A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
type: datablock
alternative label: 2KQO
link to mmcif: 2KQO.cif.gz
link to pdbml: 2KQO.xml.gz
link to pdbml noatom: 2KQO-noatom.xml.gz
link to pdbml extatom: 2KQO-extatom.xml.gz
link to doi: doi:10.2210/pdb2KQO/pdb
datablock name: 2KQO-noatom
has atom sites category: atom sitesCategory
has atom type category: atom typeCategory
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has chem comp atom category: chem comp atomCategory
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has citation category: citationCategory
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2KQO
type: atom sites
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to entry: 2KQO
atom sites.entry id: 2KQO
atom sites.fract transf matrix11: 1
atom sites.fract transf matrix12: 0
atom sites.fract transf matrix13: 0
atom sites.fract transf matrix21: 0
atom sites.fract transf matrix22: 1
atom sites.fract transf matrix23: 0
atom sites.fract transf matrix31: 0
atom sites.fract transf matrix32: 0
atom sites.fract transf matrix33: 1
atom sites.fract transf vector1: 0
atom sites.fract transf vector2: 0
atom sites.fract transf vector3: 0

2KQO
referenced by atom sites: 2KQO
type: entry
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
entry.id: 2KQO
referenced by exptl: 2KQO,SOLUTION NMR
referenced by struct: 2KQO
referenced by struct keywords: 2KQO
referenced by pdbx database status: 2KQO
referenced by pdbx nmr ensemble: 2KQO
referenced by pdbx nmr representative: 2KQO
referenced by pdbx nmr refine: 2KQO,1

http://rdf.wwpdb.org/pdb/2KQO/atom_type/C
type: atom type
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
atom type.symbol: C

http://rdf.wwpdb.org/pdb/2KQO/atom_type/H
type: atom type
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
atom type.symbol: H

http://rdf.wwpdb.org/pdb/2KQO/atom_type/N
type: atom type
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
atom type.symbol: N

http://rdf.wwpdb.org/pdb/2KQO/atom_type/O
type: atom type
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
atom type.symbol: O

http://rdf.wwpdb.org/pdb/2KQO/audit_author/1
type: audit author
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
audit author.pdbx ordinal: 1
audit author.name: Sattelle, B.M.

http://rdf.wwpdb.org/pdb/2KQO/audit_author/2
type: audit author
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
audit author.pdbx ordinal: 2
audit author.name: Shakeri, J.

http://rdf.wwpdb.org/pdb/2KQO/audit_author/3
type: audit author
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
audit author.pdbx ordinal: 3
audit author.name: Roberts, I.S.

http://rdf.wwpdb.org/pdb/2KQO/audit_author/4
type: audit author
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
audit author.pdbx ordinal: 4
audit author.name: Almond, A.

mmcif pdbx.dic,5.391
type: audit conform
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
audit conform.dict name: mmcif_pdbx.dic
audit conform.dict version: 5.391
audit conform.dict location: http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic

BDP
type: chem comp
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
chem comp.id: BDP
chem comp.formula: C6 H10 O7
chem comp.formula weight: 194.139
chem comp.name: beta-D-glucopyranuronic acid
chem comp.pdbx synonyms: beta-D-glucuronic acid; D-glucuronic acid; glucuronic acid
chem comp.type: D-saccharide, beta linking
link to chem comp: BDP
referenced by chem comp atom: HO6B,BDP
referenced by chem comp bond: O6B,HO6B,BDP
referenced by pdbx chem comp identifier: BDP,GMML,1.0,SNFG CARBOHYDRATE SYMBOL
referenced by pdbx entity branch list: BDP,1,6
referenced by chem comp atom: C1,BDP
referenced by chem comp atom: C2,BDP
referenced by chem comp atom: C3,BDP
referenced by chem comp atom: C4,BDP
referenced by chem comp atom: C5,BDP
referenced by chem comp atom: C6,BDP
referenced by chem comp atom: O2,BDP
referenced by chem comp atom: O3,BDP
referenced by chem comp atom: O4,BDP
referenced by chem comp atom: O5,BDP
referenced by chem comp atom: O6A,BDP
referenced by chem comp atom: O1,BDP
referenced by chem comp atom: O6B,BDP
referenced by chem comp atom: H1,BDP
referenced by chem comp atom: H2,BDP
referenced by chem comp atom: H3,BDP
referenced by chem comp atom: H4,BDP
referenced by chem comp atom: H5,BDP
referenced by chem comp atom: HO2,BDP
referenced by chem comp atom: HO3,BDP
referenced by chem comp atom: HO4,BDP
referenced by chem comp atom: HO1,BDP
referenced by chem comp bond: C1,C2,BDP
referenced by chem comp bond: C1,O5,BDP
referenced by chem comp bond: C1,O1,BDP
referenced by chem comp bond: C1,H1,BDP
referenced by chem comp bond: C2,C3,BDP
referenced by chem comp bond: C2,O2,BDP
referenced by chem comp bond: C2,H2,BDP
referenced by chem comp bond: C3,C4,BDP
referenced by chem comp bond: C3,O3,BDP
referenced by chem comp bond: C3,H3,BDP
referenced by chem comp bond: C4,C5,BDP
referenced by chem comp bond: C4,O4,BDP
referenced by chem comp bond: C4,H4,BDP
referenced by chem comp bond: C5,C6,BDP
referenced by chem comp bond: C5,O5,BDP
referenced by chem comp bond: C5,H5,BDP
referenced by chem comp bond: C6,O6A,BDP
referenced by chem comp bond: C6,O6B,BDP
referenced by chem comp bond: O2,HO2,BDP
referenced by chem comp bond: O3,HO3,BDP
referenced by chem comp bond: O4,HO4,BDP
referenced by chem comp bond: O1,HO1,BDP
referenced by pdbx chem comp identifier: BDP,GMML,1.0,CONDENSED IUPAC CARBOHYDRATE SYMBOL
referenced by pdbx chem comp identifier: BDP,GMML,1.0,COMMON NAME
referenced by pdbx chem comp identifier: BDP,PDB-CARE,1.0,IUPAC CARBOHYDRATE SYMBOL
referenced by pdbx entity branch list: BDP,1,2
referenced by pdbx entity branch list: BDP,1,4

NGA
type: chem comp
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
chem comp.id: NGA
chem comp.formula: C8 H15 N O6
chem comp.formula weight: 221.208
chem comp.name: 2-acetamido-2-deoxy-beta-D-galactopyranose
chem comp.pdbx synonyms: N-acetyl-beta-D-galactosamine; 2-acetamido-2-deoxy-beta-D-galactose; 2-acetamido-2-deoxy-D-galactose; 2-acetamido-2-deoxy-galactose; N-ACETYL-D-GALACTOSAMINE
chem comp.type: D-saccharide, beta linking
link to chem comp: NGA
referenced by chem comp atom: HO6,NGA
referenced by chem comp bond: O6,HO6,NGA
referenced by pdbx chem comp identifier: NGA,GMML,1.0,SNFG CARBOHYDRATE SYMBOL
referenced by pdbx entity branch list: NGA,1,5
referenced by chem comp atom: C1,NGA
referenced by chem comp atom: C2,NGA
referenced by chem comp atom: C3,NGA
referenced by chem comp atom: C4,NGA
referenced by chem comp atom: C5,NGA
referenced by chem comp atom: C6,NGA
referenced by chem comp atom: C7,NGA
referenced by chem comp atom: C8,NGA
referenced by chem comp atom: N2,NGA
referenced by chem comp atom: O1,NGA
referenced by chem comp atom: O3,NGA
referenced by chem comp atom: O4,NGA
referenced by chem comp atom: O5,NGA
referenced by chem comp atom: O6,NGA
referenced by chem comp atom: O7,NGA
referenced by chem comp atom: H1,NGA
referenced by chem comp atom: H2,NGA
referenced by chem comp atom: H3,NGA
referenced by chem comp atom: H4,NGA
referenced by chem comp atom: H5,NGA
referenced by chem comp atom: H61,NGA
referenced by chem comp atom: H62,NGA
referenced by chem comp atom: H81,NGA
referenced by chem comp atom: H82,NGA
referenced by chem comp atom: H83,NGA
referenced by chem comp atom: HN2,NGA
referenced by chem comp atom: HO1,NGA
referenced by chem comp atom: HO3,NGA
referenced by chem comp atom: HO4,NGA
referenced by chem comp bond: C1,C2,NGA
referenced by chem comp bond: C1,O1,NGA
referenced by chem comp bond: C1,O5,NGA
referenced by chem comp bond: C1,H1,NGA
referenced by chem comp bond: C2,C3,NGA
referenced by chem comp bond: C2,N2,NGA
referenced by chem comp bond: C2,H2,NGA
referenced by chem comp bond: C3,C4,NGA
referenced by chem comp bond: C3,O3,NGA
referenced by chem comp bond: C3,H3,NGA
referenced by chem comp bond: C4,C5,NGA
referenced by chem comp bond: C4,O4,NGA
referenced by chem comp bond: C4,H4,NGA
referenced by chem comp bond: C5,C6,NGA
referenced by chem comp bond: C5,O5,NGA
referenced by chem comp bond: C5,H5,NGA
referenced by chem comp bond: C6,O6,NGA
referenced by chem comp bond: C6,H61,NGA
referenced by chem comp bond: C6,H62,NGA
referenced by chem comp bond: C7,C8,NGA
referenced by chem comp bond: C7,N2,NGA
referenced by chem comp bond: C7,O7,NGA
referenced by chem comp bond: C8,H81,NGA
referenced by chem comp bond: C8,H82,NGA
referenced by chem comp bond: C8,H83,NGA
referenced by chem comp bond: N2,HN2,NGA
referenced by chem comp bond: O1,HO1,NGA
referenced by chem comp bond: O3,HO3,NGA
referenced by chem comp bond: O4,HO4,NGA
referenced by pdbx chem comp identifier: NGA,GMML,1.0,CONDENSED IUPAC CARBOHYDRATE SYMBOL
referenced by pdbx chem comp identifier: NGA,GMML,1.0,COMMON NAME
referenced by pdbx chem comp identifier: NGA,PDB-CARE,1.0,IUPAC CARBOHYDRATE SYMBOL
referenced by pdbx entity branch list: NGA,1,1
referenced by pdbx entity branch list: NGA,1,3

C1,BDP
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: BDP
chem comp atom.atom id: C1
chem comp atom.comp id: BDP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 1
chem comp atom.pdbx stereo config: R
chem comp atom.type symbol: C
referenced by chem comp bond: C1,H1,BDP
referenced by chem comp bond: C1,C2,BDP
referenced by chem comp bond: C1,O5,BDP
referenced by chem comp bond: C1,O1,BDP

C2,BDP
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: BDP
chem comp atom.atom id: C2
chem comp atom.comp id: BDP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 2
chem comp atom.pdbx stereo config: R
chem comp atom.type symbol: C
referenced by chem comp bond: C2,H2,BDP
referenced by chem comp bond: C1,C2,BDP
referenced by chem comp bond: C2,C3,BDP
referenced by chem comp bond: C2,O2,BDP

C3,BDP
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: BDP
chem comp atom.atom id: C3
chem comp atom.comp id: BDP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 3
chem comp atom.pdbx stereo config: S
chem comp atom.type symbol: C
referenced by chem comp bond: C3,H3,BDP
referenced by chem comp bond: C2,C3,BDP
referenced by chem comp bond: C3,C4,BDP
referenced by chem comp bond: C3,O3,BDP

C4,BDP
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: BDP
chem comp atom.atom id: C4
chem comp atom.comp id: BDP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 4
chem comp atom.pdbx stereo config: S
chem comp atom.type symbol: C
referenced by chem comp bond: C4,H4,BDP
referenced by chem comp bond: C3,C4,BDP
referenced by chem comp bond: C4,C5,BDP
referenced by chem comp bond: C4,O4,BDP

C5,BDP
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: BDP
chem comp atom.atom id: C5
chem comp atom.comp id: BDP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 5
chem comp atom.pdbx stereo config: S
chem comp atom.type symbol: C
referenced by chem comp bond: C5,H5,BDP
referenced by chem comp bond: C4,C5,BDP
referenced by chem comp bond: C5,C6,BDP
referenced by chem comp bond: C5,O5,BDP

C6,BDP
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: BDP
chem comp atom.atom id: C6
chem comp atom.comp id: BDP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 6
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: C6,O6B,BDP
referenced by chem comp bond: C5,C6,BDP
referenced by chem comp bond: C6,O6A,BDP

O2,BDP
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: BDP
chem comp atom.atom id: O2
chem comp atom.comp id: BDP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 7
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O
referenced by chem comp bond: O2,HO2,BDP
referenced by chem comp bond: C2,O2,BDP

O3,BDP
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: BDP
chem comp atom.atom id: O3
chem comp atom.comp id: BDP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 8
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O
referenced by chem comp bond: O3,HO3,BDP
referenced by chem comp bond: C3,O3,BDP

O4,BDP
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: BDP
chem comp atom.atom id: O4
chem comp atom.comp id: BDP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 9
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O
referenced by chem comp bond: O4,HO4,BDP
referenced by chem comp bond: C4,O4,BDP

O5,BDP
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: BDP
chem comp atom.atom id: O5
chem comp atom.comp id: BDP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 10
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O
referenced by chem comp bond: C5,O5,BDP
referenced by chem comp bond: C1,O5,BDP

O6A,BDP
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: BDP
chem comp atom.atom id: O6A
chem comp atom.comp id: BDP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 11
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O
referenced by chem comp bond: C6,O6A,BDP

O1,BDP
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: BDP
chem comp atom.atom id: O1
chem comp atom.comp id: BDP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 12
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O
referenced by chem comp bond: O1,HO1,BDP
referenced by chem comp bond: C1,O1,BDP

O6B,BDP
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: BDP
chem comp atom.atom id: O6B
chem comp atom.comp id: BDP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 13
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O
referenced by chem comp bond: O6B,HO6B,BDP
referenced by chem comp bond: C6,O6B,BDP

H1,BDP
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: BDP
chem comp atom.atom id: H1
chem comp atom.comp id: BDP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 14
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: C1,H1,BDP

H2,BDP
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: BDP
chem comp atom.atom id: H2
chem comp atom.comp id: BDP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 15
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: C2,H2,BDP

H3,BDP
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: BDP
chem comp atom.atom id: H3
chem comp atom.comp id: BDP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 16
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: C3,H3,BDP

H4,BDP
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: BDP
chem comp atom.atom id: H4
chem comp atom.comp id: BDP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 17
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: C4,H4,BDP

H5,BDP
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: BDP
chem comp atom.atom id: H5
chem comp atom.comp id: BDP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 18
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: C5,H5,BDP

HO2,BDP
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: BDP
chem comp atom.atom id: HO2
chem comp atom.comp id: BDP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 19
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: O2,HO2,BDP

HO3,BDP
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: BDP
chem comp atom.atom id: HO3
chem comp atom.comp id: BDP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 20
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: O3,HO3,BDP

HO4,BDP
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: BDP
chem comp atom.atom id: HO4
chem comp atom.comp id: BDP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 21
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: O4,HO4,BDP

HO1,BDP
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: BDP
chem comp atom.atom id: HO1
chem comp atom.comp id: BDP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 22
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: O1,HO1,BDP

HO6B,BDP
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: BDP
chem comp atom.atom id: HO6B
chem comp atom.comp id: BDP
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 23
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: O6B,HO6B,BDP

C1,NGA
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: NGA
chem comp atom.atom id: C1
chem comp atom.comp id: NGA
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 24
chem comp atom.pdbx stereo config: R
chem comp atom.type symbol: C
referenced by chem comp bond: C1,H1,NGA
referenced by chem comp bond: C1,C2,NGA
referenced by chem comp bond: C1,O1,NGA
referenced by chem comp bond: C1,O5,NGA

C2,NGA
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: NGA
chem comp atom.atom id: C2
chem comp atom.comp id: NGA
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 25
chem comp atom.pdbx stereo config: R
chem comp atom.type symbol: C
referenced by chem comp bond: C2,H2,NGA
referenced by chem comp bond: C1,C2,NGA
referenced by chem comp bond: C2,C3,NGA
referenced by chem comp bond: C2,N2,NGA

C3,NGA
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: NGA
chem comp atom.atom id: C3
chem comp atom.comp id: NGA
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 26
chem comp atom.pdbx stereo config: R
chem comp atom.type symbol: C
referenced by chem comp bond: C3,H3,NGA
referenced by chem comp bond: C2,C3,NGA
referenced by chem comp bond: C3,C4,NGA
referenced by chem comp bond: C3,O3,NGA

C4,NGA
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: NGA
chem comp atom.atom id: C4
chem comp atom.comp id: NGA
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 27
chem comp atom.pdbx stereo config: R
chem comp atom.type symbol: C
referenced by chem comp bond: C4,H4,NGA
referenced by chem comp bond: C3,C4,NGA
referenced by chem comp bond: C4,C5,NGA
referenced by chem comp bond: C4,O4,NGA

C5,NGA
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: NGA
chem comp atom.atom id: C5
chem comp atom.comp id: NGA
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 28
chem comp atom.pdbx stereo config: R
chem comp atom.type symbol: C
referenced by chem comp bond: C5,H5,NGA
referenced by chem comp bond: C4,C5,NGA
referenced by chem comp bond: C5,C6,NGA
referenced by chem comp bond: C5,O5,NGA

C6,NGA
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: NGA
chem comp atom.atom id: C6
chem comp atom.comp id: NGA
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 29
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: C6,H62,NGA
referenced by chem comp bond: C5,C6,NGA
referenced by chem comp bond: C6,O6,NGA
referenced by chem comp bond: C6,H61,NGA

C7,NGA
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: NGA
chem comp atom.atom id: C7
chem comp atom.comp id: NGA
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 30
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: C7,O7,NGA
referenced by chem comp bond: C7,C8,NGA
referenced by chem comp bond: C7,N2,NGA

C8,NGA
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: NGA
chem comp atom.atom id: C8
chem comp atom.comp id: NGA
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 31
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: C
referenced by chem comp bond: C8,H83,NGA
referenced by chem comp bond: C7,C8,NGA
referenced by chem comp bond: C8,H81,NGA
referenced by chem comp bond: C8,H82,NGA

N2,NGA
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: NGA
chem comp atom.atom id: N2
chem comp atom.comp id: NGA
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 32
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: N
referenced by chem comp bond: N2,HN2,NGA
referenced by chem comp bond: C7,N2,NGA
referenced by chem comp bond: C2,N2,NGA

O1,NGA
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: NGA
chem comp atom.atom id: O1
chem comp atom.comp id: NGA
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 33
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O
referenced by chem comp bond: O1,HO1,NGA
referenced by chem comp bond: C1,O1,NGA

O3,NGA
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: NGA
chem comp atom.atom id: O3
chem comp atom.comp id: NGA
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 34
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O
referenced by chem comp bond: O3,HO3,NGA
referenced by chem comp bond: C3,O3,NGA

O4,NGA
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: NGA
chem comp atom.atom id: O4
chem comp atom.comp id: NGA
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 35
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O
referenced by chem comp bond: O4,HO4,NGA
referenced by chem comp bond: C4,O4,NGA

O5,NGA
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: NGA
chem comp atom.atom id: O5
chem comp atom.comp id: NGA
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 36
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O
referenced by chem comp bond: C5,O5,NGA
referenced by chem comp bond: C1,O5,NGA

O6,NGA
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: NGA
chem comp atom.atom id: O6
chem comp atom.comp id: NGA
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 37
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O
referenced by chem comp bond: O6,HO6,NGA
referenced by chem comp bond: C6,O6,NGA

O7,NGA
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: NGA
chem comp atom.atom id: O7
chem comp atom.comp id: NGA
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 38
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: O
referenced by chem comp bond: C7,O7,NGA

H1,NGA
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: NGA
chem comp atom.atom id: H1
chem comp atom.comp id: NGA
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 39
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: C1,H1,NGA

H2,NGA
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: NGA
chem comp atom.atom id: H2
chem comp atom.comp id: NGA
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 40
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: C2,H2,NGA

H3,NGA
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: NGA
chem comp atom.atom id: H3
chem comp atom.comp id: NGA
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 41
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: C3,H3,NGA

H4,NGA
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: NGA
chem comp atom.atom id: H4
chem comp atom.comp id: NGA
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 42
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: C4,H4,NGA

H5,NGA
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: NGA
chem comp atom.atom id: H5
chem comp atom.comp id: NGA
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 43
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: C5,H5,NGA

H61,NGA
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: NGA
chem comp atom.atom id: H61
chem comp atom.comp id: NGA
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 44
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: C6,H61,NGA

H62,NGA
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: NGA
chem comp atom.atom id: H62
chem comp atom.comp id: NGA
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 45
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: C6,H62,NGA

H81,NGA
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: NGA
chem comp atom.atom id: H81
chem comp atom.comp id: NGA
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 46
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: C8,H81,NGA

H82,NGA
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: NGA
chem comp atom.atom id: H82
chem comp atom.comp id: NGA
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 47
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: C8,H82,NGA

H83,NGA
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: NGA
chem comp atom.atom id: H83
chem comp atom.comp id: NGA
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 48
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: C8,H83,NGA

HN2,NGA
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: NGA
chem comp atom.atom id: HN2
chem comp atom.comp id: NGA
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 49
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: N2,HN2,NGA

HO1,NGA
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: NGA
chem comp atom.atom id: HO1
chem comp atom.comp id: NGA
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 50
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: O1,HO1,NGA

HO3,NGA
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: NGA
chem comp atom.atom id: HO3
chem comp atom.comp id: NGA
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 51
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: O3,HO3,NGA

HO4,NGA
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: NGA
chem comp atom.atom id: HO4
chem comp atom.comp id: NGA
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 52
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: O4,HO4,NGA

HO6,NGA
type: chem comp atom
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: NGA
chem comp atom.atom id: HO6
chem comp atom.comp id: NGA
chem comp atom.pdbx aromatic flag: N
chem comp atom.pdbx ordinal: 53
chem comp atom.pdbx stereo config: N
chem comp atom.type symbol: H
referenced by chem comp bond: O6,HO6,NGA

C1,C2,BDP
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C1,BDP
reference to chem comp atom: C2,BDP
reference to chem comp: BDP
chem comp bond.atom id 1: C1
chem comp bond.atom id 2: C2
chem comp bond.comp id: BDP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 1
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C1,O5,BDP
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C1,BDP
reference to chem comp atom: O5,BDP
reference to chem comp: BDP
chem comp bond.atom id 1: C1
chem comp bond.atom id 2: O5
chem comp bond.comp id: BDP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 2
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C1,O1,BDP
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C1,BDP
reference to chem comp atom: O1,BDP
reference to chem comp: BDP
chem comp bond.atom id 1: C1
chem comp bond.atom id 2: O1
chem comp bond.comp id: BDP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 3
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C1,H1,BDP
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C1,BDP
reference to chem comp atom: H1,BDP
reference to chem comp: BDP
chem comp bond.atom id 1: C1
chem comp bond.atom id 2: H1
chem comp bond.comp id: BDP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 4
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C2,C3,BDP
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C2,BDP
reference to chem comp atom: C3,BDP
reference to chem comp: BDP
chem comp bond.atom id 1: C2
chem comp bond.atom id 2: C3
chem comp bond.comp id: BDP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 5
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C2,O2,BDP
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C2,BDP
reference to chem comp atom: O2,BDP
reference to chem comp: BDP
chem comp bond.atom id 1: C2
chem comp bond.atom id 2: O2
chem comp bond.comp id: BDP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 6
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C2,H2,BDP
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C2,BDP
reference to chem comp atom: H2,BDP
reference to chem comp: BDP
chem comp bond.atom id 1: C2
chem comp bond.atom id 2: H2
chem comp bond.comp id: BDP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 7
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C3,C4,BDP
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C3,BDP
reference to chem comp atom: C4,BDP
reference to chem comp: BDP
chem comp bond.atom id 1: C3
chem comp bond.atom id 2: C4
chem comp bond.comp id: BDP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 8
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C3,O3,BDP
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C3,BDP
reference to chem comp atom: O3,BDP
reference to chem comp: BDP
chem comp bond.atom id 1: C3
chem comp bond.atom id 2: O3
chem comp bond.comp id: BDP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 9
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C3,H3,BDP
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C3,BDP
reference to chem comp atom: H3,BDP
reference to chem comp: BDP
chem comp bond.atom id 1: C3
chem comp bond.atom id 2: H3
chem comp bond.comp id: BDP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 10
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C4,C5,BDP
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C4,BDP
reference to chem comp atom: C5,BDP
reference to chem comp: BDP
chem comp bond.atom id 1: C4
chem comp bond.atom id 2: C5
chem comp bond.comp id: BDP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 11
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C4,O4,BDP
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C4,BDP
reference to chem comp atom: O4,BDP
reference to chem comp: BDP
chem comp bond.atom id 1: C4
chem comp bond.atom id 2: O4
chem comp bond.comp id: BDP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 12
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C4,H4,BDP
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C4,BDP
reference to chem comp atom: H4,BDP
reference to chem comp: BDP
chem comp bond.atom id 1: C4
chem comp bond.atom id 2: H4
chem comp bond.comp id: BDP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 13
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C5,C6,BDP
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C5,BDP
reference to chem comp atom: C6,BDP
reference to chem comp: BDP
chem comp bond.atom id 1: C5
chem comp bond.atom id 2: C6
chem comp bond.comp id: BDP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 14
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C5,O5,BDP
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C5,BDP
reference to chem comp atom: O5,BDP
reference to chem comp: BDP
chem comp bond.atom id 1: C5
chem comp bond.atom id 2: O5
chem comp bond.comp id: BDP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 15
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C5,H5,BDP
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C5,BDP
reference to chem comp atom: H5,BDP
reference to chem comp: BDP
chem comp bond.atom id 1: C5
chem comp bond.atom id 2: H5
chem comp bond.comp id: BDP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 16
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C6,O6A,BDP
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C6,BDP
reference to chem comp atom: O6A,BDP
reference to chem comp: BDP
chem comp bond.atom id 1: C6
chem comp bond.atom id 2: O6A
chem comp bond.comp id: BDP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 17
chem comp bond.pdbx stereo config: N
chem comp bond.value order: doub

C6,O6B,BDP
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C6,BDP
reference to chem comp atom: O6B,BDP
reference to chem comp: BDP
chem comp bond.atom id 1: C6
chem comp bond.atom id 2: O6B
chem comp bond.comp id: BDP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 18
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

O2,HO2,BDP
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: O2,BDP
reference to chem comp atom: HO2,BDP
reference to chem comp: BDP
chem comp bond.atom id 1: O2
chem comp bond.atom id 2: HO2
chem comp bond.comp id: BDP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 19
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

O3,HO3,BDP
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: O3,BDP
reference to chem comp atom: HO3,BDP
reference to chem comp: BDP
chem comp bond.atom id 1: O3
chem comp bond.atom id 2: HO3
chem comp bond.comp id: BDP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 20
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

O4,HO4,BDP
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: O4,BDP
reference to chem comp atom: HO4,BDP
reference to chem comp: BDP
chem comp bond.atom id 1: O4
chem comp bond.atom id 2: HO4
chem comp bond.comp id: BDP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 21
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

O1,HO1,BDP
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: O1,BDP
reference to chem comp atom: HO1,BDP
reference to chem comp: BDP
chem comp bond.atom id 1: O1
chem comp bond.atom id 2: HO1
chem comp bond.comp id: BDP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 22
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

O6B,HO6B,BDP
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: O6B,BDP
reference to chem comp atom: HO6B,BDP
reference to chem comp: BDP
chem comp bond.atom id 1: O6B
chem comp bond.atom id 2: HO6B
chem comp bond.comp id: BDP
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 23
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C1,C2,NGA
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C1,NGA
reference to chem comp atom: C2,NGA
reference to chem comp: NGA
chem comp bond.atom id 1: C1
chem comp bond.atom id 2: C2
chem comp bond.comp id: NGA
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 24
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C1,O1,NGA
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C1,NGA
reference to chem comp atom: O1,NGA
reference to chem comp: NGA
chem comp bond.atom id 1: C1
chem comp bond.atom id 2: O1
chem comp bond.comp id: NGA
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 25
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C1,O5,NGA
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C1,NGA
reference to chem comp atom: O5,NGA
reference to chem comp: NGA
chem comp bond.atom id 1: C1
chem comp bond.atom id 2: O5
chem comp bond.comp id: NGA
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 26
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C1,H1,NGA
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C1,NGA
reference to chem comp atom: H1,NGA
reference to chem comp: NGA
chem comp bond.atom id 1: C1
chem comp bond.atom id 2: H1
chem comp bond.comp id: NGA
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 27
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C2,C3,NGA
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C2,NGA
reference to chem comp atom: C3,NGA
reference to chem comp: NGA
chem comp bond.atom id 1: C2
chem comp bond.atom id 2: C3
chem comp bond.comp id: NGA
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 28
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C2,N2,NGA
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C2,NGA
reference to chem comp atom: N2,NGA
reference to chem comp: NGA
chem comp bond.atom id 1: C2
chem comp bond.atom id 2: N2
chem comp bond.comp id: NGA
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 29
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C2,H2,NGA
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C2,NGA
reference to chem comp atom: H2,NGA
reference to chem comp: NGA
chem comp bond.atom id 1: C2
chem comp bond.atom id 2: H2
chem comp bond.comp id: NGA
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 30
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C3,C4,NGA
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C3,NGA
reference to chem comp atom: C4,NGA
reference to chem comp: NGA
chem comp bond.atom id 1: C3
chem comp bond.atom id 2: C4
chem comp bond.comp id: NGA
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 31
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C3,O3,NGA
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C3,NGA
reference to chem comp atom: O3,NGA
reference to chem comp: NGA
chem comp bond.atom id 1: C3
chem comp bond.atom id 2: O3
chem comp bond.comp id: NGA
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 32
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C3,H3,NGA
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C3,NGA
reference to chem comp atom: H3,NGA
reference to chem comp: NGA
chem comp bond.atom id 1: C3
chem comp bond.atom id 2: H3
chem comp bond.comp id: NGA
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 33
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C4,C5,NGA
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C4,NGA
reference to chem comp atom: C5,NGA
reference to chem comp: NGA
chem comp bond.atom id 1: C4
chem comp bond.atom id 2: C5
chem comp bond.comp id: NGA
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 34
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C4,O4,NGA
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C4,NGA
reference to chem comp atom: O4,NGA
reference to chem comp: NGA
chem comp bond.atom id 1: C4
chem comp bond.atom id 2: O4
chem comp bond.comp id: NGA
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 35
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C4,H4,NGA
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C4,NGA
reference to chem comp atom: H4,NGA
reference to chem comp: NGA
chem comp bond.atom id 1: C4
chem comp bond.atom id 2: H4
chem comp bond.comp id: NGA
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 36
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C5,C6,NGA
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C5,NGA
reference to chem comp atom: C6,NGA
reference to chem comp: NGA
chem comp bond.atom id 1: C5
chem comp bond.atom id 2: C6
chem comp bond.comp id: NGA
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 37
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C5,O5,NGA
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C5,NGA
reference to chem comp atom: O5,NGA
reference to chem comp: NGA
chem comp bond.atom id 1: C5
chem comp bond.atom id 2: O5
chem comp bond.comp id: NGA
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 38
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C5,H5,NGA
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C5,NGA
reference to chem comp atom: H5,NGA
reference to chem comp: NGA
chem comp bond.atom id 1: C5
chem comp bond.atom id 2: H5
chem comp bond.comp id: NGA
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 39
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C6,O6,NGA
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C6,NGA
reference to chem comp atom: O6,NGA
reference to chem comp: NGA
chem comp bond.atom id 1: C6
chem comp bond.atom id 2: O6
chem comp bond.comp id: NGA
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 40
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C6,H61,NGA
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C6,NGA
reference to chem comp atom: H61,NGA
reference to chem comp: NGA
chem comp bond.atom id 1: C6
chem comp bond.atom id 2: H61
chem comp bond.comp id: NGA
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 41
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C6,H62,NGA
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C6,NGA
reference to chem comp atom: H62,NGA
reference to chem comp: NGA
chem comp bond.atom id 1: C6
chem comp bond.atom id 2: H62
chem comp bond.comp id: NGA
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 42
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C7,C8,NGA
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C7,NGA
reference to chem comp atom: C8,NGA
reference to chem comp: NGA
chem comp bond.atom id 1: C7
chem comp bond.atom id 2: C8
chem comp bond.comp id: NGA
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 43
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C7,N2,NGA
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C7,NGA
reference to chem comp atom: N2,NGA
reference to chem comp: NGA
chem comp bond.atom id 1: C7
chem comp bond.atom id 2: N2
chem comp bond.comp id: NGA
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 44
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C7,O7,NGA
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C7,NGA
reference to chem comp atom: O7,NGA
reference to chem comp: NGA
chem comp bond.atom id 1: C7
chem comp bond.atom id 2: O7
chem comp bond.comp id: NGA
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 45
chem comp bond.pdbx stereo config: N
chem comp bond.value order: doub

C8,H81,NGA
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C8,NGA
reference to chem comp atom: H81,NGA
reference to chem comp: NGA
chem comp bond.atom id 1: C8
chem comp bond.atom id 2: H81
chem comp bond.comp id: NGA
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 46
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C8,H82,NGA
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C8,NGA
reference to chem comp atom: H82,NGA
reference to chem comp: NGA
chem comp bond.atom id 1: C8
chem comp bond.atom id 2: H82
chem comp bond.comp id: NGA
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 47
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

C8,H83,NGA
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: C8,NGA
reference to chem comp atom: H83,NGA
reference to chem comp: NGA
chem comp bond.atom id 1: C8
chem comp bond.atom id 2: H83
chem comp bond.comp id: NGA
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 48
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

N2,HN2,NGA
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: N2,NGA
reference to chem comp atom: HN2,NGA
reference to chem comp: NGA
chem comp bond.atom id 1: N2
chem comp bond.atom id 2: HN2
chem comp bond.comp id: NGA
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 49
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

O1,HO1,NGA
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: O1,NGA
reference to chem comp atom: HO1,NGA
reference to chem comp: NGA
chem comp bond.atom id 1: O1
chem comp bond.atom id 2: HO1
chem comp bond.comp id: NGA
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 50
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

O3,HO3,NGA
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: O3,NGA
reference to chem comp atom: HO3,NGA
reference to chem comp: NGA
chem comp bond.atom id 1: O3
chem comp bond.atom id 2: HO3
chem comp bond.comp id: NGA
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 51
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

O4,HO4,NGA
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: O4,NGA
reference to chem comp atom: HO4,NGA
reference to chem comp: NGA
chem comp bond.atom id 1: O4
chem comp bond.atom id 2: HO4
chem comp bond.comp id: NGA
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 52
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

O6,HO6,NGA
type: chem comp bond
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp atom: O6,NGA
reference to chem comp atom: HO6,NGA
reference to chem comp: NGA
chem comp bond.atom id 1: O6
chem comp bond.atom id 2: HO6
chem comp bond.comp id: NGA
chem comp bond.pdbx aromatic flag: N
chem comp bond.pdbx ordinal: 53
chem comp bond.pdbx stereo config: N
chem comp bond.value order: sing

primary
type: citation
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
citation.id: primary
citation.country: NE
citation.journal abbrev: Carbohydr.Res.
citation.journal id ASTM: CRBRAT
citation.journal id CSD: 0156
citation.journal id ISSN: 0008-6215
citation.journal volume: 345
citation.page first: 291
citation.page last: 302
citation.pdbx database id DOI: 10.1016/j.carres.2009.11.013
citation.pdbx database id pub med: 20022001
citation.title: A 3D-structural model of unsulfated chondroitin from high-field NMR: 4-sulfation has little effect on backbone conformation.
citation.year: 2010
link to doi: doi:10.1016/j.carres.2009.11.013
link to pubmed: pubmed:20022001
references: pubmed:20022001
referenced by citation author: primary,Almond, A.,4
referenced by citation author: primary,Sattelle, B.M.,1
referenced by citation author: primary,Shakeri, J.,2
referenced by citation author: primary,Roberts, I.S.,3

primary,Sattelle, B.M.,1
type: citation author
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to citation: primary
citation author.citation id: primary
citation author.name: Sattelle, B.M.
citation author.ordinal: 1

primary,Shakeri, J.,2
type: citation author
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to citation: primary
citation author.citation id: primary
citation author.name: Shakeri, J.
citation author.ordinal: 2

primary,Roberts, I.S.,3
type: citation author
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to citation: primary
citation author.citation id: primary
citation author.name: Roberts, I.S.
citation author.ordinal: 3

primary,Almond, A.,4
type: citation author
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to citation: primary
citation author.citation id: primary
citation author.name: Almond, A.
citation author.ordinal: 4

2KQO,PDB
type: database 2
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
database 2.database code: 2KQO
database 2.database id: PDB
database 2.pdbx DOI: 10.2210/pdb2kqo/pdb
database 2.pdbx database accession: pdb_00002kqo

RCSB101453,RCSB
type: database 2
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
database 2.database code: RCSB101453
database 2.database id: RCSB

D 1000101453,WWPDB
type: database 2
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
database 2.database code: D_1000101453
database 2.database id: WWPDB

http://rdf.wwpdb.org/pdb/2KQO/entity/1
type: entity
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
entity.id: 1
entity.formula weight: 1155.965
entity.pdbx description: beta-D-glucopyranuronic acid-(1-3)-2-acetamido-2-deoxy-beta-D-galactopyranose-(1-4)-beta-D-glucopyranuronic acid-(1-3)-2-acetamido-2-deoxy-beta-D-galactopyranose-(1-4)-beta-D-glucopyranuronic acid-(1-3)-2-acetamido-2-deoxy-beta-D-galactopyranose
entity.pdbx number of molecules: 1
entity.src method: man
entity.type: branched
referenced by struct asym: http://rdf.wwpdb.org/pdb/2KQO/struct_asym/A
referenced by pdbx entity branch descriptor: http://rdf.wwpdb.org/pdb/2KQO/pdbx_entity_branch_descriptor/3
referenced by pdbx entity branch list: BDP,1,6
referenced by pdbx entity branch: http://rdf.wwpdb.org/pdb/2KQO/pdbx_entity_branch/1
referenced by pdbx branch scheme: A,1,BDP,6
referenced by pdbx branch scheme: A,1,NGA,1
referenced by pdbx branch scheme: A,1,BDP,2
referenced by pdbx branch scheme: A,1,NGA,3
referenced by pdbx branch scheme: A,1,BDP,4
referenced by pdbx branch scheme: A,1,NGA,5
referenced by pdbx entity branch descriptor: http://rdf.wwpdb.org/pdb/2KQO/pdbx_entity_branch_descriptor/1
referenced by pdbx entity branch descriptor: http://rdf.wwpdb.org/pdb/2KQO/pdbx_entity_branch_descriptor/2
referenced by pdbx entity branch list: NGA,1,1
referenced by pdbx entity branch list: BDP,1,2
referenced by pdbx entity branch list: NGA,1,3
referenced by pdbx entity branch list: BDP,1,4
referenced by pdbx entity branch list: NGA,1,5

2KQO,SOLUTION NMR
type: exptl
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to entry: 2KQO
exptl.entry id: 2KQO
exptl.method: SOLUTION NMR

Structure model,1,3
type: pdbx audit revision category
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to pdbx audit revision history: Structure model,3
pdbx audit revision category.data content type: Structure model
pdbx audit revision category.ordinal: 1
pdbx audit revision category.revision ordinal: 3
pdbx audit revision category.category: atom_site

Structure model,3
referenced by pdbx audit revision category: Structure model,1,3
referenced by pdbx audit revision category: Structure model,2,3
referenced by pdbx audit revision category: Structure model,3,3
referenced by pdbx audit revision category: Structure model,4,3
referenced by pdbx audit revision category: Structure model,5,3
referenced by pdbx audit revision category: Structure model,6,3
referenced by pdbx audit revision category: Structure model,7,3
referenced by pdbx audit revision category: Structure model,8,3
referenced by pdbx audit revision category: Structure model,9,3
referenced by pdbx audit revision category: Structure model,10,3
referenced by pdbx audit revision category: Structure model,11,3
referenced by pdbx audit revision category: Structure model,12,3
referenced by pdbx audit revision category: Structure model,13,3
referenced by pdbx audit revision category: Structure model,14,3
referenced by pdbx audit revision category: Structure model,15,3
referenced by pdbx audit revision category: Structure model,16,3
referenced by pdbx audit revision details: Structure model,2,3
referenced by pdbx audit revision group: Structure model,3,3
referenced by pdbx audit revision group: Structure model,4,3
referenced by pdbx audit revision group: Structure model,5,3
referenced by pdbx audit revision group: Structure model,6,3
type: pdbx audit revision history
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
pdbx audit revision history.data content type: Structure model
pdbx audit revision history.ordinal: 3
pdbx audit revision history.major revision: 2
pdbx audit revision history.minor revision: 0
pdbx audit revision history.revision date: 2020-07-29
referenced by pdbx audit revision item: Structure model,12,3
referenced by pdbx audit revision item: Structure model,1,3
referenced by pdbx audit revision item: Structure model,2,3
referenced by pdbx audit revision item: Structure model,3,3
referenced by pdbx audit revision item: Structure model,4,3
referenced by pdbx audit revision item: Structure model,5,3
referenced by pdbx audit revision item: Structure model,6,3
referenced by pdbx audit revision item: Structure model,7,3
referenced by pdbx audit revision item: Structure model,8,3
referenced by pdbx audit revision item: Structure model,9,3
referenced by pdbx audit revision item: Structure model,10,3
referenced by pdbx audit revision item: Structure model,11,3

Structure model,2,3
type: pdbx audit revision category
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reference to pdbx audit revision history: Structure model,3
pdbx audit revision category.data content type: Structure model
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pdbx audit revision category.category: chem_comp

Structure model,3,3
type: pdbx audit revision category
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reference to pdbx audit revision history: Structure model,3
pdbx audit revision category.data content type: Structure model
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pdbx audit revision category.revision ordinal: 3
pdbx audit revision category.category: entity

Structure model,4,3
type: pdbx audit revision category
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reference to pdbx audit revision history: Structure model,3
pdbx audit revision category.data content type: Structure model
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pdbx audit revision category.revision ordinal: 3
pdbx audit revision category.category: pdbx_branch_scheme

Structure model,5,3
type: pdbx audit revision category
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reference to pdbx audit revision history: Structure model,3
pdbx audit revision category.data content type: Structure model
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pdbx audit revision category.revision ordinal: 3
pdbx audit revision category.category: pdbx_chem_comp_identifier

Structure model,6,3
type: pdbx audit revision category
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reference to pdbx audit revision history: Structure model,3
pdbx audit revision category.data content type: Structure model
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pdbx audit revision category.revision ordinal: 3
pdbx audit revision category.category: pdbx_entity_branch

Structure model,7,3
type: pdbx audit revision category
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reference to pdbx audit revision history: Structure model,3
pdbx audit revision category.data content type: Structure model
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pdbx audit revision category.revision ordinal: 3
pdbx audit revision category.category: pdbx_entity_branch_descriptor

Structure model,8,3
type: pdbx audit revision category
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reference to pdbx audit revision history: Structure model,3
pdbx audit revision category.data content type: Structure model
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pdbx audit revision category.revision ordinal: 3
pdbx audit revision category.category: pdbx_entity_branch_link

Structure model,9,3
type: pdbx audit revision category
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reference to pdbx audit revision history: Structure model,3
pdbx audit revision category.data content type: Structure model
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pdbx audit revision category.revision ordinal: 3
pdbx audit revision category.category: pdbx_entity_branch_list

Structure model,10,3
type: pdbx audit revision category
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reference to pdbx audit revision history: Structure model,3
pdbx audit revision category.data content type: Structure model
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pdbx audit revision category.revision ordinal: 3
pdbx audit revision category.category: pdbx_entity_nonpoly

Structure model,11,3
type: pdbx audit revision category
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reference to pdbx audit revision history: Structure model,3
pdbx audit revision category.data content type: Structure model
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pdbx audit revision category.revision ordinal: 3
pdbx audit revision category.category: pdbx_nmr_software

Structure model,12,3
type: pdbx audit revision category
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reference to pdbx audit revision history: Structure model,3
pdbx audit revision category.data content type: Structure model
pdbx audit revision category.ordinal: 12
pdbx audit revision category.revision ordinal: 3
pdbx audit revision category.category: pdbx_nmr_spectrometer

Structure model,13,3
type: pdbx audit revision category
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reference to pdbx audit revision history: Structure model,3
pdbx audit revision category.data content type: Structure model
pdbx audit revision category.ordinal: 13
pdbx audit revision category.revision ordinal: 3
pdbx audit revision category.category: pdbx_nonpoly_scheme

Structure model,14,3
type: pdbx audit revision category
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reference to pdbx audit revision history: Structure model,3
pdbx audit revision category.data content type: Structure model
pdbx audit revision category.ordinal: 14
pdbx audit revision category.revision ordinal: 3
pdbx audit revision category.category: pdbx_struct_assembly_gen

Structure model,15,3
type: pdbx audit revision category
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reference to pdbx audit revision history: Structure model,3
pdbx audit revision category.data content type: Structure model
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pdbx audit revision category.revision ordinal: 3
pdbx audit revision category.category: struct_asym

Structure model,16,3
type: pdbx audit revision category
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reference to pdbx audit revision history: Structure model,3
pdbx audit revision category.data content type: Structure model
pdbx audit revision category.ordinal: 16
pdbx audit revision category.revision ordinal: 3
pdbx audit revision category.category: struct_conn

Structure model,17,4
type: pdbx audit revision category
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reference to pdbx audit revision history: Structure model,4
pdbx audit revision category.data content type: Structure model
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pdbx audit revision category.revision ordinal: 4
pdbx audit revision category.category: chem_comp

Structure model,4
referenced by pdbx audit revision category: Structure model,17,4
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referenced by pdbx audit revision category: Structure model,19,4
referenced by pdbx audit revision category: Structure model,20,4
referenced by pdbx audit revision group: Structure model,7,4
referenced by pdbx audit revision group: Structure model,8,4
referenced by pdbx audit revision group: Structure model,9,4
type: pdbx audit revision history
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
pdbx audit revision history.data content type: Structure model
pdbx audit revision history.ordinal: 4
pdbx audit revision history.major revision: 2
pdbx audit revision history.minor revision: 1
pdbx audit revision history.revision date: 2024-05-01
referenced by pdbx audit revision item: Structure model,15,4
referenced by pdbx audit revision item: Structure model,13,4
referenced by pdbx audit revision item: Structure model,14,4

Structure model,18,4
type: pdbx audit revision category
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reference to pdbx audit revision history: Structure model,4
pdbx audit revision category.data content type: Structure model
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pdbx audit revision category.revision ordinal: 4
pdbx audit revision category.category: chem_comp_atom

Structure model,19,4
type: pdbx audit revision category
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reference to pdbx audit revision history: Structure model,4
pdbx audit revision category.data content type: Structure model
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pdbx audit revision category.revision ordinal: 4
pdbx audit revision category.category: chem_comp_bond

Structure model,20,4
type: pdbx audit revision category
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reference to pdbx audit revision history: Structure model,4
pdbx audit revision category.data content type: Structure model
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pdbx audit revision category.revision ordinal: 4
pdbx audit revision category.category: database_2

Structure model,1,1
type: pdbx audit revision details
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reference to pdbx audit revision history: Structure model,1
pdbx audit revision details.data content type: Structure model
pdbx audit revision details.ordinal: 1
pdbx audit revision details.revision ordinal: 1
pdbx audit revision details.provider: repository
pdbx audit revision details.type: Initial release

Structure model,1
referenced by pdbx audit revision details: Structure model,1,1
type: pdbx audit revision history
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
pdbx audit revision history.data content type: Structure model
pdbx audit revision history.ordinal: 1
pdbx audit revision history.major revision: 1
pdbx audit revision history.minor revision: 0
pdbx audit revision history.revision date: 2009-12-01

Structure model,2,3
type: pdbx audit revision details
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to pdbx audit revision history: Structure model,3
pdbx audit revision details.data content type: Structure model
pdbx audit revision details.ordinal: 2
pdbx audit revision details.revision ordinal: 3
pdbx audit revision details.description: Carbohydrate remediation
pdbx audit revision details.provider: repository
pdbx audit revision details.type: Remediation

Structure model,1,2
type: pdbx audit revision group
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reference to pdbx audit revision history: Structure model,2
pdbx audit revision group.data content type: Structure model
pdbx audit revision group.ordinal: 1
pdbx audit revision group.revision ordinal: 2
pdbx audit revision group.group: Non-polymer description

Structure model,2
referenced by pdbx audit revision group: Structure model,1,2
referenced by pdbx audit revision group: Structure model,2,2
type: pdbx audit revision history
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
pdbx audit revision history.data content type: Structure model
pdbx audit revision history.ordinal: 2
pdbx audit revision history.major revision: 1
pdbx audit revision history.minor revision: 1
pdbx audit revision history.revision date: 2011-07-13

Structure model,2,2
type: pdbx audit revision group
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reference to pdbx audit revision history: Structure model,2
pdbx audit revision group.data content type: Structure model
pdbx audit revision group.ordinal: 2
pdbx audit revision group.revision ordinal: 2
pdbx audit revision group.group: Version format compliance

Structure model,3,3
type: pdbx audit revision group
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reference to pdbx audit revision history: Structure model,3
pdbx audit revision group.data content type: Structure model
pdbx audit revision group.ordinal: 3
pdbx audit revision group.revision ordinal: 3
pdbx audit revision group.group: Atomic model

Structure model,4,3
type: pdbx audit revision group
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reference to pdbx audit revision history: Structure model,3
pdbx audit revision group.data content type: Structure model
pdbx audit revision group.ordinal: 4
pdbx audit revision group.revision ordinal: 3
pdbx audit revision group.group: Data collection

Structure model,5,3
type: pdbx audit revision group
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to pdbx audit revision history: Structure model,3
pdbx audit revision group.data content type: Structure model
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pdbx audit revision group.revision ordinal: 3
pdbx audit revision group.group: Derived calculations

Structure model,6,3
type: pdbx audit revision group
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reference to pdbx audit revision history: Structure model,3
pdbx audit revision group.data content type: Structure model
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pdbx audit revision group.revision ordinal: 3
pdbx audit revision group.group: Structure summary

Structure model,7,4
type: pdbx audit revision group
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reference to pdbx audit revision history: Structure model,4
pdbx audit revision group.data content type: Structure model
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pdbx audit revision group.revision ordinal: 4
pdbx audit revision group.group: Data collection

Structure model,8,4
type: pdbx audit revision group
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reference to pdbx audit revision history: Structure model,4
pdbx audit revision group.data content type: Structure model
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pdbx audit revision group.revision ordinal: 4
pdbx audit revision group.group: Database references

Structure model,9,4
type: pdbx audit revision group
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reference to pdbx audit revision history: Structure model,4
pdbx audit revision group.data content type: Structure model
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pdbx audit revision group.revision ordinal: 4
pdbx audit revision group.group: Structure summary

Structure model,1,3
type: pdbx audit revision item
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reference to pdbx audit revision history: Structure model,3
pdbx audit revision item.data content type: Structure model
pdbx audit revision item.ordinal: 1
pdbx audit revision item.revision ordinal: 3
pdbx audit revision item.item: _atom_site.auth_atom_id

Structure model,2,3
type: pdbx audit revision item
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reference to pdbx audit revision history: Structure model,3
pdbx audit revision item.data content type: Structure model
pdbx audit revision item.ordinal: 2
pdbx audit revision item.revision ordinal: 3
pdbx audit revision item.item: _atom_site.label_asym_id

Structure model,3,3
type: pdbx audit revision item
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reference to pdbx audit revision history: Structure model,3
pdbx audit revision item.data content type: Structure model
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pdbx audit revision item.revision ordinal: 3
pdbx audit revision item.item: _atom_site.label_atom_id

Structure model,4,3
type: pdbx audit revision item
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reference to pdbx audit revision history: Structure model,3
pdbx audit revision item.data content type: Structure model
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pdbx audit revision item.revision ordinal: 3
pdbx audit revision item.item: _atom_site.label_entity_id

Structure model,5,3
type: pdbx audit revision item
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to pdbx audit revision history: Structure model,3
pdbx audit revision item.data content type: Structure model
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pdbx audit revision item.revision ordinal: 3
pdbx audit revision item.item: _chem_comp.name

Structure model,6,3
type: pdbx audit revision item
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reference to pdbx audit revision history: Structure model,3
pdbx audit revision item.data content type: Structure model
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pdbx audit revision item.revision ordinal: 3
pdbx audit revision item.item: _chem_comp.type

Structure model,7,3
type: pdbx audit revision item
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reference to pdbx audit revision history: Structure model,3
pdbx audit revision item.data content type: Structure model
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pdbx audit revision item.revision ordinal: 3
pdbx audit revision item.item: _pdbx_nmr_software.name

Structure model,8,3
type: pdbx audit revision item
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reference to pdbx audit revision history: Structure model,3
pdbx audit revision item.data content type: Structure model
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pdbx audit revision item.revision ordinal: 3
pdbx audit revision item.item: _pdbx_nmr_spectrometer.model

Structure model,9,3
type: pdbx audit revision item
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reference to pdbx audit revision history: Structure model,3
pdbx audit revision item.data content type: Structure model
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pdbx audit revision item.revision ordinal: 3
pdbx audit revision item.item: _pdbx_struct_assembly_gen.asym_id_list

Structure model,10,3
type: pdbx audit revision item
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reference to pdbx audit revision history: Structure model,3
pdbx audit revision item.data content type: Structure model
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pdbx audit revision item.revision ordinal: 3
pdbx audit revision item.item: _struct_conn.pdbx_leaving_atom_flag

Structure model,11,3
type: pdbx audit revision item
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reference to pdbx audit revision history: Structure model,3
pdbx audit revision item.data content type: Structure model
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pdbx audit revision item.revision ordinal: 3
pdbx audit revision item.item: _struct_conn.ptnr1_label_asym_id

Structure model,12,3
type: pdbx audit revision item
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reference to pdbx audit revision history: Structure model,3
pdbx audit revision item.data content type: Structure model
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pdbx audit revision item.revision ordinal: 3
pdbx audit revision item.item: _struct_conn.ptnr2_label_asym_id

Structure model,13,4
type: pdbx audit revision item
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reference to pdbx audit revision history: Structure model,4
pdbx audit revision item.data content type: Structure model
pdbx audit revision item.ordinal: 13
pdbx audit revision item.revision ordinal: 4
pdbx audit revision item.item: _chem_comp.pdbx_synonyms

Structure model,14,4
type: pdbx audit revision item
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reference to pdbx audit revision history: Structure model,4
pdbx audit revision item.data content type: Structure model
pdbx audit revision item.ordinal: 14
pdbx audit revision item.revision ordinal: 4
pdbx audit revision item.item: _database_2.pdbx_DOI

Structure model,15,4
type: pdbx audit revision item
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reference to pdbx audit revision history: Structure model,4
pdbx audit revision item.data content type: Structure model
pdbx audit revision item.ordinal: 15
pdbx audit revision item.revision ordinal: 4
pdbx audit revision item.item: _database_2.pdbx_database_accession

A,1,NGA,1
type: pdbx branch scheme
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pdbx branch scheme.asym id: A
pdbx branch scheme.entity id: 1
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pdbx branch scheme.num: 1
pdbx branch scheme.auth asym id: X
pdbx branch scheme.auth mon id: NGA
pdbx branch scheme.auth seq num: 1
pdbx branch scheme.hetero: n
pdbx branch scheme.pdb asym id: X
pdbx branch scheme.pdb mon id: NGA
pdbx branch scheme.pdb seq num: 1

A,1,BDP,2
type: pdbx branch scheme
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pdbx branch scheme.asym id: A
pdbx branch scheme.entity id: 1
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pdbx branch scheme.num: 2
pdbx branch scheme.auth asym id: X
pdbx branch scheme.auth mon id: BDP
pdbx branch scheme.auth seq num: 2
pdbx branch scheme.hetero: n
pdbx branch scheme.pdb asym id: X
pdbx branch scheme.pdb mon id: BDP
pdbx branch scheme.pdb seq num: 2

A,1,NGA,3
type: pdbx branch scheme
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reference to entity: http://rdf.wwpdb.org/pdb/2KQO/entity/1
pdbx branch scheme.asym id: A
pdbx branch scheme.entity id: 1
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pdbx branch scheme.num: 3
pdbx branch scheme.auth asym id: X
pdbx branch scheme.auth mon id: NGA
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pdbx branch scheme.hetero: n
pdbx branch scheme.pdb asym id: X
pdbx branch scheme.pdb mon id: NGA
pdbx branch scheme.pdb seq num: 3

A,1,BDP,4
type: pdbx branch scheme
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pdbx branch scheme.asym id: A
pdbx branch scheme.entity id: 1
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pdbx branch scheme.auth asym id: X
pdbx branch scheme.auth mon id: BDP
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pdbx branch scheme.hetero: n
pdbx branch scheme.pdb asym id: X
pdbx branch scheme.pdb mon id: BDP
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A,1,NGA,5
type: pdbx branch scheme
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to entity: http://rdf.wwpdb.org/pdb/2KQO/entity/1
pdbx branch scheme.asym id: A
pdbx branch scheme.entity id: 1
pdbx branch scheme.mon id: NGA
pdbx branch scheme.num: 5
pdbx branch scheme.auth asym id: X
pdbx branch scheme.auth mon id: NGA
pdbx branch scheme.auth seq num: 5
pdbx branch scheme.hetero: n
pdbx branch scheme.pdb asym id: X
pdbx branch scheme.pdb mon id: NGA
pdbx branch scheme.pdb seq num: 5

A,1,BDP,6
type: pdbx branch scheme
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to entity: http://rdf.wwpdb.org/pdb/2KQO/entity/1
pdbx branch scheme.asym id: A
pdbx branch scheme.entity id: 1
pdbx branch scheme.mon id: BDP
pdbx branch scheme.num: 6
pdbx branch scheme.auth asym id: X
pdbx branch scheme.auth mon id: BDP
pdbx branch scheme.auth seq num: 6
pdbx branch scheme.hetero: n
pdbx branch scheme.pdb asym id: X
pdbx branch scheme.pdb mon id: BDP
pdbx branch scheme.pdb seq num: 6

BDP,GMML,1.0,CONDENSED IUPAC CARBOHYDRATE SYMBOL
type: pdbx chem comp identifier
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: BDP
pdbx chem comp identifier.comp id: BDP
pdbx chem comp identifier.program: GMML
pdbx chem comp identifier.program version: 1.0
pdbx chem comp identifier.type: CONDENSED IUPAC CARBOHYDRATE SYMBOL
pdbx chem comp identifier.identifier: DGlcpAb

BDP,GMML,1.0,COMMON NAME
type: pdbx chem comp identifier
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: BDP
pdbx chem comp identifier.comp id: BDP
pdbx chem comp identifier.program: GMML
pdbx chem comp identifier.program version: 1.0
pdbx chem comp identifier.type: COMMON NAME
pdbx chem comp identifier.identifier: b-D-glucopyranuronic acid

BDP,PDB-CARE,1.0,IUPAC CARBOHYDRATE SYMBOL
type: pdbx chem comp identifier
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: BDP
pdbx chem comp identifier.comp id: BDP
pdbx chem comp identifier.program: PDB-CARE
pdbx chem comp identifier.program version: 1.0
pdbx chem comp identifier.type: IUPAC CARBOHYDRATE SYMBOL
pdbx chem comp identifier.identifier: b-D-GlcpA

BDP,GMML,1.0,SNFG CARBOHYDRATE SYMBOL
type: pdbx chem comp identifier
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: BDP
pdbx chem comp identifier.comp id: BDP
pdbx chem comp identifier.program: GMML
pdbx chem comp identifier.program version: 1.0
pdbx chem comp identifier.type: SNFG CARBOHYDRATE SYMBOL
pdbx chem comp identifier.identifier: GlcA

NGA,GMML,1.0,CONDENSED IUPAC CARBOHYDRATE SYMBOL
type: pdbx chem comp identifier
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: NGA
pdbx chem comp identifier.comp id: NGA
pdbx chem comp identifier.program: GMML
pdbx chem comp identifier.program version: 1.0
pdbx chem comp identifier.type: CONDENSED IUPAC CARBOHYDRATE SYMBOL
pdbx chem comp identifier.identifier: DGalpNAcb

NGA,GMML,1.0,COMMON NAME
type: pdbx chem comp identifier
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: NGA
pdbx chem comp identifier.comp id: NGA
pdbx chem comp identifier.program: GMML
pdbx chem comp identifier.program version: 1.0
pdbx chem comp identifier.type: COMMON NAME
pdbx chem comp identifier.identifier: N-acetyl-b-D-galactopyranosamine

NGA,PDB-CARE,1.0,IUPAC CARBOHYDRATE SYMBOL
type: pdbx chem comp identifier
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: NGA
pdbx chem comp identifier.comp id: NGA
pdbx chem comp identifier.program: PDB-CARE
pdbx chem comp identifier.program version: 1.0
pdbx chem comp identifier.type: IUPAC CARBOHYDRATE SYMBOL
pdbx chem comp identifier.identifier: b-D-GalpNAc

NGA,GMML,1.0,SNFG CARBOHYDRATE SYMBOL
type: pdbx chem comp identifier
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: NGA
pdbx chem comp identifier.comp id: NGA
pdbx chem comp identifier.program: GMML
pdbx chem comp identifier.program version: 1.0
pdbx chem comp identifier.type: SNFG CARBOHYDRATE SYMBOL
pdbx chem comp identifier.identifier: GalNAc

2KQO
type: pdbx database status
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to entry: 2KQO
pdbx database status.entry id: 2KQO
pdbx database status.deposit site: BMRB
pdbx database status.pdb format compatible: Y
pdbx database status.process site: RCSB
pdbx database status.recvd initial deposition date: 2009-11-12
pdbx database status.status code: REL
pdbx database status.status code mr: REL

http://rdf.wwpdb.org/pdb/2KQO/pdbx_entity_branch/1
type: pdbx entity branch
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to entity: http://rdf.wwpdb.org/pdb/2KQO/entity/1
pdbx entity branch.entity id: 1
pdbx entity branch.type: oligosaccharide

http://rdf.wwpdb.org/pdb/2KQO/pdbx_entity_branch_descriptor/1
type: pdbx entity branch descriptor
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to entity: http://rdf.wwpdb.org/pdb/2KQO/entity/1
pdbx entity branch descriptor.ordinal: 1
pdbx entity branch descriptor.descriptor: DGlcpAb1-3DGalpNAcb1-4DGlcpAb1-3DGalpNAcb1-4DGlcpAb1-3DGalpNAcb1-ROH
pdbx entity branch descriptor.entity id: 1
pdbx entity branch descriptor.program: GMML
pdbx entity branch descriptor.program version: 1.0
pdbx entity branch descriptor.type: Glycam Condensed Sequence

http://rdf.wwpdb.org/pdb/2KQO/pdbx_entity_branch_descriptor/2
type: pdbx entity branch descriptor
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to entity: http://rdf.wwpdb.org/pdb/2KQO/entity/1
pdbx entity branch descriptor.ordinal: 2
pdbx entity branch descriptor.descriptor: WURCS=2.0/2,6,5/[a2112h-1b_1-5_2*NCC/3=O][a2122A-1b_1-5]/1-2-1-2-1-2/a3-b1_b4-c1_c3-d1_d4-e1_e3-f1
pdbx entity branch descriptor.entity id: 1
pdbx entity branch descriptor.program: PDB2Glycan
pdbx entity branch descriptor.program version: 1.1.0
pdbx entity branch descriptor.type: WURCS

http://rdf.wwpdb.org/pdb/2KQO/pdbx_entity_branch_descriptor/3
type: pdbx entity branch descriptor
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to entity: http://rdf.wwpdb.org/pdb/2KQO/entity/1
pdbx entity branch descriptor.ordinal: 3
pdbx entity branch descriptor.descriptor: [][b-D-GalpNAc]{[(3+1)][b-D-GlcpA]{[(4+1)][b-D-GalpNAc]{[(3+1)][b-D-GlcpA]{[(4+1)][b-D-GalpNAc]{[(3+1)][b-D-GlcpA]{}}}}}}
pdbx entity branch descriptor.entity id: 1
pdbx entity branch descriptor.program: PDB-CARE
pdbx entity branch descriptor.type: LINUCS

http://rdf.wwpdb.org/pdb/2KQO/pdbx_entity_branch_link/1
type: pdbx entity branch link
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
pdbx entity branch link.link id: 1
pdbx entity branch link.atom id 1: C1
pdbx entity branch link.atom id 2: O3
pdbx entity branch link.comp id 1: BDP
pdbx entity branch link.comp id 2: NGA
pdbx entity branch link.entity branch list num 1: 2
pdbx entity branch link.entity branch list num 2: 1
pdbx entity branch link.entity id: 1
pdbx entity branch link.leaving atom id 1: O1
pdbx entity branch link.leaving atom id 2: HO3
pdbx entity branch link.value order: sing

http://rdf.wwpdb.org/pdb/2KQO/pdbx_entity_branch_link/2
type: pdbx entity branch link
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
pdbx entity branch link.link id: 2
pdbx entity branch link.atom id 1: C1
pdbx entity branch link.atom id 2: O4
pdbx entity branch link.comp id 1: NGA
pdbx entity branch link.comp id 2: BDP
pdbx entity branch link.entity branch list num 1: 3
pdbx entity branch link.entity branch list num 2: 2
pdbx entity branch link.entity id: 1
pdbx entity branch link.leaving atom id 1: O1
pdbx entity branch link.leaving atom id 2: HO4
pdbx entity branch link.value order: sing

http://rdf.wwpdb.org/pdb/2KQO/pdbx_entity_branch_link/3
type: pdbx entity branch link
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
pdbx entity branch link.link id: 3
pdbx entity branch link.atom id 1: C1
pdbx entity branch link.atom id 2: O3
pdbx entity branch link.comp id 1: BDP
pdbx entity branch link.comp id 2: NGA
pdbx entity branch link.entity branch list num 1: 4
pdbx entity branch link.entity branch list num 2: 3
pdbx entity branch link.entity id: 1
pdbx entity branch link.leaving atom id 1: O1
pdbx entity branch link.leaving atom id 2: HO3
pdbx entity branch link.value order: sing

http://rdf.wwpdb.org/pdb/2KQO/pdbx_entity_branch_link/4
type: pdbx entity branch link
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
pdbx entity branch link.link id: 4
pdbx entity branch link.atom id 1: C1
pdbx entity branch link.atom id 2: O4
pdbx entity branch link.comp id 1: NGA
pdbx entity branch link.comp id 2: BDP
pdbx entity branch link.entity branch list num 1: 5
pdbx entity branch link.entity branch list num 2: 4
pdbx entity branch link.entity id: 1
pdbx entity branch link.leaving atom id 1: O1
pdbx entity branch link.leaving atom id 2: HO4
pdbx entity branch link.value order: sing

http://rdf.wwpdb.org/pdb/2KQO/pdbx_entity_branch_link/5
type: pdbx entity branch link
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
pdbx entity branch link.link id: 5
pdbx entity branch link.atom id 1: C1
pdbx entity branch link.atom id 2: O3
pdbx entity branch link.comp id 1: BDP
pdbx entity branch link.comp id 2: NGA
pdbx entity branch link.entity branch list num 1: 6
pdbx entity branch link.entity branch list num 2: 5
pdbx entity branch link.entity id: 1
pdbx entity branch link.leaving atom id 1: O1
pdbx entity branch link.leaving atom id 2: HO3
pdbx entity branch link.value order: sing

NGA,1,1
type: pdbx entity branch list
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: NGA
reference to entity: http://rdf.wwpdb.org/pdb/2KQO/entity/1
pdbx entity branch list.comp id: NGA
pdbx entity branch list.entity id: 1
pdbx entity branch list.num: 1
pdbx entity branch list.hetero: n

BDP,1,2
type: pdbx entity branch list
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: BDP
reference to entity: http://rdf.wwpdb.org/pdb/2KQO/entity/1
pdbx entity branch list.comp id: BDP
pdbx entity branch list.entity id: 1
pdbx entity branch list.num: 2
pdbx entity branch list.hetero: n

NGA,1,3
type: pdbx entity branch list
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: NGA
reference to entity: http://rdf.wwpdb.org/pdb/2KQO/entity/1
pdbx entity branch list.comp id: NGA
pdbx entity branch list.entity id: 1
pdbx entity branch list.num: 3
pdbx entity branch list.hetero: n

BDP,1,4
type: pdbx entity branch list
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: BDP
reference to entity: http://rdf.wwpdb.org/pdb/2KQO/entity/1
pdbx entity branch list.comp id: BDP
pdbx entity branch list.entity id: 1
pdbx entity branch list.num: 4
pdbx entity branch list.hetero: n

NGA,1,5
type: pdbx entity branch list
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: NGA
reference to entity: http://rdf.wwpdb.org/pdb/2KQO/entity/1
pdbx entity branch list.comp id: NGA
pdbx entity branch list.entity id: 1
pdbx entity branch list.num: 5
pdbx entity branch list.hetero: n

BDP,1,6
type: pdbx entity branch list
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to chem comp: BDP
reference to entity: http://rdf.wwpdb.org/pdb/2KQO/entity/1
pdbx entity branch list.comp id: BDP
pdbx entity branch list.entity id: 1
pdbx entity branch list.num: 6
pdbx entity branch list.hetero: n

2KQO
type: pdbx nmr ensemble
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to entry: 2KQO
pdbx nmr ensemble.entry id: 2KQO
pdbx nmr ensemble.conformer selection criteria: structures with the lowest energy
pdbx nmr ensemble.conformers calculated total number: 250
pdbx nmr ensemble.conformers submitted total number: 25

1,1,1
type: pdbx nmr exptl
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
pdbx nmr exptl.conditions id: 1
pdbx nmr exptl.experiment id: 1
pdbx nmr exptl.solution id: 1
pdbx nmr exptl.type: 2D 1H-15N HSQC

1,2,1
type: pdbx nmr exptl
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
pdbx nmr exptl.conditions id: 1
pdbx nmr exptl.experiment id: 2
pdbx nmr exptl.solution id: 1
pdbx nmr exptl.type: 2D 1H-13C HSQC

1,3,1
type: pdbx nmr exptl
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
pdbx nmr exptl.conditions id: 1
pdbx nmr exptl.experiment id: 3
pdbx nmr exptl.solution id: 1
pdbx nmr exptl.type: 2D 1H-1H TOCSY

1,4,1
type: pdbx nmr exptl
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
pdbx nmr exptl.conditions id: 1
pdbx nmr exptl.experiment id: 4
pdbx nmr exptl.solution id: 1
pdbx nmr exptl.type: 2D 1H-1H COSY

1,5,1
type: pdbx nmr exptl
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
pdbx nmr exptl.conditions id: 1
pdbx nmr exptl.experiment id: 5
pdbx nmr exptl.solution id: 1
pdbx nmr exptl.type: 2D 1H-1H NOESY

unsulphated chondroitin,1
type: pdbx nmr exptl sample
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
pdbx nmr exptl sample.component: unsulphated chondroitin
pdbx nmr exptl sample.solution id: 1
pdbx nmr exptl sample.concentration range: 5,10
pdbx nmr exptl sample.concentration units: mM
pdbx nmr exptl sample.isotopic labeling: [U-15N]

http://rdf.wwpdb.org/pdb/2KQO/pdbx_nmr_exptl_sample_conditions/1
type: pdbx nmr exptl sample conditions
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
pdbx nmr exptl sample conditions.conditions id: 1
pdbx nmr exptl sample conditions.p h: 6
pdbx nmr exptl sample conditions.pressure: ambient
pdbx nmr exptl sample conditions.temperature: 298
pdbx nmr exptl sample conditions.temperature units: K

2KQO,1
type: pdbx nmr refine
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to entry: 2KQO
pdbx nmr refine.entry id: 2KQO
pdbx nmr refine.software ordinal: 1
pdbx nmr refine.details: 750 nanoseconds explicit solvent (TIP3P) molecular dynamics simulated annealing within the NPT ensemble
pdbx nmr refine.method: simulated annealing

2KQO
type: pdbx nmr representative
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to entry: 2KQO
pdbx nmr representative.entry id: 2KQO
pdbx nmr representative.conformer id: 1
pdbx nmr representative.selection criteria: lowest energy

http://rdf.wwpdb.org/pdb/2KQO/pdbx_nmr_sample_details/1
type: pdbx nmr sample details
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
pdbx nmr sample details.solution id: 1
pdbx nmr sample details.contents: 5-10 mM [U-15N] unsulphated chondroitin, 90% H2O/10% D2O
pdbx nmr sample details.solvent system: 90% H2O/10% D2O

http://rdf.wwpdb.org/pdb/2KQO/pdbx_nmr_software/1
type: pdbx nmr software
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
pdbx nmr software.ordinal: 1
pdbx nmr software.authors: Case, D. et al.
pdbx nmr software.classification: refinement
pdbx nmr software.name: Amber
pdbx nmr software.version: 10

http://rdf.wwpdb.org/pdb/2KQO/pdbx_nmr_spectrometer/1
type: pdbx nmr spectrometer
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
pdbx nmr spectrometer.spectrometer id: 1
pdbx nmr spectrometer.field strength: 600
pdbx nmr spectrometer.manufacturer: Bruker
pdbx nmr spectrometer.model: AVANCE
pdbx nmr spectrometer.type: Bruker Avance

http://rdf.wwpdb.org/pdb/2KQO/pdbx_nmr_spectrometer/2
type: pdbx nmr spectrometer
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
pdbx nmr spectrometer.spectrometer id: 2
pdbx nmr spectrometer.field strength: 900
pdbx nmr spectrometer.manufacturer: Varian
pdbx nmr spectrometer.model: INOVA
pdbx nmr spectrometer.type: Varian INOVA

http://rdf.wwpdb.org/pdb/2KQO/pdbx_struct_assembly/1
type: pdbx struct assembly
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
pdbx struct assembly.id: 1
pdbx struct assembly.details: author_defined_assembly
pdbx struct assembly.oligomeric count: 1
pdbx struct assembly.oligomeric details: monomeric
referenced by pdbx struct assembly gen: 1,A,1

1,A,1
type: pdbx struct assembly gen
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to pdbx struct assembly: http://rdf.wwpdb.org/pdb/2KQO/pdbx_struct_assembly/1
pdbx struct assembly gen.assembly id: 1
pdbx struct assembly gen.asym id list: A
pdbx struct assembly gen.oper expression: 1

http://rdf.wwpdb.org/pdb/2KQO/pdbx_struct_oper_list/1
type: pdbx struct oper list
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
pdbx struct oper list.id: 1
pdbx struct oper list.matrix11: 1
pdbx struct oper list.matrix12: 0
pdbx struct oper list.matrix13: 0
pdbx struct oper list.matrix21: 0
pdbx struct oper list.matrix22: 1
pdbx struct oper list.matrix23: 0
pdbx struct oper list.matrix31: 0
pdbx struct oper list.matrix32: 0
pdbx struct oper list.matrix33: 1
pdbx struct oper list.name: 1_555
pdbx struct oper list.symmetry operation: x,y,z
pdbx struct oper list.type: identity operation
pdbx struct oper list.vector1: 0
pdbx struct oper list.vector2: 0
pdbx struct oper list.vector3: 0

2KQO
type: struct
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to entry: 2KQO
struct.entry id: 2KQO
struct.title: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation

http://rdf.wwpdb.org/pdb/2KQO/struct_asym/A
type: struct asym
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to entity: http://rdf.wwpdb.org/pdb/2KQO/entity/1
struct asym.id: A
struct asym.entity id: 1
struct asym.pdbx blank PDB chainid flag: N
struct asym.pdbx modified: N

http://rdf.wwpdb.org/pdb/2KQO/struct_biol/1
type: struct biol
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
struct biol.id: 1

covale1
type: struct conn
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to struct conn type: covale
struct conn.id: covale1
struct conn.conn type id: covale
struct conn.pdbx dist value: 1.465
struct conn.pdbx leaving atom flag: both
struct conn.ptnr1 auth asym id: X
struct conn.ptnr1 auth comp id: NGA
struct conn.ptnr1 auth seq id: 1
struct conn.ptnr1 label asym id: A
struct conn.ptnr1 label atom id: O3
struct conn.ptnr1 label comp id: NGA
struct conn.ptnr1 symmetry: 1_555
struct conn.ptnr2 auth asym id: X
struct conn.ptnr2 auth comp id: BDP
struct conn.ptnr2 auth seq id: 2
struct conn.ptnr2 label asym id: A
struct conn.ptnr2 label atom id: C1
struct conn.ptnr2 label comp id: BDP
struct conn.ptnr2 symmetry: 1_555

covale
referenced by struct conn: covale1
referenced by struct conn: covale2
referenced by struct conn: covale3
referenced by struct conn: covale4
referenced by struct conn: covale5
type: struct conn type
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
struct conn type.id: covale

covale2
type: struct conn
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to struct conn type: covale
struct conn.id: covale2
struct conn.conn type id: covale
struct conn.pdbx dist value: 1.468
struct conn.pdbx leaving atom flag: both
struct conn.ptnr1 auth asym id: X
struct conn.ptnr1 auth comp id: BDP
struct conn.ptnr1 auth seq id: 2
struct conn.ptnr1 label asym id: A
struct conn.ptnr1 label atom id: O4
struct conn.ptnr1 label comp id: BDP
struct conn.ptnr1 symmetry: 1_555
struct conn.ptnr2 auth asym id: X
struct conn.ptnr2 auth comp id: NGA
struct conn.ptnr2 auth seq id: 3
struct conn.ptnr2 label asym id: A
struct conn.ptnr2 label atom id: C1
struct conn.ptnr2 label comp id: NGA
struct conn.ptnr2 symmetry: 1_555

covale3
type: struct conn
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to struct conn type: covale
struct conn.id: covale3
struct conn.conn type id: covale
struct conn.pdbx dist value: 1.464
struct conn.pdbx leaving atom flag: both
struct conn.ptnr1 auth asym id: X
struct conn.ptnr1 auth comp id: NGA
struct conn.ptnr1 auth seq id: 3
struct conn.ptnr1 label asym id: A
struct conn.ptnr1 label atom id: O3
struct conn.ptnr1 label comp id: NGA
struct conn.ptnr1 symmetry: 1_555
struct conn.ptnr2 auth asym id: X
struct conn.ptnr2 auth comp id: BDP
struct conn.ptnr2 auth seq id: 4
struct conn.ptnr2 label asym id: A
struct conn.ptnr2 label atom id: C1
struct conn.ptnr2 label comp id: BDP
struct conn.ptnr2 symmetry: 1_555

covale4
type: struct conn
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to struct conn type: covale
struct conn.id: covale4
struct conn.conn type id: covale
struct conn.pdbx dist value: 1.468
struct conn.pdbx leaving atom flag: both
struct conn.ptnr1 auth asym id: X
struct conn.ptnr1 auth comp id: BDP
struct conn.ptnr1 auth seq id: 4
struct conn.ptnr1 label asym id: A
struct conn.ptnr1 label atom id: O4
struct conn.ptnr1 label comp id: BDP
struct conn.ptnr1 symmetry: 1_555
struct conn.ptnr2 auth asym id: X
struct conn.ptnr2 auth comp id: NGA
struct conn.ptnr2 auth seq id: 5
struct conn.ptnr2 label asym id: A
struct conn.ptnr2 label atom id: C1
struct conn.ptnr2 label comp id: NGA
struct conn.ptnr2 symmetry: 1_555

covale5
type: struct conn
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to struct conn type: covale
struct conn.id: covale5
struct conn.conn type id: covale
struct conn.pdbx dist value: 1.464
struct conn.pdbx leaving atom flag: both
struct conn.ptnr1 auth asym id: X
struct conn.ptnr1 auth comp id: NGA
struct conn.ptnr1 auth seq id: 5
struct conn.ptnr1 label asym id: A
struct conn.ptnr1 label atom id: O3
struct conn.ptnr1 label comp id: NGA
struct conn.ptnr1 symmetry: 1_555
struct conn.ptnr2 auth asym id: X
struct conn.ptnr2 auth comp id: BDP
struct conn.ptnr2 auth seq id: 6
struct conn.ptnr2 label asym id: A
struct conn.ptnr2 label atom id: C1
struct conn.ptnr2 label comp id: BDP
struct conn.ptnr2 symmetry: 1_555

2KQO
type: struct keywords
of datablock: A 3D-structural model of unsulphated chondroitin from high-field NMR: 4-sulphation has little effect on backbone conformation
reference to entry: 2KQO
struct keywords.entry id: 2KQO
struct keywords.pdbx keywords: CARBOHYDRATE
struct keywords.text: UNSULPHATED CHONDROITIN, CONFORMATION, N-ACETYL-D-GALACTOSAMINE, D-GLUCURONIC ACID, EXPLICIT SOLVENT MOLECULAR DYNAMICS SIMULATION, EXTRACELLULAR MATRIX, GLYCOSAMINOGLYCAN, CARBOHYDRATE