Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
type: datablock
alternative label: 7CSS
link to mmcif: 7CSS.cif.gz
link to pdbml: 7CSS.xml.gz
link to pdbml noatom: 7CSS-noatom.xml.gz
link to pdbml extatom: 7CSS-extatom.xml.gz
link to doi: doi:10.2210/pdb7CSS/pdb
datablock name: 7CSS-noatom
has atom sites category: atom sitesCategory
has atom type category: atom typeCategory
has audit author category: audit authorCategory
has audit conform category: audit conformCategory
has chem comp category: chem compCategory
has citation category: citationCategory
has citation author category: citation authorCategory
has database 2 category: database 2Category
has entity category: entityCategory
has entity poly category: entity polyCategory
has entity poly seq category: entity poly seqCategory
has entry category: entryCategory
has exptl category: exptlCategory
has pdbx audit revision category category: pdbx audit revision categoryCategory
has pdbx audit revision details category: pdbx audit revision detailsCategory
has pdbx audit revision group category: pdbx audit revision groupCategory
has pdbx audit revision history category: pdbx audit revision historyCategory
has pdbx audit revision item category: pdbx audit revision itemCategory
has pdbx database related category: pdbx database relatedCategory
has pdbx database status category: pdbx database statusCategory
has pdbx entity src syn category: pdbx entity src synCategory
has pdbx nmr ensemble category: pdbx nmr ensembleCategory
has pdbx nmr exptl category: pdbx nmr exptlCategory
has pdbx nmr exptl sample category: pdbx nmr exptl sampleCategory
has pdbx nmr exptl sample conditions category: pdbx nmr exptl sample conditionsCategory
has pdbx nmr refine category: pdbx nmr refineCategory
has pdbx nmr representative category: pdbx nmr representativeCategory
has pdbx nmr sample details category: pdbx nmr sample detailsCategory
has pdbx nmr software category: pdbx nmr softwareCategory
has pdbx nmr spectrometer category: pdbx nmr spectrometerCategory
has pdbx poly seq scheme category: pdbx poly seq schemeCategory
has pdbx struct assembly category: pdbx struct assemblyCategory
has pdbx struct assembly auth evidence category: pdbx struct assembly auth evidenceCategory
has pdbx struct assembly gen category: pdbx struct assembly genCategory
has pdbx struct assembly prop category: pdbx struct assembly propCategory
has pdbx struct oper list category: pdbx struct oper listCategory
has pdbx validate torsion category: pdbx validate torsionCategory
has struct category: structCategory
has struct asym category: struct asymCategory
has struct conn category: struct connCategory
has struct conn type category: struct conn typeCategory
has struct keywords category: struct keywordsCategory
has struct ref category: struct refCategory
has struct ref seq category: struct ref seqCategory

7CSS
type: atom sites
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to entry: 7CSS
atom sites.entry id: 7CSS
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

7CSS
referenced by atom sites: 7CSS
type: entry
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
entry.id: 7CSS
referenced by exptl: 7CSS,SOLUTION NMR
referenced by struct: 7CSS
referenced by struct keywords: 7CSS
referenced by pdbx database status: 7CSS
referenced by pdbx nmr ensemble: 7CSS
referenced by pdbx nmr representative: 7CSS
referenced by pdbx nmr refine: 7CSS,1

http://rdf.wwpdb.org/pdb/7CSS/atom_type/C
type: atom type
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
atom type.symbol: C

http://rdf.wwpdb.org/pdb/7CSS/atom_type/H
type: atom type
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
atom type.symbol: H

http://rdf.wwpdb.org/pdb/7CSS/atom_type/N
type: atom type
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
atom type.symbol: N

http://rdf.wwpdb.org/pdb/7CSS/atom_type/O
type: atom type
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
atom type.symbol: O

http://rdf.wwpdb.org/pdb/7CSS/atom_type/S
type: atom type
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
atom type.symbol: S

http://rdf.wwpdb.org/pdb/7CSS/audit_author/1
type: audit author
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
audit author.pdbx ordinal: 1
audit author.name: Shimamoto, S.

http://rdf.wwpdb.org/pdb/7CSS/audit_author/2
type: audit author
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
audit author.pdbx ordinal: 2
audit author.name: Hidaka, Y.

mmcif pdbx.dic,5.370
type: audit conform
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
audit conform.dict name: mmcif_pdbx.dic
audit conform.dict version: 5.370
audit conform.dict location: http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic

ALA
type: chem comp
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
chem comp.id: ALA
chem comp.formula: C3 H7 N O2
chem comp.formula weight: 89.093
chem comp.mon nstd flag: y
chem comp.name: ALANINE
chem comp.type: L-peptide linking
link to chem comp: ALA
referenced by entity poly seq: 1,ALA,9

ASN
type: chem comp
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
chem comp.id: ASN
chem comp.formula: C4 H8 N2 O3
chem comp.formula weight: 132.118
chem comp.mon nstd flag: y
chem comp.name: ASPARAGINE
chem comp.type: L-peptide linking
link to chem comp: ASN
referenced by entity poly seq: 1,ASN,7

CYS
type: chem comp
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
chem comp.id: CYS
chem comp.formula: C3 H7 N O2 S
chem comp.formula weight: 121.158
chem comp.mon nstd flag: y
chem comp.name: CYSTEINE
chem comp.type: L-peptide linking
link to chem comp: CYS
referenced by entity poly seq: 1,CYS,13
referenced by entity poly seq: 1,CYS,1
referenced by entity poly seq: 1,CYS,2
referenced by entity poly seq: 1,CYS,5
referenced by entity poly seq: 1,CYS,6
referenced by entity poly seq: 1,CYS,10

GLU
type: chem comp
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
chem comp.id: GLU
chem comp.formula: C5 H9 N O4
chem comp.formula weight: 147.129
chem comp.mon nstd flag: y
chem comp.name: GLUTAMIC ACID
chem comp.type: L-peptide linking
link to chem comp: GLU
referenced by entity poly seq: 1,GLU,3

GLY
type: chem comp
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
chem comp.id: GLY
chem comp.formula: C2 H5 N O2
chem comp.formula weight: 75.067
chem comp.mon nstd flag: y
chem comp.name: GLYCINE
chem comp.type: peptide linking
link to chem comp: GLY
referenced by entity poly seq: 1,GLY,12

LEU
type: chem comp
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
chem comp.id: LEU
chem comp.formula: C6 H13 N O2
chem comp.formula weight: 131.173
chem comp.mon nstd flag: y
chem comp.name: LEUCINE
chem comp.type: L-peptide linking
link to chem comp: LEU
referenced by entity poly seq: 1,LEU,4

PRO
type: chem comp
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
chem comp.id: PRO
chem comp.formula: C5 H9 N O2
chem comp.formula weight: 115.13
chem comp.mon nstd flag: y
chem comp.name: PROLINE
chem comp.type: L-peptide linking
link to chem comp: PRO
referenced by entity poly seq: 1,PRO,8

THR
type: chem comp
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
chem comp.id: THR
chem comp.formula: C4 H9 N O3
chem comp.formula weight: 119.119
chem comp.mon nstd flag: y
chem comp.name: THREONINE
chem comp.type: L-peptide linking
link to chem comp: THR
referenced by entity poly seq: 1,THR,11

primary
type: citation
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
citation.id: primary
citation.country: CH
citation.journal abbrev: Molecules
citation.journal id ISSN: 1420-3049
citation.journal volume: 25
citation.pdbx database id DOI: 10.3390/molecules25204798
citation.pdbx database id pub med: 33096591
citation.title: Topological Regulation of the Bioactive Conformation of a Disulfide-Rich Peptide, Heat-Stable Enterotoxin.
citation.year: 2020
link to doi: doi:10.3390/molecules25204798
link to pubmed: pubmed:33096591
references: pubmed:33096591
referenced by citation author: primary,Hidaka, Y.,6
referenced by citation author: primary,Shimamoto, S.,1
referenced by citation author: primary,Fukutsuji, M.,2
referenced by citation author: primary,Osumi, T.,3
referenced by citation author: primary,Goto, M.,4
referenced by citation author: primary,Toyoda, H.,5

primary,Shimamoto, S.,1
type: citation author
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to citation: primary
citation author.citation id: primary
citation author.name: Shimamoto, S.
citation author.ordinal: 1
citation author.identifier ORCID: 0000-0002-9470-0352

primary,Fukutsuji, M.,2
type: citation author
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to citation: primary
citation author.citation id: primary
citation author.name: Fukutsuji, M.
citation author.ordinal: 2

primary,Osumi, T.,3
type: citation author
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to citation: primary
citation author.citation id: primary
citation author.name: Osumi, T.
citation author.ordinal: 3

primary,Goto, M.,4
type: citation author
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to citation: primary
citation author.citation id: primary
citation author.name: Goto, M.
citation author.ordinal: 4

primary,Toyoda, H.,5
type: citation author
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to citation: primary
citation author.citation id: primary
citation author.name: Toyoda, H.
citation author.ordinal: 5

primary,Hidaka, Y.,6
type: citation author
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to citation: primary
citation author.citation id: primary
citation author.name: Hidaka, Y.
citation author.ordinal: 6
citation author.identifier ORCID: 0000-0002-3131-2619

7CSS,PDB
type: database 2
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
database 2.database code: 7CSS
database 2.database id: PDB
database 2.pdbx DOI: 10.2210/pdb7css/pdb
database 2.pdbx database accession: pdb_00007css

D 1300017732,WWPDB
type: database 2
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
database 2.database code: D_1300017732
database 2.database id: WWPDB

36371,BMRB
type: database 2
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
database 2.database code: 36371
database 2.database id: BMRB

http://rdf.wwpdb.org/pdb/7CSS/entity/1
type: entity
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
entity.id: 1
entity.formula weight: 1319.595
entity.pdbx description: CYS-CYS-GLU-LEU-CYS-CYS-ASN-PRO-ALA-CYS-THR-GLY-CYS
entity.pdbx number of molecules: 1
entity.src method: syn
entity.type: polymer
referenced by entity poly: http://rdf.wwpdb.org/pdb/7CSS/entity_poly/1
referenced by struct asym: http://rdf.wwpdb.org/pdb/7CSS/struct_asym/A
referenced by struct ref: http://rdf.wwpdb.org/pdb/7CSS/struct_ref/1
referenced by pdbx entity src syn: 1,1

http://rdf.wwpdb.org/pdb/7CSS/entity_poly/1
type: entity poly
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to entity: http://rdf.wwpdb.org/pdb/7CSS/entity/1
entity poly.entity id: 1
entity poly.nstd linkage: no
entity poly.nstd monomer: no
entity poly.pdbx seq one letter code: CCELCCNPACTGC
entity poly.pdbx seq one letter code can: CCELCCNPACTGC
entity poly.pdbx strand id: A
entity poly.type: polypeptide(L)
referenced by entity poly seq: 1,CYS,13
referenced by entity poly seq: 1,CYS,1
referenced by entity poly seq: 1,CYS,2
referenced by entity poly seq: 1,GLU,3
referenced by entity poly seq: 1,LEU,4
referenced by entity poly seq: 1,CYS,5
referenced by entity poly seq: 1,CYS,6
referenced by entity poly seq: 1,ASN,7
referenced by entity poly seq: 1,PRO,8
referenced by entity poly seq: 1,ALA,9
referenced by entity poly seq: 1,CYS,10
referenced by entity poly seq: 1,THR,11
referenced by entity poly seq: 1,GLY,12

1,CYS,1
type: entity poly seq
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to chem comp: CYS
reference to entity poly: http://rdf.wwpdb.org/pdb/7CSS/entity_poly/1
entity poly seq.entity id: 1
entity poly seq.mon id: CYS
entity poly seq.num: 1
entity poly seq.hetero: n
referenced by pdbx poly seq scheme: A,1,CYS,1

1,CYS,2
type: entity poly seq
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to chem comp: CYS
reference to entity poly: http://rdf.wwpdb.org/pdb/7CSS/entity_poly/1
entity poly seq.entity id: 1
entity poly seq.mon id: CYS
entity poly seq.num: 2
entity poly seq.hetero: n
referenced by pdbx poly seq scheme: A,1,CYS,2

1,GLU,3
type: entity poly seq
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to chem comp: GLU
reference to entity poly: http://rdf.wwpdb.org/pdb/7CSS/entity_poly/1
entity poly seq.entity id: 1
entity poly seq.mon id: GLU
entity poly seq.num: 3
entity poly seq.hetero: n
referenced by pdbx poly seq scheme: A,1,GLU,3

1,LEU,4
type: entity poly seq
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to chem comp: LEU
reference to entity poly: http://rdf.wwpdb.org/pdb/7CSS/entity_poly/1
entity poly seq.entity id: 1
entity poly seq.mon id: LEU
entity poly seq.num: 4
entity poly seq.hetero: n
referenced by pdbx poly seq scheme: A,1,LEU,4

1,CYS,5
type: entity poly seq
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to chem comp: CYS
reference to entity poly: http://rdf.wwpdb.org/pdb/7CSS/entity_poly/1
entity poly seq.entity id: 1
entity poly seq.mon id: CYS
entity poly seq.num: 5
entity poly seq.hetero: n
referenced by pdbx poly seq scheme: A,1,CYS,5

1,CYS,6
type: entity poly seq
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to chem comp: CYS
reference to entity poly: http://rdf.wwpdb.org/pdb/7CSS/entity_poly/1
entity poly seq.entity id: 1
entity poly seq.mon id: CYS
entity poly seq.num: 6
entity poly seq.hetero: n
referenced by pdbx poly seq scheme: A,1,CYS,6

1,ASN,7
type: entity poly seq
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to chem comp: ASN
reference to entity poly: http://rdf.wwpdb.org/pdb/7CSS/entity_poly/1
entity poly seq.entity id: 1
entity poly seq.mon id: ASN
entity poly seq.num: 7
entity poly seq.hetero: n
referenced by pdbx poly seq scheme: A,1,ASN,7

1,PRO,8
type: entity poly seq
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to chem comp: PRO
reference to entity poly: http://rdf.wwpdb.org/pdb/7CSS/entity_poly/1
entity poly seq.entity id: 1
entity poly seq.mon id: PRO
entity poly seq.num: 8
entity poly seq.hetero: n
referenced by pdbx poly seq scheme: A,1,PRO,8

1,ALA,9
type: entity poly seq
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to chem comp: ALA
reference to entity poly: http://rdf.wwpdb.org/pdb/7CSS/entity_poly/1
entity poly seq.entity id: 1
entity poly seq.mon id: ALA
entity poly seq.num: 9
entity poly seq.hetero: n
referenced by pdbx poly seq scheme: A,1,ALA,9

1,CYS,10
type: entity poly seq
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to chem comp: CYS
reference to entity poly: http://rdf.wwpdb.org/pdb/7CSS/entity_poly/1
entity poly seq.entity id: 1
entity poly seq.mon id: CYS
entity poly seq.num: 10
entity poly seq.hetero: n
referenced by pdbx poly seq scheme: A,1,CYS,10

1,THR,11
type: entity poly seq
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to chem comp: THR
reference to entity poly: http://rdf.wwpdb.org/pdb/7CSS/entity_poly/1
entity poly seq.entity id: 1
entity poly seq.mon id: THR
entity poly seq.num: 11
entity poly seq.hetero: n
referenced by pdbx poly seq scheme: A,1,THR,11

1,GLY,12
type: entity poly seq
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to chem comp: GLY
reference to entity poly: http://rdf.wwpdb.org/pdb/7CSS/entity_poly/1
entity poly seq.entity id: 1
entity poly seq.mon id: GLY
entity poly seq.num: 12
entity poly seq.hetero: n
referenced by pdbx poly seq scheme: A,1,GLY,12

1,CYS,13
type: entity poly seq
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to chem comp: CYS
reference to entity poly: http://rdf.wwpdb.org/pdb/7CSS/entity_poly/1
entity poly seq.entity id: 1
entity poly seq.mon id: CYS
entity poly seq.num: 13
entity poly seq.hetero: n
referenced by pdbx poly seq scheme: A,1,CYS,13

7CSS,SOLUTION NMR
type: exptl
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to entry: 7CSS
exptl.entry id: 7CSS
exptl.method: SOLUTION NMR

Structure model,1,2
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Structure model,2
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Structure model,2,2
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Structure model,1,1
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Structure model,1
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Structure model,1,2
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Structure model,2,2
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Structure model,3,2
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unspecified,36371,BMRB
type: pdbx database related
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
pdbx database related.content type: unspecified
pdbx database related.db id: 36371
pdbx database related.db name: BMRB
pdbx database related.details: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
link to bmrb: bmr36371

7CSS
type: pdbx database status
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to entry: 7CSS
pdbx database status.entry id: 7CSS
pdbx database status.sg entry: N
pdbx database status.deposit site: PDBJ
pdbx database status.pdb format compatible: Y
pdbx database status.process site: PDBJ
pdbx database status.recvd initial deposition date: 2020-08-17
pdbx database status.status code: REL
pdbx database status.status code cs: REL
pdbx database status.status code mr: REL
pdbx database status.status code nmr data: REL

1,1
type: pdbx entity src syn
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to entity: http://rdf.wwpdb.org/pdb/7CSS/entity/1
pdbx entity src syn.entity id: 1
pdbx entity src syn.pdbx src id: 1
pdbx entity src syn.ncbi taxonomy id: 562
pdbx entity src syn.organism scientific: Escherichia coli
pdbx entity src syn.pdbx alt source flag: sample
pdbx entity src syn.pdbx beg seq num: 1
pdbx entity src syn.pdbx end seq num: 13

7CSS
type: pdbx nmr ensemble
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to entry: 7CSS
pdbx nmr ensemble.entry id: 7CSS
pdbx nmr ensemble.conformer selection criteria: structures with the lowest energy
pdbx nmr ensemble.conformers calculated total number: 1000
pdbx nmr ensemble.conformers submitted total number: 10

1,1,1
type: pdbx nmr exptl
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
pdbx nmr exptl.conditions id: 1
pdbx nmr exptl.experiment id: 1
pdbx nmr exptl.solution id: 1
pdbx nmr exptl.sample state: isotropic
pdbx nmr exptl.spectrometer id: 1
pdbx nmr exptl.type: 2D DQF-COSY

1,2,1
type: pdbx nmr exptl
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
pdbx nmr exptl.conditions id: 1
pdbx nmr exptl.experiment id: 2
pdbx nmr exptl.solution id: 1
pdbx nmr exptl.sample state: isotropic
pdbx nmr exptl.spectrometer id: 1
pdbx nmr exptl.type: 2D 1H-1H NOESY

1,3,2
type: pdbx nmr exptl
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
pdbx nmr exptl.conditions id: 1
pdbx nmr exptl.experiment id: 3
pdbx nmr exptl.solution id: 2
pdbx nmr exptl.sample state: isotropic
pdbx nmr exptl.spectrometer id: 1
pdbx nmr exptl.type: 2D 1H-1H NOESY

topological isomer of STh,1
type: pdbx nmr exptl sample
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
pdbx nmr exptl sample.component: topological isomer of STh
pdbx nmr exptl sample.solution id: 1
pdbx nmr exptl sample.concentration: 2
pdbx nmr exptl sample.concentration units: mg/mL
pdbx nmr exptl sample.isotopic labeling: natural abundance

topological isomer of STh,2
type: pdbx nmr exptl sample
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
pdbx nmr exptl sample.component: topological isomer of STh
pdbx nmr exptl sample.solution id: 2
pdbx nmr exptl sample.concentration: 2
pdbx nmr exptl sample.concentration units: mg/mL
pdbx nmr exptl sample.isotopic labeling: natural abundance

http://rdf.wwpdb.org/pdb/7CSS/pdbx_nmr_exptl_sample_conditions/1
type: pdbx nmr exptl sample conditions
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
pdbx nmr exptl sample conditions.conditions id: 1
pdbx nmr exptl sample conditions.ionic strength: 25
pdbx nmr exptl sample conditions.ionic strength units: mM
pdbx nmr exptl sample conditions.label: conditions_1
pdbx nmr exptl sample conditions.p h: 6.5
pdbx nmr exptl sample conditions.p h units: pH
pdbx nmr exptl sample conditions.pressure: 1.0
pdbx nmr exptl sample conditions.pressure units: atm
pdbx nmr exptl sample conditions.temperature: 298.15
pdbx nmr exptl sample conditions.temperature units: K

7CSS,1
type: pdbx nmr refine
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to entry: 7CSS
pdbx nmr refine.entry id: 7CSS
pdbx nmr refine.software ordinal: 1
pdbx nmr refine.method: simulated annealing

7CSS
type: pdbx nmr representative
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to entry: 7CSS
pdbx nmr representative.entry id: 7CSS
pdbx nmr representative.conformer id: 1
pdbx nmr representative.selection criteria: lowest energy

http://rdf.wwpdb.org/pdb/7CSS/pdbx_nmr_sample_details/1
type: pdbx nmr sample details
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
pdbx nmr sample details.solution id: 1
pdbx nmr sample details.contents: 2 mg/mL topological isomer of STh, 90% H2O/10% D2O
pdbx nmr sample details.details: 20 mM sodium phosphate buffer pH6.5
pdbx nmr sample details.label: sample_1
pdbx nmr sample details.solvent system: 90% H2O/10% D2O
pdbx nmr sample details.type: solution

http://rdf.wwpdb.org/pdb/7CSS/pdbx_nmr_sample_details/2
type: pdbx nmr sample details
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
pdbx nmr sample details.solution id: 2
pdbx nmr sample details.contents: 2 mg/mL topological isomer of STh, 100% D2O
pdbx nmr sample details.details: 20 mM sodium phosphate buffer pH6.5
pdbx nmr sample details.label: sample_2
pdbx nmr sample details.solvent system: 100% D2O
pdbx nmr sample details.type: solution

http://rdf.wwpdb.org/pdb/7CSS/pdbx_nmr_software/1
type: pdbx nmr software
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
pdbx nmr software.ordinal: 1
pdbx nmr software.authors: Brunger, Adams, Clore, Gros, Nilges and Read
pdbx nmr software.classification: structure calculation
pdbx nmr software.name: CNS

http://rdf.wwpdb.org/pdb/7CSS/pdbx_nmr_spectrometer/1
type: pdbx nmr spectrometer
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
pdbx nmr spectrometer.spectrometer id: 1
pdbx nmr spectrometer.field strength: 800
pdbx nmr spectrometer.manufacturer: JEOL
pdbx nmr spectrometer.model: JNM-ECA800

A,1,CYS,1
type: pdbx poly seq scheme
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to entity poly seq: 1,CYS,1
reference to struct asym: http://rdf.wwpdb.org/pdb/7CSS/struct_asym/A
pdbx poly seq scheme.asym id: A
pdbx poly seq scheme.entity id: 1
pdbx poly seq scheme.mon id: CYS
pdbx poly seq scheme.seq id: 1
pdbx poly seq scheme.auth mon id: CYS
pdbx poly seq scheme.auth seq num: 1
pdbx poly seq scheme.hetero: n
pdbx poly seq scheme.ndb seq num: 1
pdbx poly seq scheme.pdb mon id: CYS
pdbx poly seq scheme.pdb seq num: 1
pdbx poly seq scheme.pdb strand id: A

http://rdf.wwpdb.org/pdb/7CSS/struct_asym/A
referenced by pdbx poly seq scheme: A,1,CYS,1
referenced by pdbx poly seq scheme: A,1,CYS,2
referenced by pdbx poly seq scheme: A,1,GLU,3
referenced by pdbx poly seq scheme: A,1,LEU,4
referenced by pdbx poly seq scheme: A,1,CYS,5
referenced by pdbx poly seq scheme: A,1,CYS,6
referenced by pdbx poly seq scheme: A,1,ASN,7
referenced by pdbx poly seq scheme: A,1,PRO,8
referenced by pdbx poly seq scheme: A,1,ALA,9
referenced by pdbx poly seq scheme: A,1,CYS,10
referenced by pdbx poly seq scheme: A,1,THR,11
referenced by pdbx poly seq scheme: A,1,GLY,12
referenced by pdbx poly seq scheme: A,1,CYS,13
type: struct asym
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to entity: http://rdf.wwpdb.org/pdb/7CSS/entity/1
struct asym.id: A
struct asym.entity id: 1
struct asym.pdbx blank PDB chainid flag: N
struct asym.pdbx modified: N

A,1,CYS,2
type: pdbx poly seq scheme
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to entity poly seq: 1,CYS,2
reference to struct asym: http://rdf.wwpdb.org/pdb/7CSS/struct_asym/A
pdbx poly seq scheme.asym id: A
pdbx poly seq scheme.entity id: 1
pdbx poly seq scheme.mon id: CYS
pdbx poly seq scheme.seq id: 2
pdbx poly seq scheme.auth mon id: CYS
pdbx poly seq scheme.auth seq num: 2
pdbx poly seq scheme.hetero: n
pdbx poly seq scheme.ndb seq num: 2
pdbx poly seq scheme.pdb mon id: CYS
pdbx poly seq scheme.pdb seq num: 2
pdbx poly seq scheme.pdb strand id: A

A,1,GLU,3
type: pdbx poly seq scheme
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to entity poly seq: 1,GLU,3
reference to struct asym: http://rdf.wwpdb.org/pdb/7CSS/struct_asym/A
pdbx poly seq scheme.asym id: A
pdbx poly seq scheme.entity id: 1
pdbx poly seq scheme.mon id: GLU
pdbx poly seq scheme.seq id: 3
pdbx poly seq scheme.auth mon id: GLU
pdbx poly seq scheme.auth seq num: 3
pdbx poly seq scheme.hetero: n
pdbx poly seq scheme.ndb seq num: 3
pdbx poly seq scheme.pdb mon id: GLU
pdbx poly seq scheme.pdb seq num: 3
pdbx poly seq scheme.pdb strand id: A

A,1,LEU,4
type: pdbx poly seq scheme
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to entity poly seq: 1,LEU,4
reference to struct asym: http://rdf.wwpdb.org/pdb/7CSS/struct_asym/A
pdbx poly seq scheme.asym id: A
pdbx poly seq scheme.entity id: 1
pdbx poly seq scheme.mon id: LEU
pdbx poly seq scheme.seq id: 4
pdbx poly seq scheme.auth mon id: LEU
pdbx poly seq scheme.auth seq num: 4
pdbx poly seq scheme.hetero: n
pdbx poly seq scheme.ndb seq num: 4
pdbx poly seq scheme.pdb mon id: LEU
pdbx poly seq scheme.pdb seq num: 4
pdbx poly seq scheme.pdb strand id: A

A,1,CYS,5
type: pdbx poly seq scheme
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to entity poly seq: 1,CYS,5
reference to struct asym: http://rdf.wwpdb.org/pdb/7CSS/struct_asym/A
pdbx poly seq scheme.asym id: A
pdbx poly seq scheme.entity id: 1
pdbx poly seq scheme.mon id: CYS
pdbx poly seq scheme.seq id: 5
pdbx poly seq scheme.auth mon id: CYS
pdbx poly seq scheme.auth seq num: 5
pdbx poly seq scheme.hetero: n
pdbx poly seq scheme.ndb seq num: 5
pdbx poly seq scheme.pdb mon id: CYS
pdbx poly seq scheme.pdb seq num: 5
pdbx poly seq scheme.pdb strand id: A

A,1,CYS,6
type: pdbx poly seq scheme
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to entity poly seq: 1,CYS,6
reference to struct asym: http://rdf.wwpdb.org/pdb/7CSS/struct_asym/A
pdbx poly seq scheme.asym id: A
pdbx poly seq scheme.entity id: 1
pdbx poly seq scheme.mon id: CYS
pdbx poly seq scheme.seq id: 6
pdbx poly seq scheme.auth mon id: CYS
pdbx poly seq scheme.auth seq num: 6
pdbx poly seq scheme.hetero: n
pdbx poly seq scheme.ndb seq num: 6
pdbx poly seq scheme.pdb mon id: CYS
pdbx poly seq scheme.pdb seq num: 6
pdbx poly seq scheme.pdb strand id: A

A,1,ASN,7
type: pdbx poly seq scheme
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to entity poly seq: 1,ASN,7
reference to struct asym: http://rdf.wwpdb.org/pdb/7CSS/struct_asym/A
pdbx poly seq scheme.asym id: A
pdbx poly seq scheme.entity id: 1
pdbx poly seq scheme.mon id: ASN
pdbx poly seq scheme.seq id: 7
pdbx poly seq scheme.auth mon id: ASN
pdbx poly seq scheme.auth seq num: 7
pdbx poly seq scheme.hetero: n
pdbx poly seq scheme.ndb seq num: 7
pdbx poly seq scheme.pdb mon id: ASN
pdbx poly seq scheme.pdb seq num: 7
pdbx poly seq scheme.pdb strand id: A

A,1,PRO,8
type: pdbx poly seq scheme
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to entity poly seq: 1,PRO,8
reference to struct asym: http://rdf.wwpdb.org/pdb/7CSS/struct_asym/A
pdbx poly seq scheme.asym id: A
pdbx poly seq scheme.entity id: 1
pdbx poly seq scheme.mon id: PRO
pdbx poly seq scheme.seq id: 8
pdbx poly seq scheme.auth mon id: PRO
pdbx poly seq scheme.auth seq num: 8
pdbx poly seq scheme.hetero: n
pdbx poly seq scheme.ndb seq num: 8
pdbx poly seq scheme.pdb mon id: PRO
pdbx poly seq scheme.pdb seq num: 8
pdbx poly seq scheme.pdb strand id: A

A,1,ALA,9
type: pdbx poly seq scheme
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to entity poly seq: 1,ALA,9
reference to struct asym: http://rdf.wwpdb.org/pdb/7CSS/struct_asym/A
pdbx poly seq scheme.asym id: A
pdbx poly seq scheme.entity id: 1
pdbx poly seq scheme.mon id: ALA
pdbx poly seq scheme.seq id: 9
pdbx poly seq scheme.auth mon id: ALA
pdbx poly seq scheme.auth seq num: 9
pdbx poly seq scheme.hetero: n
pdbx poly seq scheme.ndb seq num: 9
pdbx poly seq scheme.pdb mon id: ALA
pdbx poly seq scheme.pdb seq num: 9
pdbx poly seq scheme.pdb strand id: A

A,1,CYS,10
type: pdbx poly seq scheme
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to entity poly seq: 1,CYS,10
reference to struct asym: http://rdf.wwpdb.org/pdb/7CSS/struct_asym/A
pdbx poly seq scheme.asym id: A
pdbx poly seq scheme.entity id: 1
pdbx poly seq scheme.mon id: CYS
pdbx poly seq scheme.seq id: 10
pdbx poly seq scheme.auth mon id: CYS
pdbx poly seq scheme.auth seq num: 10
pdbx poly seq scheme.hetero: n
pdbx poly seq scheme.ndb seq num: 10
pdbx poly seq scheme.pdb mon id: CYS
pdbx poly seq scheme.pdb seq num: 10
pdbx poly seq scheme.pdb strand id: A

A,1,THR,11
type: pdbx poly seq scheme
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to entity poly seq: 1,THR,11
reference to struct asym: http://rdf.wwpdb.org/pdb/7CSS/struct_asym/A
pdbx poly seq scheme.asym id: A
pdbx poly seq scheme.entity id: 1
pdbx poly seq scheme.mon id: THR
pdbx poly seq scheme.seq id: 11
pdbx poly seq scheme.auth mon id: THR
pdbx poly seq scheme.auth seq num: 11
pdbx poly seq scheme.hetero: n
pdbx poly seq scheme.ndb seq num: 11
pdbx poly seq scheme.pdb mon id: THR
pdbx poly seq scheme.pdb seq num: 11
pdbx poly seq scheme.pdb strand id: A

A,1,GLY,12
type: pdbx poly seq scheme
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to entity poly seq: 1,GLY,12
reference to struct asym: http://rdf.wwpdb.org/pdb/7CSS/struct_asym/A
pdbx poly seq scheme.asym id: A
pdbx poly seq scheme.entity id: 1
pdbx poly seq scheme.mon id: GLY
pdbx poly seq scheme.seq id: 12
pdbx poly seq scheme.auth mon id: GLY
pdbx poly seq scheme.auth seq num: 12
pdbx poly seq scheme.hetero: n
pdbx poly seq scheme.ndb seq num: 12
pdbx poly seq scheme.pdb mon id: GLY
pdbx poly seq scheme.pdb seq num: 12
pdbx poly seq scheme.pdb strand id: A

A,1,CYS,13
type: pdbx poly seq scheme
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to entity poly seq: 1,CYS,13
reference to struct asym: http://rdf.wwpdb.org/pdb/7CSS/struct_asym/A
pdbx poly seq scheme.asym id: A
pdbx poly seq scheme.entity id: 1
pdbx poly seq scheme.mon id: CYS
pdbx poly seq scheme.seq id: 13
pdbx poly seq scheme.auth mon id: CYS
pdbx poly seq scheme.auth seq num: 13
pdbx poly seq scheme.hetero: n
pdbx poly seq scheme.ndb seq num: 13
pdbx poly seq scheme.pdb mon id: CYS
pdbx poly seq scheme.pdb seq num: 13
pdbx poly seq scheme.pdb strand id: A

http://rdf.wwpdb.org/pdb/7CSS/pdbx_struct_assembly/1
type: pdbx struct assembly
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
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
referenced by pdbx struct assembly auth evidence: 1,1

1,1
type: pdbx struct assembly auth evidence
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to pdbx struct assembly: http://rdf.wwpdb.org/pdb/7CSS/pdbx_struct_assembly/1
pdbx struct assembly auth evidence.assembly id: 1
pdbx struct assembly auth evidence.id: 1
pdbx struct assembly auth evidence.experimental support: none

1,A,1
type: pdbx struct assembly gen
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to pdbx struct assembly: http://rdf.wwpdb.org/pdb/7CSS/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

1,ABSA (A^2)
type: pdbx struct assembly prop
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
pdbx struct assembly prop.biol id: 1
pdbx struct assembly prop.type: ABSA (A^2)
pdbx struct assembly prop.value: 0

1,MORE
type: pdbx struct assembly prop
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
pdbx struct assembly prop.biol id: 1
pdbx struct assembly prop.type: MORE
pdbx struct assembly prop.value: 0

1,SSA (A^2)
type: pdbx struct assembly prop
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
pdbx struct assembly prop.biol id: 1
pdbx struct assembly prop.type: SSA (A^2)
pdbx struct assembly prop.value: 1230

http://rdf.wwpdb.org/pdb/7CSS/pdbx_struct_oper_list/1
type: pdbx struct oper list
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
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.type: identity operation
pdbx struct oper list.vector1: 0
pdbx struct oper list.vector2: 0
pdbx struct oper list.vector3: 0

http://rdf.wwpdb.org/pdb/7CSS/pdbx_validate_torsion/1
type: pdbx validate torsion
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
pdbx validate torsion.id: 1
pdbx validate torsion.pdb model num: 1
pdbx validate torsion.auth asym id: A
pdbx validate torsion.auth comp id: GLU
pdbx validate torsion.auth seq id: 3
pdbx validate torsion.phi: -146.2
pdbx validate torsion.psi: -67.78

http://rdf.wwpdb.org/pdb/7CSS/pdbx_validate_torsion/2
type: pdbx validate torsion
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
pdbx validate torsion.id: 2
pdbx validate torsion.pdb model num: 1
pdbx validate torsion.auth asym id: A
pdbx validate torsion.auth comp id: ALA
pdbx validate torsion.auth seq id: 9
pdbx validate torsion.phi: -156.95
pdbx validate torsion.psi: -2.51

http://rdf.wwpdb.org/pdb/7CSS/pdbx_validate_torsion/3
type: pdbx validate torsion
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
pdbx validate torsion.id: 3
pdbx validate torsion.pdb model num: 2
pdbx validate torsion.auth asym id: A
pdbx validate torsion.auth comp id: GLU
pdbx validate torsion.auth seq id: 3
pdbx validate torsion.phi: -146.36
pdbx validate torsion.psi: -67.8

http://rdf.wwpdb.org/pdb/7CSS/pdbx_validate_torsion/4
type: pdbx validate torsion
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
pdbx validate torsion.id: 4
pdbx validate torsion.pdb model num: 2
pdbx validate torsion.auth asym id: A
pdbx validate torsion.auth comp id: ALA
pdbx validate torsion.auth seq id: 9
pdbx validate torsion.phi: -156.95
pdbx validate torsion.psi: -2.51

http://rdf.wwpdb.org/pdb/7CSS/pdbx_validate_torsion/5
type: pdbx validate torsion
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
pdbx validate torsion.id: 5
pdbx validate torsion.pdb model num: 3
pdbx validate torsion.auth asym id: A
pdbx validate torsion.auth comp id: GLU
pdbx validate torsion.auth seq id: 3
pdbx validate torsion.phi: -146.25
pdbx validate torsion.psi: -67.84

http://rdf.wwpdb.org/pdb/7CSS/pdbx_validate_torsion/6
type: pdbx validate torsion
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
pdbx validate torsion.id: 6
pdbx validate torsion.pdb model num: 3
pdbx validate torsion.auth asym id: A
pdbx validate torsion.auth comp id: ALA
pdbx validate torsion.auth seq id: 9
pdbx validate torsion.phi: -156.85
pdbx validate torsion.psi: -2.56

http://rdf.wwpdb.org/pdb/7CSS/pdbx_validate_torsion/7
type: pdbx validate torsion
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
pdbx validate torsion.id: 7
pdbx validate torsion.pdb model num: 4
pdbx validate torsion.auth asym id: A
pdbx validate torsion.auth comp id: GLU
pdbx validate torsion.auth seq id: 3
pdbx validate torsion.phi: -146.37
pdbx validate torsion.psi: -67.82

http://rdf.wwpdb.org/pdb/7CSS/pdbx_validate_torsion/8
type: pdbx validate torsion
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
pdbx validate torsion.id: 8
pdbx validate torsion.pdb model num: 4
pdbx validate torsion.auth asym id: A
pdbx validate torsion.auth comp id: ALA
pdbx validate torsion.auth seq id: 9
pdbx validate torsion.phi: -156.86
pdbx validate torsion.psi: -2.5

http://rdf.wwpdb.org/pdb/7CSS/pdbx_validate_torsion/9
type: pdbx validate torsion
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
pdbx validate torsion.id: 9
pdbx validate torsion.pdb model num: 5
pdbx validate torsion.auth asym id: A
pdbx validate torsion.auth comp id: GLU
pdbx validate torsion.auth seq id: 3
pdbx validate torsion.phi: -146.36
pdbx validate torsion.psi: -67.82

http://rdf.wwpdb.org/pdb/7CSS/pdbx_validate_torsion/10
type: pdbx validate torsion
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
pdbx validate torsion.id: 10
pdbx validate torsion.pdb model num: 5
pdbx validate torsion.auth asym id: A
pdbx validate torsion.auth comp id: ALA
pdbx validate torsion.auth seq id: 9
pdbx validate torsion.phi: -156.98
pdbx validate torsion.psi: -2.38

http://rdf.wwpdb.org/pdb/7CSS/pdbx_validate_torsion/11
type: pdbx validate torsion
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
pdbx validate torsion.id: 11
pdbx validate torsion.pdb model num: 6
pdbx validate torsion.auth asym id: A
pdbx validate torsion.auth comp id: GLU
pdbx validate torsion.auth seq id: 3
pdbx validate torsion.phi: -146.65
pdbx validate torsion.psi: -67.79

http://rdf.wwpdb.org/pdb/7CSS/pdbx_validate_torsion/12
type: pdbx validate torsion
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
pdbx validate torsion.id: 12
pdbx validate torsion.pdb model num: 6
pdbx validate torsion.auth asym id: A
pdbx validate torsion.auth comp id: ALA
pdbx validate torsion.auth seq id: 9
pdbx validate torsion.phi: -156.87
pdbx validate torsion.psi: -2.48

http://rdf.wwpdb.org/pdb/7CSS/pdbx_validate_torsion/13
type: pdbx validate torsion
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
pdbx validate torsion.id: 13
pdbx validate torsion.pdb model num: 7
pdbx validate torsion.auth asym id: A
pdbx validate torsion.auth comp id: GLU
pdbx validate torsion.auth seq id: 3
pdbx validate torsion.phi: -146.74
pdbx validate torsion.psi: -67.81

http://rdf.wwpdb.org/pdb/7CSS/pdbx_validate_torsion/14
type: pdbx validate torsion
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
pdbx validate torsion.id: 14
pdbx validate torsion.pdb model num: 7
pdbx validate torsion.auth asym id: A
pdbx validate torsion.auth comp id: ALA
pdbx validate torsion.auth seq id: 9
pdbx validate torsion.phi: -157.04
pdbx validate torsion.psi: -2.31

http://rdf.wwpdb.org/pdb/7CSS/pdbx_validate_torsion/15
type: pdbx validate torsion
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
pdbx validate torsion.id: 15
pdbx validate torsion.pdb model num: 8
pdbx validate torsion.auth asym id: A
pdbx validate torsion.auth comp id: GLU
pdbx validate torsion.auth seq id: 3
pdbx validate torsion.phi: -146.78
pdbx validate torsion.psi: -67.82

http://rdf.wwpdb.org/pdb/7CSS/pdbx_validate_torsion/16
type: pdbx validate torsion
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
pdbx validate torsion.id: 16
pdbx validate torsion.pdb model num: 8
pdbx validate torsion.auth asym id: A
pdbx validate torsion.auth comp id: ALA
pdbx validate torsion.auth seq id: 9
pdbx validate torsion.phi: -157.06
pdbx validate torsion.psi: -2.55

http://rdf.wwpdb.org/pdb/7CSS/pdbx_validate_torsion/17
type: pdbx validate torsion
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
pdbx validate torsion.id: 17
pdbx validate torsion.pdb model num: 9
pdbx validate torsion.auth asym id: A
pdbx validate torsion.auth comp id: GLU
pdbx validate torsion.auth seq id: 3
pdbx validate torsion.phi: -146.84
pdbx validate torsion.psi: -67.72

http://rdf.wwpdb.org/pdb/7CSS/pdbx_validate_torsion/18
type: pdbx validate torsion
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
pdbx validate torsion.id: 18
pdbx validate torsion.pdb model num: 9
pdbx validate torsion.auth asym id: A
pdbx validate torsion.auth comp id: PRO
pdbx validate torsion.auth seq id: 8
pdbx validate torsion.phi: -80.87
pdbx validate torsion.psi: 30

http://rdf.wwpdb.org/pdb/7CSS/pdbx_validate_torsion/19
type: pdbx validate torsion
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
pdbx validate torsion.id: 19
pdbx validate torsion.pdb model num: 9
pdbx validate torsion.auth asym id: A
pdbx validate torsion.auth comp id: ALA
pdbx validate torsion.auth seq id: 9
pdbx validate torsion.phi: -157.01
pdbx validate torsion.psi: -2.56

http://rdf.wwpdb.org/pdb/7CSS/pdbx_validate_torsion/20
type: pdbx validate torsion
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
pdbx validate torsion.id: 20
pdbx validate torsion.pdb model num: 10
pdbx validate torsion.auth asym id: A
pdbx validate torsion.auth comp id: GLU
pdbx validate torsion.auth seq id: 3
pdbx validate torsion.phi: -146.12
pdbx validate torsion.psi: -67.85

http://rdf.wwpdb.org/pdb/7CSS/pdbx_validate_torsion/21
type: pdbx validate torsion
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
pdbx validate torsion.id: 21
pdbx validate torsion.pdb model num: 10
pdbx validate torsion.auth asym id: A
pdbx validate torsion.auth comp id: ALA
pdbx validate torsion.auth seq id: 9
pdbx validate torsion.phi: -156.81
pdbx validate torsion.psi: -2.58

7CSS
type: struct
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to entry: 7CSS
struct.entry id: 7CSS
struct.pdbx CASP flag: N
struct.title: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli

disulf1
type: struct conn
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to struct conn type: disulf
struct conn.id: disulf1
struct conn.conn type id: disulf
struct conn.pdbx dist value: 2.031
struct conn.ptnr1 auth asym id: A
struct conn.ptnr1 auth comp id: CYS
struct conn.ptnr1 auth seq id: 1
struct conn.ptnr1 label asym id: A
struct conn.ptnr1 label atom id: SG
struct conn.ptnr1 label comp id: CYS
struct conn.ptnr1 label seq id: 1
struct conn.ptnr1 symmetry: 1_555
struct conn.ptnr2 auth asym id: A
struct conn.ptnr2 auth comp id: CYS
struct conn.ptnr2 auth seq id: 6
struct conn.ptnr2 label asym id: A
struct conn.ptnr2 label atom id: SG
struct conn.ptnr2 label comp id: CYS
struct conn.ptnr2 label seq id: 6
struct conn.ptnr2 symmetry: 1_555

disulf
referenced by struct conn: disulf1
referenced by struct conn: disulf2
referenced by struct conn: disulf3
type: struct conn type
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
struct conn type.id: disulf

disulf2
type: struct conn
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to struct conn type: disulf
struct conn.id: disulf2
struct conn.conn type id: disulf
struct conn.pdbx dist value: 2.031
struct conn.ptnr1 auth asym id: A
struct conn.ptnr1 auth comp id: CYS
struct conn.ptnr1 auth seq id: 2
struct conn.ptnr1 label asym id: A
struct conn.ptnr1 label atom id: SG
struct conn.ptnr1 label comp id: CYS
struct conn.ptnr1 label seq id: 2
struct conn.ptnr1 symmetry: 1_555
struct conn.ptnr2 auth asym id: A
struct conn.ptnr2 auth comp id: CYS
struct conn.ptnr2 auth seq id: 10
struct conn.ptnr2 label asym id: A
struct conn.ptnr2 label atom id: SG
struct conn.ptnr2 label comp id: CYS
struct conn.ptnr2 label seq id: 10
struct conn.ptnr2 symmetry: 1_555

disulf3
type: struct conn
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to struct conn type: disulf
struct conn.id: disulf3
struct conn.conn type id: disulf
struct conn.pdbx dist value: 2.032
struct conn.ptnr1 auth asym id: A
struct conn.ptnr1 auth comp id: CYS
struct conn.ptnr1 auth seq id: 5
struct conn.ptnr1 label asym id: A
struct conn.ptnr1 label atom id: SG
struct conn.ptnr1 label comp id: CYS
struct conn.ptnr1 label seq id: 5
struct conn.ptnr1 symmetry: 1_555
struct conn.ptnr2 auth asym id: A
struct conn.ptnr2 auth comp id: CYS
struct conn.ptnr2 auth seq id: 13
struct conn.ptnr2 label asym id: A
struct conn.ptnr2 label atom id: SG
struct conn.ptnr2 label comp id: CYS
struct conn.ptnr2 label seq id: 13
struct conn.ptnr2 symmetry: 1_555

7CSS
type: struct keywords
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to entry: 7CSS
struct keywords.entry id: 7CSS
struct keywords.pdbx keywords: TOXIN
struct keywords.text: Heat-stable enterotoxin, topological isomer, STh, STh(6-18), TOXIN

http://rdf.wwpdb.org/pdb/7CSS/struct_ref/1
type: struct ref
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to entity: http://rdf.wwpdb.org/pdb/7CSS/entity/1
struct ref.id: 1
struct ref.db code: 7CSS
struct ref.db name: PDB
struct ref.entity id: 1
struct ref.pdbx align begin: 1
struct ref.pdbx db accession: 7CSS
referenced by struct ref seq: http://rdf.wwpdb.org/pdb/7CSS/struct_ref_seq/1

http://rdf.wwpdb.org/pdb/7CSS/struct_ref_seq/1
type: struct ref seq
of datablock: Solution structure of the topological isomer of Heat-stable enterotoxin produced by Enterotoxigenic Escherichia coli
reference to struct ref: http://rdf.wwpdb.org/pdb/7CSS/struct_ref/1
struct ref seq.align id: 1
struct ref seq.db align beg: 1
struct ref seq.db align end: 13
struct ref seq.pdbx PDB id code: 7CSS
struct ref seq.pdbx auth seq align beg: 1
struct ref seq.pdbx auth seq align end: 13
struct ref seq.pdbx db accession: 7CSS
struct ref seq.pdbx strand id: A
struct ref seq.ref id: 1
struct ref seq.seq align beg: 1
struct ref seq.seq align end: 13