SOLUTION STRUCTURE OF C1-T1, A TWO-DOMAIN PROTEINASE INHIBITOR DERIVED FROM THE CIRCULAR PRECURSOR PROTEIN NA-PROPI FROM NICOTIANA ALATA
The solution structure of C1-T1, a two-domain proteinase inhibitor derived from a circular precursor protein from Nicotiana alata.
DOMAINS 1 AND 2 (C1 AND T1) FROM THE SIX-DOMAIN PRECURSOR PROTEIN NA-PROPI
DRICTNCCAGTKGCKYFSDDGTFVCEGESDPRNPKACTLNCDPRIAYGVCPRSEEKKNDRICTNCCAGTKGCKYFSDDGT FVCEGESDPRNPKACPRNCDPRIAYGICPLA
This structure was determined using standard 2D homonuclear techniques and 3D heteronuclear techniques.
the structures are based on a total of 1193 constraints, 1039 are NOE-derived distance constraints, 82 dihedral angle restraints, and 72 hydrogen bond distance constraints
simulated annealing with torsion angle dynamics
Bartels, Xia, Billeter, Guentert, Wuethrich
MAVHRVSFLALLLLFGMSLLVSNVEHADAKACTLNCDPRIAYGVCPRSEEKKNDRICTNCCAGTKGCKYFSDDGTFVCEG ESDPRNPKACTLNCDPRIAYGVCPRSEEKKNDRICTNCCAGTKGCKYFSDDGTFVCEGESDPRNPKACPRNCDPRIAYGI CPLAEEKKNDRICTNCCAGKKGCKYFSDDGTFVCEGESDPKNPKACPRNCDGRIAYGICPLSEEKKNDRICTNCCAGKKG CKYFSDDGTFVCEGESDPKNPKACPRNCDGRIAYGICPLSEEKKNDRICTNCCAGKKGCKYFSDDGTFVCEGESDPRNPK ACPRNCDGRIAYGICPLSEEKKNDRICTNCCAGKKGCKYFSDDGTFICEGESEYASKVDEYVGEVENDLQKSKVAVS