Human thrombin mutant C191A-C220A in complex with the inhibitor PPACK

Summary for 2PGQ

Related1SHH 2PGB
Related PRD IDPRD_000020
DescriptorProthrombin, ZINC ION, D-phenylalanyl-N-[(2S,3S)-6-{[amino(iminio)methyl]amino}-1-chloro-2-hydroxyhexan-3-yl]-L-prolinamide, ... (6 entities in total)
Functional Keywordsserine protease, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
Biological sourceHomo sapiens (human)
Cellular locationSecreted, extracellular space P00734 P00734
Total number of polymer chains2
Total molecular weight35868.32
Bush-Pelc, L.A.,Marino, F.,Chen, Z.,Pineda, A.O.,Mathews, F.S.,Di Cera, E. (deposition date: 2007-04-10, release date: 2007-07-17, Last modification date: 2013-09-25)
Primary citation
Bush-Pelc, L.A.,Marino, F.,Chen, Z.,Pineda, A.O.,Mathews, F.S.,Di Cera, E.
Important role of the cys-191 cys-220 disulfide bond in thrombin function and allostery
J.Biol.Chem., 282:27165-27170, 2007
PubMed: 17636263 (PDB entries with the same primary citation)
DOI: 10.1074/jbc.M703202200
MImport into Mendeley
Experimental method
NMR Information

Structure validation

ClashscoreRamachandran outliersSidechain outliers1105.1%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution