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Structure paper

TitleCrystal structures of thrombin with thiazole-containing inhibitors: probes of the S1' binding site.
Journal, issue, pagesBiophys. J., Vol. 71, Page 2830-2839, Year 1996
Publish dateFeb 6, 1998 (structure data deposition date)
AuthorsMatthews, J.H. / Krishnan, R. / Costanzo, M.J. / Maryanoff, B.E. / Tulinsky, A.
External linksPubMed:8913620
MethodsX-ray diffraction
Resolution1.8 - 2.3 Å
Structure data

PDB-1a4w:
CRYSTAL STRUCTURES OF THROMBIN WITH THIAZOLE-CONTAINING INHIBITORS: PROBES OF THE S1' BINDING SITE
Method: X-RAY DIFFRACTION / Resolution: 1.8 Å

PDB-1tbz:
HUMAN THROMBIN WITH ACTIVE SITE N-METHYL-D PHENYLALANYL-N-[5-(AMINOIMINOMETHYL)AMINO]-1-{{BENZOTHIAZOLYL)CARBONYL] BUTYL]-L-PROLINAMIDE TRIFLUROACETATE AND EXOSITE-HIRUGEN
Method: X-RAY DIFFRACTION / Resolution: 2.3 Å

Chemicals

ChemComp-NA:
Unknown entry

ChemComp-QWE:
amino{[(4S)-4-({[5-(dimethylamino)naphthalen-1-yl]sulfonyl}amino)-5-oxo-5-{(2R)-2-[3-oxo-3-(1,3-thiazol-2-yl)propyl]pip

ChemComp-HOH:
WATER

ChemComp-00Q:
D-phenylalanyl-N-{(1S)-1-[(S)-1,3-benzothiazol-2-yl(hydroxy)methyl]-4-carbamimidamidobutyl}-L-prolinamide

Source
  • homo sapiens (human)
  • hirudo medicinalis (medicinal leech)
KeywordsHYDROLASE/HYDROLASE INHIBITOR / SERINE PROTEASE-INHIBITOR / BLOOD COAGULATION / HYDROLASE-HYDROLASE INHIBITOR complex / COMPLEX (SERINE PROTEASE-INHIBITOR)

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