6T3Q
Thrombin in Complex with a D-Phe-Pro-2-aminopyridine derivative
Summary for 6T3Q
Entry DOI | 10.2210/pdb6t3q/pdb |
Descriptor | Prothrombin, Hirudin variant-2, 2-acetamido-2-deoxy-beta-D-glucopyranose, ... (9 entities in total) |
Functional Keywords | coagulation, blood clotting, convertion of fibrinogen to fibrin, thrombin inhibitor, hydrolase |
Biological source | Homo sapiens (Human) More |
Total number of polymer chains | 3 |
Total formula weight | 36189.98 |
Authors | Ngo, K.,Collins, C.,Heine, A.,Klebe, G. (deposition date: 2019-10-11, release date: 2020-05-13, Last modification date: 2024-01-24) |
Primary citation | Ngo, K.,Collins-Kautz, C.,Gerstenecker, S.,Wagner, B.,Heine, A.,Klebe, G. Protein-Induced Change in Ligand Protonation during Trypsin and Thrombin Binding: Hint on Differences in Selectivity Determinants of Both Proteins? J.Med.Chem., 63:3274-3289, 2020 Cited by PubMed: 32011145DOI: 10.1021/acs.jmedchem.9b02061 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.33 Å) |
Structure validation
Download full validation report