3WV3
Crystal structure of the catalytic domain of MMP-13 complexed with N-(3-methoxybenzyl)-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-2-carboxamide
Summary for 3WV3
Entry DOI | 10.2210/pdb3wv3/pdb |
Related | 3WV1 3WV2 |
Descriptor | Collagenase 3, ZINC ION, CALCIUM ION, ... (8 entities in total) |
Functional Keywords | mmp-13, hydrolase, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor |
Biological source | Homo sapiens (human) |
Cellular location | Secreted, extracellular space, extracellular matrix : P45452 |
Total number of polymer chains | 2 |
Total formula weight | 39785.57 |
Authors | Oki, H.,Tanaka, Y. (deposition date: 2014-05-12, release date: 2014-09-24, Last modification date: 2023-11-08) |
Primary citation | Nara, H.,Sato, K.,Naito, T.,Mototani, H.,Oki, H.,Yamamoto, Y.,Kuno, H.,Santou, T.,Kanzaki, N.,Terauchi, J.,Uchikawa, O.,Kori, M. Thieno[2,3-d]pyrimidine-2-carboxamides bearing a carboxybenzene group at 5-position: highly potent, selective, and orally available MMP-13 inhibitors interacting with the S1′′ binding site. Bioorg.Med.Chem., 22:5487-5505, 2014 Cited by PubMed: 25192810DOI: 10.1016/j.bmc.2014.07.025 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.6 Å) |
Structure validation
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