7K6U
Carbonic Anhydrase IX mimic complexed with 4-(2-(3-(4-methylphenyl)ureido)ethylsulfonamido)benzenesulfonamide
Summary for 7K6U
Entry DOI | 10.2210/pdb7k6u/pdb |
Descriptor | Carbonic anhydrase 2, ZINC ION, 4-{[(2-{[(4-methylphenyl)carbamoyl]amino}ethyl)sulfonyl]amino}benzene-1-sulfonamide, ... (5 entities in total) |
Functional Keywords | carbonic anhydrase, caii, caix inhibitor, structure guided drug design, structure activity relationship study, breast cancer, lyase, lyase-lyase inhibitor complex, lyase/lyase inhibitor |
Biological source | Homo sapiens (Human) |
Total number of polymer chains | 1 |
Total formula weight | 29756.91 |
Authors | Andring, J.T.,Singh, S.,McKenna, R. (deposition date: 2020-09-21, release date: 2020-12-23, Last modification date: 2023-10-18) |
Primary citation | Akgul, O.,Singh, S.,Andring, J.T.,McKenna, R.,Selleri, S.,Carta, F.,Angeli, A.,Supuran, C.T. Handling drug-target selectivity: A study on ureido containing Carbonic Anhydrase inhibitors. Eur.J.Med.Chem., 212:113035-113035, 2021 Cited by PubMed: 33303238DOI: 10.1016/j.ejmech.2020.113035 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.605 Å) |
Structure validation
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