6YPW
Crystal structure for the complex of human carbonic anhydrase II and 4-((1-(2-(hydroxymethyl)-5-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)tetrahydrofuran-3-yl)-1H-1,2,3-triazol-4-yl)methoxy)benzenesulfonamide
Summary for 6YPW
Entry DOI | 10.2210/pdb6ypw/pdb |
Descriptor | Carbonic anhydrase 2, ZINC ION, 4-[[1-[(2~{S},3~{S},5~{R})-2-(hydroxymethyl)-5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]oxolan-3-yl]-1,2,3-triazol-4-yl]methoxy]benzenesulfonamide, ... (4 entities in total) |
Functional Keywords | carbonic anhydrase inhibitors; azt; telomerase inhibitors; cancer; molecular hybrids; click chemistry; triazole., lyase |
Biological source | Homo sapiens (Human) |
Total number of polymer chains | 1 |
Total formula weight | 29832.95 |
Authors | Angeli, A.,Ferraroni, M. (deposition date: 2020-04-16, release date: 2021-04-28, Last modification date: 2024-01-31) |
Primary citation | Plyasova, A.A.,Berrino, E.,Khan, I.I.,Veselovsky, A.V.,Pokrovsky, V.S.,Angeli, A.,Ferraroni, M.,Supuran, C.T.,Pokrovskaya, M.V.,Alexandrova, S.S.,Gladilina, Y.A.,Sokolov, N.N.,Hilal, A.,Carta, F.,Zhdanov, D.D. Mechanisms of the Antiproliferative and Antitumor Activity of Novel Telomerase-Carbonic Anhydrase Dual-Hybrid Inhibitors. J.Med.Chem., 64:11432-11444, 2021 Cited by PubMed: 34283610DOI: 10.1021/acs.jmedchem.1c00756 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.1 Å) |
Structure validation
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