4YXO
Human Carbonic Anhydrase II complexed with an inhibitor with a benzenesulfonamide group (3).
Summary for 4YXO
| Entry DOI | 10.2210/pdb4yxo/pdb |
| Related | 4YX4 4YXI |
| Descriptor | Carbonic anhydrase 2, MERCURIBENZOIC ACID, ZINC ION, ... (6 entities in total) |
| Functional Keywords | lyase |
| Biological source | Homo sapiens (Human) |
| Cellular location | Cytoplasm : P00918 |
| Total number of polymer chains | 1 |
| Total formula weight | 30138.75 |
| Authors | Rechlin, C.,Heine, A.,Klebe, G. (deposition date: 2015-03-23, release date: 2016-02-03, Last modification date: 2024-01-10) |
| Primary citation | Gaspari, R.,Rechlin, C.,Heine, A.,Bottegoni, G.,Rocchia, W.,Schwarz, D.,Bomke, J.,Gerber, H.D.,Klebe, G.,Cavalli, A. Kinetic and Structural Insights into the Mechanism of Binding of Sulfonamides to Human Carbonic Anhydrase by Computational and Experimental Studies. J.Med.Chem., 59:4245-4256, 2016 Cited by PubMed: 26700575DOI: 10.1021/acs.jmedchem.5b01643 PDB entries with the same primary citation |
| Experimental method | X-RAY DIFFRACTION (1.06 Å) |
Structure validation
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