6BBS
Joint X-ray/neutron structure of human carbonic anhydrase II in complex with brinzolamide
Summary for 6BBS
Entry DOI | 10.2210/pdb6bbs/pdb |
Descriptor | Carbonic anhydrase 2, ZINC ION, (+)-4-ETHYLAMINO-3,4-DIHYDRO-2-(METHOXY)PROPYL-2H-THIENO[3,2-E]-1,2-THIAZINE-6-SULFONAMIDE-1,1-DIOXIDE, ... (4 entities in total) |
Functional Keywords | drug binding, protonation state, lyase, lyase-lyase inhibitor complex, lyase/lyase inhibitor |
Biological source | Homo sapiens (Human) |
Cellular location | Cytoplasm : P00918 |
Total number of polymer chains | 1 |
Total formula weight | 29737.98 |
Authors | Kovalevsky, A.,Aggarwal, M.,McKenna, R. (deposition date: 2017-10-19, release date: 2018-02-28, Last modification date: 2024-03-13) |
Primary citation | Kovalevsky, A.,Aggarwal, M.,Velazquez, H.,Cuneo, M.J.,Blakeley, M.P.,Weiss, K.L.,Smith, J.C.,Fisher, S.Z.,McKenna, R. "To Be or Not to Be" Protonated: Atomic Details of Human Carbonic Anhydrase-Clinical Drug Complexes by Neutron Crystallography and Simulation. Structure, 26:383-390.e3, 2018 Cited by PubMed: 29429876DOI: 10.1016/j.str.2018.01.006 PDB entries with the same primary citation |
Experimental method | NEUTRON DIFFRACTION X-RAY DIFFRACTION (2 Å) |
Structure validation
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