5JQ0
Crystal structure of human carbonic anhydrase II in complex with Benzoxaborole at pH=8.7
Summary for 5JQ0
Entry DOI | 10.2210/pdb5jq0/pdb |
Descriptor | Carbonic anhydrase 2, ZINC ION, 1,1-dihydroxy-1,3-dihydro-2,1-benzoxaborol-1-ium, ... (4 entities in total) |
Functional Keywords | benzoxaborole, lyase, boron, zinc, carbonate dehydratase |
Biological source | Homo sapiens (Human) |
Total number of polymer chains | 1 |
Total formula weight | 29693.66 |
Authors | Alterio, V.,Esposito, D.,Di Fiore, A.,De Simone, G. (deposition date: 2016-05-04, release date: 2016-10-19, Last modification date: 2024-01-10) |
Primary citation | Alterio, V.,Cadoni, R.,Esposito, D.,Vullo, D.,Fiore, A.D.,Monti, S.M.,Caporale, A.,Ruvo, M.,Sechi, M.,Dumy, P.,Supuran, C.T.,Simone, G.,Winum, J.Y. Benzoxaborole as a new chemotype for carbonic anhydrase inhibition. Chem.Commun.(Camb.), 52:11983-11986, 2016 Cited by PubMed: 27722534DOI: 10.1039/c6cc06399c PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.4 Å) |
Structure validation
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