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: 27722534 DOI: 10.1039/c6cc06399c PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.4 Å)

Structure validation