5N0E
Crystal structure of human carbonic anhydrase II in complex with (S)-4-(6,7-dihydroxy-1-phenyl-3,4-tetrahydroisoquinoline-1H-2-carbonyl)benzenesulfonamide.
Summary for 5N0E
Entry DOI | 10.2210/pdb5n0e/pdb |
Descriptor | Carbonic anhydrase 2, ZINC ION, 4-[[(1~{S})-6,7-bis(oxidanyl)-1-phenyl-3,4-dihydro-1~{H}-isoquinolin-2-yl]carbonyl]benzenesulfonamide, ... (4 entities in total) |
Functional Keywords | human carbonic anhydrase, benzesulfonamide, protein-inhibitor adduct, lyase |
Biological source | Homo sapiens (Human) |
Cellular location | Cytoplasm : P00918 |
Total number of polymer chains | 1 |
Total formula weight | 29967.19 |
Authors | Di Fiore, A.,De Simone, G. (deposition date: 2017-02-02, release date: 2017-05-10, Last modification date: 2024-01-17) |
Primary citation | Bruno, E.,Buemi, M.R.,Di Fiore, A.,De Luca, L.,Ferro, S.,Angeli, A.,Cirilli, R.,Sadutto, D.,Alterio, V.,Monti, S.M.,Supuran, C.T.,De Simone, G.,Gitto, R. Probing Molecular Interactions between Human Carbonic Anhydrases (hCAs) and a Novel Class of Benzenesulfonamides. J. Med. Chem., 60:4316-4326, 2017 Cited by PubMed: 28453941DOI: 10.1021/acs.jmedchem.7b00264 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.75 Å) |
Structure validation
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