6F3B

Crystal structure of human carbonic anhydrase I in complex with the 1-(2-hydroxy-5-sulfamoylphenyl)-3-[(4-methylphenyl)methyl]urea inhibitor

Summary for 6F3B

• Entry DOI: 10.2210/pdb6f3b/pdb
• Descriptor: Carbonic anhydrase 1, ZINC ION, 1-[(4-methylphenyl)methyl]-3-(2-oxidanyl-5-sulfamoyl-phenyl)urea, ... (6 entities in total)
• Functional Keywords: lyase
• Biological source: Homo sapiens (Human)
• Total number of polymer chains: 2
• Total formula weight: 59008.32

Authors

Ferraroni, M.,Supuran, C.T.,Chiapponi, D.,Bozdag, M. (deposition date: 2017-11-28, release date: 2018-10-10, Last modification date: 2024-01-17)

• Primary citation: Bozdag, M.,Carta, F.,Ceruso, M.,Ferraroni, M.,McDonald, P.C.,Dedhar, S.,Supuran, C.T.; Discovery of 4-Hydroxy-3-(3-(phenylureido)benzenesulfonamides as SLC-0111 Analogues for the Treatment of Hypoxic Tumors Overexpressing Carbonic Anhydrase IX.; J. Med. Chem., 61:6328-6338, 2018; PubMed: 29962205; DOI: 10.1021/acs.jmedchem.8b00770

Experimental method

X-RAY DIFFRACTION (1.4 Å)