3MMF

Crystal structure of human carbonic anhydrase II in complex with a 1,3,5-triazine-substituted benzenesulfonamide inhibitor

Summary for 3MMF

• Entry DOI: 10.2210/pdb3mmf/pdb
• Related: 3ML2
• Descriptor: Carbonic anhydrase 2, ZINC ION, 4-({4-chloro-6-[(2-hydroxyethyl)amino]-1,3,5-triazin-2-yl}amino)benzenesulfonamide, ... (5 entities in total)
• Functional Keywords: zinc metalloenzyme, inhibitor, sulfonamide, metal-binding, triazine, 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: 29791.34

Authors

Avvaru, B.S.,Wagner, J.,Robbins, A.H.,Mckenna, R. (deposition date: 2010-04-19, release date: 2011-04-20, Last modification date: 2023-09-06)

• Primary citation: Carta, F.,Garaj, V.,Maresca, A.,Wagner, J.,Avvaru, B.S.,Robbins, A.H.,Scozzafava, A.,McKenna, R.,Supuran, C.T.; Sulfonamides incorporating 1,3,5-triazine moieties selectively and potently inhibit carbonic anhydrase transmembrane isoforms IX, XII and XIV over cytosolic isoforms I and II: Solution and X-ray crystallographic studies.; Bioorg.Med.Chem., 19:3105-3119, 2011; PubMed: 21515057; DOI: 10.1016/j.bmc.2011.04.005

Experimental method

X-RAY DIFFRACTION (1.5 Å)