3OY0

Human Carbonic Anhydrase II complexed with 1-(4-(4-(2-(ISOPROPYLSULFONYL)PHENYLAMINO)-1H-PYRROLO[2,3-B]PYRIDIN-6-YLAMINO)-3-METHOXYPHENYL)PIPERIDIN-4-OL

Summary for 3OY0

• Entry DOI: 10.2210/pdb3oy0/pdb
• Related: 3OYQ 3OYS
• Descriptor: Carbonic anhydrase 2, ZINC ION, (2S)-2-tert-butyl-N-(4-sulfamoylphenyl)pentanamide, ... (6 entities in total)
• Functional Keywords: benzene sulfonamide, drug interaction, 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: 29837.13

Authors

Aggarwal, M.,McKenna, R. (deposition date: 2010-09-22, release date: 2011-08-10, Last modification date: 2023-09-06)

• Primary citation: Hen, N.,Bialer, M.,Yagen, B.,Maresca, A.,Aggarwal, M.,Robbins, A.H.,McKenna, R.,Scozzafava, A.,Supuran, C.T.; Anticonvulsant 4-aminobenzenesulfonamide derivatives with branched-alkylamide moieties: X-ray crystallography and inhibition studies of human carbonic anhydrase isoforms I, II, VII, and XIV.; J.Med.Chem., 54:3977-3981, 2011; PubMed: 21506569; DOI: 10.1021/jm200209n

Experimental method

X-RAY DIFFRACTION (1.6 Å)