4HT2

Crystal structure of human carbonic anhydrase isozyme XII with the inhibitor.

Summary for 4HT2

Entry DOI	10.2210/pdb4ht2/pdb
Descriptor	Carbonic anhydrase 12, ZINC ION, 4-[(4,6-dimethylpyrimidin-2-yl)thio]-2,3,5,6-tetrafluorobenzenesulfonamide, ... (6 entities in total)
Functional Keywords	drug design, carbonic anhydrase, benzenesulfonamide, metal-binding, lyase-lyase inhibitor complex, catalytic activity, carbon-oxygen lyase activity, carbonate dehydratase activity, membrane, lyase/lyase inhibitor
Biological source	Homo sapiens (human)
Cellular location	Membrane; Single-pass type I membrane protein: O43570
Total number of polymer chains	4
Total formula weight	122463.45
Authors	Smirnov, A.,Manakova, E.,Grazulis, S. (deposition date: 2012-10-31, release date: 2013-04-10, Last modification date: 2023-09-20)
Primary citation	Dudutiene, V.,Zubriene, A.,Smirnov, A.,Gylyte, J.,Timm, D.,Manakova, E.,Grazulis, S.,Matulis, D. 4-Substituted-2,3,5,6-tetrafluorobenzenesulfonamides as inhibitors of carbonic anhydrases I, II, VII, XII, and XIII. Bioorg.Med.Chem., 21:2093-2106, 2013 Cited by PubMed: 23394791 DOI: 10.1016/j.bmc.2013.01.008 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.45 Å)

Structure validation