4QSA

Crystal structure of human carbonic anhydrase isozyme II with 2-chloro-4-{[(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)thio]acetyl}benzenesulfonamide

Summary for 4QSA

Entry DOI	10.2210/pdb4qsa/pdb
Related	4QSB 4QSI 4QSJ
Descriptor	Carbonic anhydrase 2, ZINC ION, 2-chloro-4-{[(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetyl}benzenesulfonamide, ... (7 entities in total)
Functional Keywords	drug design, carbonic anhydrase, benzenesulfonamide, metal-binding, 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	30107.80
Authors	Smirnov, A.,Manakova, E.,Grazulis, S. (deposition date: 2014-07-03, release date: 2015-01-21, Last modification date: 2023-11-08)
Primary citation	Kisonaite, M.,Zubriene, A.,Capkauskaite, E.,Smirnov, A.,Smirnoviene, J.,Kairys, V.,Michailoviene, V.,Manakova, E.,Grazulis, S.,Matulis, D. Intrinsic Thermodynamics and Structure Correlation of Benzenesulfonamides with a Pyrimidine Moiety Binding to Carbonic Anhydrases I, II, VII, XII, and XIII Plos One, 9:e114106-e114106, 2014 Cited by PubMed: 25493428 DOI: 10.1371/journal.pone.0114106 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.501 Å)

Structure validation