5DOG

Crystal structure of human carbonic anhydrase isozyme II with 2-(Benzylamino)-3,5,6-trifluoro-4-[(2-phenylethyl)thio]benzene- sulfonamide

Summary for 5DOG

Entry DOI	10.2210/pdb5dog/pdb
Descriptor	Carbonic anhydrase 2, ZINC ION, BICINE, ... (6 entities in total)
Functional Keywords	drug design, carbonic anhydrase, benzenesulfonamide, metal-binding, lyase-lyase inhibitor complex, lyase
Biological source	Homo sapiens (Human)
Cellular location	Cytoplasm : P00918
Total number of polymer chains	1
Total formula weight	30165.39
Authors	Smirnov, A.,Manakova, E.,Grazulis, S. (deposition date: 2015-09-11, release date: 2016-09-28, Last modification date: 2024-01-10)
Primary citation	Zubriene, A.,Smirnov, A.,Dudutiene, V.,Timm, D.D.,Matuliene, J.,Michailoviene, V.,Zaksauskas, A.,Manakova, E.,Grazulis, S.,Matulis, D. Intrinsic Thermodynamics and Structures of 2,4- and 3,4-Substituted Fluorinated Benzenesulfonamides Binding to Carbonic Anhydrases. ChemMedChem, 12:161-176, 2017 Cited by PubMed: 28001003 DOI: 10.1002/cmdc.201600509 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.7 Å)

Structure validation