4WUP

Crystal structure of human carbonic anhydrase isozyme I with 4-[(2-Hydroxyethyl)thio]benzenesulfonamide

Summary for 4WUP

• Entry DOI: 10.2210/pdb4wup/pdb
• Related: 4WR7
• Descriptor: Carbonic anhydrase 1, ZINC ION, 4-[(2-hydroxyethyl)sulfanyl]benzenesulfonamide, ... (6 entities in total)
• Functional Keywords: drug design, lyase, benzenesulfonamide, metal-binding, lyase-lyase inhibitor complex
• Biological source: Homo sapiens (Human)
• Cellular location: Cytoplasm: P00915
• Total number of polymer chains: 2
• Total formula weight: 58432.81

Authors

Smirnov, A.,Manakova, E.,Grazulis, S. (deposition date: 2014-11-03, release date: 2015-07-01, Last modification date: 2024-01-10)

• Primary citation: Zubriene, A.,Smirnoviene, J.,Smirnov, A.,Morkunaite, V.,Michailoviene, V.,Jachno, J.,Juozapaitiene, V.,Norvaisas, P.,Manakova, E.,Grazulis, S.,Matulis, D.; Intrinsic thermodynamics of 4-substituted-2,3,5,6-tetrafluorobenzenesulfonamide binding to carbonic anhydrases by isothermal titration calorimetry.; Biophys.Chem., 205:51-65, 2015; PubMed: 26079542; DOI: 10.1016/j.bpc.2015.05.009

Experimental method

X-RAY DIFFRACTION (1.75 Å)