7Q0C

Mimic carbonic anhydrase IX in complex with Methyl 2-chloro-4-(cyclohexylsulfanyl)-5-sulfamoylbenzoate

Summary for 7Q0C

• Entry DOI: 10.2210/pdb7q0c/pdb
• Descriptor: Carbonic anhydrase 2, ZINC ION, methyl 2-chloranyl-4-cyclohexylsulfanyl-5-sulfamoyl-benzoate, ... (6 entities in total)
• Functional Keywords: drug design, carbonic anhydrase, benzenesulfonamide, metal-binding, lyase-lyase inhibitor complex, lyase
• Biological source: Homo sapiens (Human)
• Total number of polymer chains: 2
• Total formula weight: 59559.87

Authors

Paketuryte-Latve, V.,Smirnov, A.,Manakova, E.,Grazulis, S. (deposition date: 2021-10-14, release date: 2022-01-12, Last modification date: 2024-01-31)

• Primary citation: Zaksauskas, A.,Capkauskaite, E.,Paketuryte-Latve, V.,Smirnov, A.,Leitans, J.,Kazaks, A.,Dvinskis, E.,Stancaitis, L.,Mickeviciute, A.,Jachno, J.,Jezepcikas, L.,Linkuviene, V.,Sakalauskas, A.,Manakova, E.,Grazulis, S.,Matuliene, J.,Tars, K.,Matulis, D.; Methyl 2-Halo-4-Substituted-5-Sulfamoyl-Benzoates as High Affinity and Selective Inhibitors of Carbonic Anhydrase IX.; Int J Mol Sci, 23:-, 2021; PubMed: 35008553; DOI: 10.3390/ijms23010130

Experimental method

X-RAY DIFFRACTION (1.12 Å)