7K6L

Carbonic Anhydrase II complexed with 4-(2-(3-(4-fluorophenyl)ureido)ethylsulfonamido)benzenesulfonamide

Summary for 7K6L

Entry DOI	10.2210/pdb7k6l/pdb
Descriptor	Carbonic anhydrase 2, ZINC ION, 4-{[(2-{[(4-fluorophenyl)carbamoyl]amino}ethyl)sulfonyl]amino}benzene-1-sulfonamide, ... (4 entities in total)
Functional Keywords	carbonic anhydrase, caii, caix inhibitor, structure guided drug design, structure activity relationship study, breast cancer, lyase, lyase-lyase inhibitor complex, lyase/lyase inhibitor
Biological source	Homo sapiens (Human)
Total number of polymer chains	1
Total formula weight	30603.82
Authors	Andring, J.T.,Singh, S.,McKenna, R. (deposition date: 2020-09-21, release date: 2020-12-23, Last modification date: 2023-10-18)
Primary citation	Akgul, O.,Singh, S.,Andring, J.T.,McKenna, R.,Selleri, S.,Carta, F.,Angeli, A.,Supuran, C.T. Handling drug-target selectivity: A study on ureido containing Carbonic Anhydrase inhibitors. Eur.J.Med.Chem., 212:113035-113035, 2021 Cited by PubMed: 33303238 DOI: 10.1016/j.ejmech.2020.113035 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.655 Å)

Structure validation