5LLA

Crystal structure of human carbonic anhydrase isozyme XIII with 4-(1H-benzimidazol-1-ylacetyl)-2-chlorobenzenesulfonamide

Summary for 5LLA

Entry DOI	10.2210/pdb5lla/pdb
Related	5LL4 5LL5 5LL9
Descriptor	Carbonic anhydrase 13, ZINC ION, 4-[2-(benzimidazol-1-yl)ethanoyl]-2-chloranyl-benzenesulfonamide, ... (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	60565.42
Authors	Smirnov, A.,Manakova, E.,Grazulis, S. (deposition date: 2016-07-27, release date: 2017-08-16, Last modification date: 2024-01-10)
Primary citation	Capkauskaite, E.,Linkuviene, V.,Smirnov, A.,Milinaviciute, G.,Timm, D.,Kasiliauskaite, A.,Manakova, E.,Grazulis, S.,Matulis, D. Combinatorial Design of Isoform-Selective N-Alkylated Benzimidazole-Based Inhibitors of Carbonic Anhydrases Chemistryselect, 2017 Cited by DOI: 10.1002/slct.201700531 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.5 Å)

Structure validation