4XGK

Crystal structure of UDP-galactopyranose mutase from Corynebacterium diphtheriae in complex with 2-[4-(4-chlorophenyl)-7-(2-thienyl)-2-thia-5,6,8,9-tetrazabicyclo[4.3.0]nona-4,7,9-trien-3-yl]acetic

Summary for 4XGK

• Entry DOI: 10.2210/pdb4xgk/pdb
• Descriptor: UDP-galactopyranose mutase, SULFATE ION, [(7S)-6-(4-chlorophenyl)-3-(thiophen-2-yl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-7-yl]acetic acid, ... (5 entities in total)
• Functional Keywords: udp-galactopyranose mutase, corynebacterium diphtheriae, inhibitor, galactofuranose, isomerase-isomerase inhibitor complex, isomerase/isomerase inhibitor
• Biological source: Corynebacterium diphtheriae
• Total number of polymer chains: 2
• Total formula weight: 93345.25

Authors

Wangkanont, K.,Heroux, A.,Forest, K.T.,Kiessling, L.L. (deposition date: 2014-12-31, release date: 2015-08-12, Last modification date: 2023-09-27)

• Primary citation: Kincaid, V.A.,London, N.,Wangkanont, K.,Wesener, D.A.,Marcus, S.A.,Heroux, A.,Nedyalkova, L.,Talaat, A.M.,Forest, K.T.,Shoichet, B.K.,Kiessling, L.L.; Virtual Screening for UDP-Galactopyranose Mutase Ligands Identifies a New Class of Antimycobacterial Agents.; Acs Chem.Biol., 10:2209-2218, 2015; PubMed: 26214585; DOI: 10.1021/acschembio.5b00370

Experimental method

X-RAY DIFFRACTION (2.652 Å)