6B1C

Macrophage Migration Inhibitory Factor in complex with a Naphthyridinone Inhibitor (4a)

Summary for 6B1C

• Entry DOI: 10.2210/pdb6b1c/pdb
• Related: 6B1K 6B2C
• Descriptor: Macrophage migration inhibitory factor, SULFATE ION, 2-[1-(3-fluoro-4-hydroxyphenyl)-1H-1,2,3-triazol-4-yl]-7-methyl-1,7-naphthyridin-8(7H)-one, ... (4 entities in total)
• Functional Keywords: cd74 binding, tautomerase, inhibitor, complex, isomerase-isomerase inhibitor complex, isomerase, isomerase/isomerase inhibitor
• Biological source: Homo sapiens (Human)
• Total number of polymer chains: 3
• Total formula weight: 38124.04

Authors

Krimmer, S.G.,Robertson, M.J.,Jorgensen, W.L. (deposition date: 2017-09-18, release date: 2018-01-03, Last modification date: 2023-10-04)

• Primary citation: Dawson, T.K.,Dziedzic, P.,Robertson, M.J.,Cisneros, J.A.,Krimmer, S.G.,Newton, A.S.,Tirado-Rives, J.,Jorgensen, W.L.; Adding a Hydrogen Bond May Not Help: Naphthyridinone vs Quinoline Inhibitors of Macrophage Migration Inhibitory Factor.; ACS Med Chem Lett, 8:1287-1291, 2017; PubMed: 29259749; DOI: 10.1021/acsmedchemlett.7b00384

Experimental method

X-RAY DIFFRACTION (2.163 Å)