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Structure paper

TitleA Fluorescence Polarization Assay for Binding to Macrophage Migration Inhibitory Factor and Crystal Structures for Complexes of Two Potent Inhibitors.
Journal, issue, pagesJ. Am. Chem. Soc., Vol. 138, Page 8630-8638, Year 2016
Publish dateJan 28, 2016 (structure data deposition date)
AuthorsCisneros, J.A. / Robertson, M.J. / Valhondo, M. / Jorgensen, W.L.
External linksJ. Am. Chem. Soc. / PubMed:27299179
MethodsX-ray diffraction
Resolution1.75 Å
Structure data

PDB-5hvs:
Crystal Structure of Macrophage Migration Inhibitory Factor (MIF) with a Biaryltriazole Inhibitor (3i-305)
Method: X-RAY DIFFRACTION / Resolution: 1.75 Å

PDB-5hvt:
Crystal Structure of Macrophage Migration Inhibitory Factor (MIF) with a Potent Inhibitor (NVS-2)
Method: X-RAY DIFFRACTION / Resolution: 1.75 Å

Chemicals

ChemComp-SO4:
SULFATE ION

ChemComp-65V:
3-({2-[1-(3-fluoro-4-hydroxyphenyl)-1H-1,2,3-triazol-4-yl]quinolin-5-yl}oxy)benzoic acid

ChemComp-GOL:
GLYCEROL

ChemComp-HOH:
WATER

ChemComp-NVS:
7-hydroxy-3-(4-methoxyphenyl)-3,4-dihydro-2H-1,3-benzoxazin-2-one

ChemComp-IPA:
ISOPROPYL ALCOHOL / alkaloid*YM

Source
  • homo sapiens (human)
KeywordsISOMERASE/ISOMERASE inhibitor / Cytokine / Inhibitor / Complex / CYTOKINE-CYTOKINE inhibitor complex / ISOMERASE-ISOMERASE inhibitor complex

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