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TitleSmall Molecule Disruptors of the Glucokinase-Glucokinase Regulatory Protein Interaction: 1. Discovery of a Novel Tool Compound for in Vivo Proof-of-Concept.
Journal, issue, pagesJ. Med. Chem., Vol. 57, Page 309-324, Year 2014
Publish dateSep 18, 2013 (structure data deposition date)
AuthorsAshton, K.S. / Andrews, K.L. / Bryan, M.C. / Chen, J. / Chen, K. / Chen, M. / Chmait, S. / Croghan, M. / Cupples, R. / Fotsch, C. ...Ashton, K.S. / Andrews, K.L. / Bryan, M.C. / Chen, J. / Chen, K. / Chen, M. / Chmait, S. / Croghan, M. / Cupples, R. / Fotsch, C. / Helmering, J. / Jordan, S.R. / Kurzeja, R.J. / Michelsen, K. / Pennington, L.D. / Poon, S.F. / Sivits, G. / Van, G. / Vonderfecht, S.L. / Wahl, R.C. / Zhang, J. / Lloyd, D.J. / Hale, C. / St Jean, D.J.
External linksJ. Med. Chem. / PubMed:24405172
MethodsX-ray diffraction
Resolution2.5 Å
Structure data

PDB-4msu:
Human GKRP bound to AMG-6861 and Sorbitol-6-phosphate
Method: X-RAY DIFFRACTION / Resolution: 2.5 Å

Chemicals

ChemComp-2EU:
1,1,1,3,3,3-hexafluoro-2-{4-[4-(thiophen-2-ylsulfonyl)piperazin-1-yl]phenyl}propan-2-ol

ChemComp-S6P:
D-SORBITOL-6-PHOSPHATE

ChemComp-IOD:
IODIDE ION

ChemComp-GOL:
GLYCEROL

ChemComp-SO4:
SULFATE ION

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsSUGAR BINDING PROTEIN / SIS domains / Regulatory protein / glucokinase / phospho-fructose

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