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TitleHuman Aldose Reductase: How expensive is the opening of the specificity pocket? IDD ligands under investigation
Journal, issue, pagesTo be Published
Publish dateMar 14, 2014 (structure data deposition date)
AuthorsRechlin, C. / Heine, A. / Scheer, F. / Toth, P. / Diederich, W. / Klebe, G.
External linksSearch PubMed
MethodsX-ray diffraction
Resolution1.14 Å
Structure data

PDB-4puu:
Human Aldose Reductase complexed with a ligand with an IDD structure (2-(2-carbamoyl-5-fluoro-phenoxy)acetic acid) at 1.14 A
Method: X-RAY DIFFRACTION / Resolution: 1.14 Å

Chemicals

ChemComp-NAP:
NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE

ChemComp-2WR:
(2-carbamoyl-5-fluorophenoxy)acetic acid

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsOxidoreductase/Oxidoreductase inhibitor / Tim Barrel / Oxidoreductase / Oxidoreductase-Oxidoreductase inhibitor complex

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