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Structure paper

TitleHuman Aldose Reductase Mutant L300A in Complex with a Ligand with an IDD Structure (3-({[2-(carboxymethoxy)-4-fluorobenzoyl]amino}methyl)benzoic acid)
Journal, issue, pagesTo Be Published
Publish dateJan 14, 2020 (structure data deposition date)
AuthorsHubert, L.-S. / Ley, M. / Scheer, F. / Diederich, W. / Heine, A. / Klebe, G.
External linksSearch PubMed
MethodsX-ray diffraction
Resolution0.95 Å
Structure data

PDB-6txp:
Human Aldose Reductase Mutant L300A in Complex with a Ligand with an IDD Structure (3-({[2-(carboxymethoxy)-4-fluorobenzoyl]amino}methyl)benzoic acid)
Method: X-RAY DIFFRACTION / Resolution: 0.95 Å

Chemicals

ChemComp-CIT:
CITRIC ACID

ChemComp-4G7:
3-({[2-(carboxymethoxy)-4-fluorobenzoyl]amino}methyl)benzoic acid

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

ChemComp-NAP:
NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsOXIDOREDUCTASE / L300A Mutant / SAR_061 Ligand / hAR / Opened and Closed Transient Pocket

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