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TitleHistidine-51 facilitates deprotonation of the zinc-bound ligand during catalysis by horse liver alcohol dehydrogenase
Journal, issue, pagesTo Be Published
Publish dateFeb 5, 2023 (structure data deposition date)
AuthorsPlapp, B.V. / Kovaleva, E.G.
External linksSearch PubMed
MethodsX-ray diffraction
Resolution1.2 - 1.47 Å
Structure data

PDB-8g2l:
Horse liver alcohol dehydrogense His-51 Gln form complexed with NAD+ and 2,2,2-trifluoroethanol
Method: X-RAY DIFFRACTION / Resolution: 1.42 Å

PDB-8g2s:
Horse liver alcohol dehydrogense His-51-Gln form complexed with NAD+ and capric acid
Method: X-RAY DIFFRACTION / Resolution: 1.45 Å

PDB-8g2x:
Horse liver alcohol dehydrogense His-51-Gln form complexed with NAD+ and pyrazole
Method: X-RAY DIFFRACTION / Resolution: 1.47 Å

PDB-8g39:
Horse liver alcohol dehydrogense His-51-Gln form complexed with NADH and N-cyclohexylformamide
Method: X-RAY DIFFRACTION / Resolution: 1.42 Å

PDB-8g4v:
Horse liver alcohol dehydrogense His-51-Gln form complexed with NAD+ and 2,3,4,5,6-pentafluorobenzyl alcohol
Method: X-RAY DIFFRACTION / Resolution: 1.2 Å

Chemicals

ChemComp-ZN:
Unknown entry

ChemComp-NAJ:
NICOTINAMIDE-ADENINE-DINUCLEOTIDE (ACIDIC FORM)

ChemComp-ETF:
TRIFLUOROETHANOL

ChemComp-MPD:
(4S)-2-METHYL-2,4-PENTANEDIOL / precipitant*YM

ChemComp-MRD:
(4R)-2-METHYLPENTANE-2,4-DIOL / precipitant*YM

ChemComp-HOH:
WATER

ChemComp-DKA:
DECANOIC ACID

ChemComp-PZO:
PYRAZOLE

ChemComp-NAI:
1,4-DIHYDRONICOTINAMIDE ADENINE DINUCLEOTIDE

ChemComp-CXF:
CYCLOHEXYLFORMAMIDE

ChemComp-PFB:
2,3,4,5,6-PENTAFLUOROBENZYL ALCOHOL

Source
  • equus caballus (horse)
KeywordsOXIDOREDUCTASE / alcohol dehydrogenase horse liver His-48 Gln substitution complex with NAD+ and trifluoroethanol / alcohol dehydrogenase horse liver His-51 Gln substitution complex with NAD+ and capric acid / alcohol dehydrogenase horse liver His-48 Gln substitution complex with NAD+ and pyrazole / alcohol dehydrogenase horse liver His-51-Gln substitution complex with NADH and N-cyclohexylformamide / alcohol dehydrogenase horse liver His-51- Gln substitution / complex with NAD+ and pentafluorobenzyl alcohol

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