› 1mg0

X-ray diffraction
1.8Å resolution

Horse Liver Alcohol Dehydrogenase Complexed With NAD+ and 2,3-Difluorobenzyl Alcohol

Released:
DOI: 10.2210/pdb1mg0/pdb
PDB entry 1mg0 coloured by chain, front view.
PDB entry 1mg0 coloured by chain, side view.
PDB entry 1mg0 coloured by chain, top view.
Source organism: Equus caballus
Primary publication:
Mobility of fluorobenzyl alcohols bound to liver alcohol dehydrogenases as determined by NMR and X-ray crystallographic studies.
Rubach JK, Plapp BV
Biochemistry 41 15770-9 (2002)
PMID: 12501206

Function and Biology Details

Reaction catalysed: 
A primary alcohol + NAD(+) = an aldehyde + NADH
Biochemical function:
Biological process:
Cellular component:
Sequence domains:
Structure domains:

Structure analysis Details

Assembly composition:
homo dimer (preferred)
Assembly name:
PDBe Complex ID:
PDB-CPX-132405 (preferred)
Entry contents:
1 distinct polypeptide molecule
Macromolecule:
Alcohol dehydrogenase E chain Chains: A, B, C, D
Molecule details ›
Chains: A, B, C, D
Length: 374 amino acids
Theoretical weight: 39.85 KDa
Source organism: Equus caballus
UniProt:
  • Canonical: P00327 (Residues: 2-375; Coverage: 100%)
Sequence domains:
Structure domains:

Ligands and Environments


Cofactor: Ligand NAD 4 x NAD
2 bound ligands:
Ligand ZN 8 x ZN
Ligand DFB 4 x DFB
No modified residues

Experiments and Validation Details

Entry percentile scores
X-ray source: RIGAKU
Spacegroup: P21
Unit cell:
a: 50.114Å b: 180.31Å c: 86.912Å
α: 90° β: 105.99° γ: 90°
R-values:
R R work R free
0.18 0.179 0.214

Quick links

Citations

1 review citation

Relating protein motion to catalysis.
Hammes-Schiffer et al. (2006)
5 other articles

3 mentions without citation

Single-crystal polarized optical absorption spectroscopy of the one-dimensional ferrimagnet MnIICuII(pba)(H2O)3.2H2O (pba = 1,3-propylenebis(oxamato)).
Cador et al. (2000)
2 more