› 4usa

X-ray diffraction
1.13Å resolution

Aldehyde Oxidoreductase from Desulfovibrio gigas (MOP), soaked with trans-cinnamaldehyde

Released:
DOI: 10.2210/pdb4usa/pdb
PDB entry 4usa coloured by chain, front view.
PDB entry 4usa coloured by chain, side view.
PDB entry 4usa coloured by chain, top view.
Source organism: Megalodesulfovibrio gigas
Primary publication:
Aromatic aldehydes at the active site of aldehyde oxidoreductase from Desulfovibrio gigas: reactivity and molecular details of the enzyme-substrate and enzyme-product interaction.
Correia HD, Marangon J, Brondino CD, Moura JJ, Romão MJ, González PJ, Santos-Silva T
J Biol Inorg Chem 20 219-29 (2015)
PMID: 25261288

Function and Biology Details

Reaction catalysed: 
An aldehyde + H(2)O + acceptor = a carboxylate + reduced acceptor
Biochemical function:
Biological process:
  • not assigned
Cellular component:
  • not assigned
Sequence domains:

Structure analysis Details

Assembly composition:
homo dimer (preferred)
Assembly name:
PDBe Complex ID:
PDB-CPX-175125 (preferred)
Entry contents:
1 distinct polypeptide molecule
Macromolecule:

Ligands and Environments

7 bound ligands:
Ligand FES 2 x FES
Ligand IPA 1 x IPA
Ligand BCT 1 x BCT
Ligand MG 4 x MG
Ligand CL 2 x CL
Ligand PCD 1 x PCD
Ligand HCI 1 x HCI
1 modified residue:
Ligand CSO 1 x CSO

Experiments and Validation Details

Entry percentile scores
X-ray source: SOLEIL BEAMLINE PROXIMA 1
Spacegroup: P6122
Unit cell:
a: 143.143Å b: 143.143Å c: 161.954Å
α: 90° β: 90° γ: 120°
R-values:
R R work R free
0.103 0.102 0.122

Quick links

Citations

1 review citation

The History of Desulfovibrio gigas Aldehyde Oxidoreductase-A Personal View.
Moura JJG. (2023)
2 other articles