› 3hgj

X-ray diffraction
2Å resolution

Old Yellow Enzyme from Thermus scotoductus SA-01 complexed with p-hydroxy-benzaldehyde

Released:
DOI: 10.2210/pdb3hgj/pdb
PDB entry 3hgj coloured by chain, front view.
PDB entry 3hgj coloured by chain, side view.
PDB entry 3hgj coloured by chain, top view.
Source organism: Thermus scotoductus
Primary publication:
Crystal structure of a thermostable old yellow enzyme from Thermus scotoductus SA-01.
Opperman DJ, Sewell BT, Litthauer D, Isupov MN, Littlechild JA, van Heerden E
Biochem Biophys Res Commun 393 426-31 (2010)
PMID: 20138824

Function and Biology Details

Reaction catalysed: 
NADPH + acceptor = NADP(+) + 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-109157 (preferred)
Entry contents:
1 distinct polypeptide molecule
Macromolecule:
NADH:flavin oxidoreductase/NADH oxidase N-terminal domain-containing protein Chains: A, B, C, D
Molecule details ›
Chains: A, B, C, D
Length: 349 amino acids
Theoretical weight: 38.03 KDa
Source organism: Thermus scotoductus
Expression system: Escherichia coli BL21(DE3)
UniProt:
  • Canonical: B0JDW3 (Residues: 1-349; Coverage: 100%)
Gene name: chrR
Sequence domains: NADH:flavin oxidoreductase / NADH oxidase family
Structure domains: Aldolase class I

Ligands and Environments


Cofactor: Ligand FMN 4 x FMN
1 bound ligand:
Ligand HBA 4 x HBA
No modified residues

Experiments and Validation Details

Entry percentile scores
X-ray source: ESRF BEAMLINE BM14
Spacegroup: P2
Unit cell:
a: 98.703Å b: 101.169Å c: 101.336Å
α: 90° β: 114.32° γ: 90°
R-values:
R R work R free
0.202 0.199 0.259
Expression system: Escherichia coli BL21(DE3)

Quick links

Citations

1 review citation

Asymmetric bioreduction of activated alkenes to industrially relevant optically active compounds.
Winkler et al. (2012)
29 other articles

1 mention without citation

The oxygenating constituent of 3,6-diketocamphane monooxygenase from the CAM plasmid of Pseudomonas putida: the first crystal structure of a type II Baeyer-Villiger monooxygenase.
Isupov et al. (2015)