› 6lql

X-ray diffraction
1.8Å resolution

Complex structure of CHAO with product from Erythrobacteraceae bacterium

Released:
DOI: 10.2210/pdb6lql/pdb
PDB entry 6lql coloured by chain, front view.
PDB entry 6lql coloured by chain, side view.
PDB entry 6lql coloured by chain, top view.
Source organism: Erythrobacteraceae bacterium CCH12-C2
Primary publication:
Asymmetric Synthesis of a Key Dextromethorphan Intermediate and Its Analogues Enabled by a New Cyclohexylamine Oxidase: Enzyme Discovery, Reaction Development, and Mechanistic Insight.
Wu X, Huang Z, Wang Z, Li Z, Wang J, Lin J, Chen F
J Org Chem 85 5598-5614 (2020)
PMID: 32203655

Function and Biology Details

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-167036 (preferred)
Entry contents:
1 distinct polypeptide molecule
Macromolecule:
Amine oxidase Chain: A
Molecule details ›
Chain: A
Length: 453 amino acids
Theoretical weight: 48.99 KDa
Source organism: Erythrobacteraceae bacterium CCH12-C2
Expression system: Escherichia coli

Ligands and Environments

2 bound ligands:
Ligand FAD 1 x FAD
Ligand F0C 1 x F0C
No modified residues

Experiments and Validation Details

Entry percentile scores
X-ray source: EMBL/DESY, HAMBURG BEAMLINE X11
Spacegroup: P43212
Unit cell:
a: 83.205Å b: 83.205Å c: 176.643Å
α: 90° β: 90° γ: 90°
R-values:
R R work R free
0.17 0.169 0.188
Expression system: Escherichia coli

Quick links

Citations

1 citations in other articles

A unified strategy to prostaglandins: chemoenzymatic total synthesis of cloprostenol, bimatoprost, PGF2α, fluprostenol, and travoprost guided by biocatalytic retrosynthesis.
Zhu et al. (2021)