› 4df2

X-ray diffraction
2.02Å resolution

P. stipitis OYE2.6 complexed with p-Chlorophenol

Released:
DOI: 10.2210/pdb4df2/pdb
PDB entry 4df2 coloured by chain, front view.
PDB entry 4df2 coloured by chain, side view.
PDB entry 4df2 coloured by chain, top view.
Source organism: Scheffersomyces stipitis CBS 6054
Primary publication:
Structural and Catalytic Characterization of Pichia stipitis OYE 2.6, a Useful Biocatalyst for Asymmetric Alkene Reductions
Pompeu YA, Sullivan B, Walton A, Stewart JD
Adv. Synth. Catal. (2012)

Function and Biology Details

Biochemical function:
Biological process:
  • not assigned
Cellular component:
Sequence domains:

Structure analysis Details

Assembly composition:
homo dimer (preferred)
Assembly name:
PDBe Complex ID:
PDB-CPX-107165 (preferred)
Entry contents:
1 distinct polypeptide molecule
Macromolecule:
NADH:flavin oxidoreductase/NADH oxidase N-terminal domain-containing protein Chain: A
Molecule details ›
Chain: A
Length: 407 amino acids
Theoretical weight: 45.33 KDa
Source organism: Scheffersomyces stipitis CBS 6054
Expression system: Escherichia coli BL21(DE3)
UniProt:
  • Canonical: A3LT82 (Residues: 1-407; Coverage: 100%)
Gene names: OYE2.6, PICST_44614
Sequence domains: NADH:flavin oxidoreductase / NADH oxidase family
Structure domains: Aldolase class I

Ligands and Environments

4 bound ligands:
Ligand FMN 1 x FMN
Ligand MLA 2 x MLA
Ligand NA 2 x NA
Ligand 4CH 1 x 4CH
No modified residues

Experiments and Validation Details

Entry percentile scores
X-ray source: RIGAKU
Spacegroup: P6322
Unit cell:
a: 127.736Å b: 127.736Å c: 123.646Å
α: 90° β: 90° γ: 120°
R-values:
R R work R free
0.164 0.16 0.198
Expression system: Escherichia coli BL21(DE3)

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