› 3hi4

X-ray diffraction
2.25Å resolution

Switching catalysis from hydrolysis to perhydrolysis in P. fluorescens esterase

Released:
DOI: 10.2210/pdb3hi4/pdb
PDB entry 3hi4 coloured by chain, front view.
PDB entry 3hi4 coloured by chain, side view.
PDB entry 3hi4 coloured by chain, top view.
Source organism: Pseudomonas fluorescens
Primary publication:
Switching catalysis from hydrolysis to perhydrolysis in Pseudomonas fluorescens esterase.
Yin DL, Bernhardt P, Morley KL, Jiang Y, Cheeseman JD, Purpero V, Schrag JD, Kazlauskas RJ
Biochemistry 49 1931-42 (2010)
PMID: 20112920

Function and Biology Details

Reaction catalysed: 
A phenyl acetate + H(2)O = a phenol + acetate
Biochemical function:
Biological process:
Cellular component:
  • not assigned
Sequence domains:

Structure analysis Details

Assembly composition:
homo trimer (preferred)
Assembly name:
PDBe Complex ID:
PDB-CPX-149815 (preferred)
Entry contents:
1 distinct polypeptide molecule
Macromolecule:
Arylesterase Chains: A, B, C, D, E, F
Molecule details ›
Chains: A, B, C, D, E, F
Length: 271 amino acids
Theoretical weight: 29.98 KDa
Source organism: Pseudomonas fluorescens
Expression system: Escherichia coli
UniProt:
  • Canonical: P22862 (Residues: 2-272; Coverage: 100%)
Gene name: estF
Sequence domains: alpha/beta hydrolase fold
Structure domains: alpha/beta hydrolase

Ligands and Environments

3 bound ligands:
Ligand ACT 10 x ACT
Ligand SO4 5 x SO4
Ligand GOL 20 x GOL
No modified residues

Experiments and Validation Details

Entry percentile scores
X-ray source: RIGAKU MICROMAX-007 HF
Spacegroup: P32
Unit cell:
a: 145.49Å b: 145.49Å c: 129.99Å
α: 90° β: 90° γ: 120°
R-values:
R R work R free
0.166 0.165 0.202
Expression system: Escherichia coli

Quick links

Citations

7 review citations

Biocatalytic Oxidation Reactions: A Chemist's Perspective.
Dong et al. (2018)
6 more

5 mentions without citation

BioLiP: a semi-manually curated database for biologically relevant ligand-protein interactions.
Yang et al. (2013)
4 more