X-ray diffraction
2.8Å resolution

X-ray crystal structure of 4-hydroxybenzoyl CoA thioesterase mutant D17N complexed with 4-hydroxybenzoyl CoA


Function and Biology Details

Reaction catalysed:
4-hydroxybenzoyl-CoA + H(2)O = 4-hydroxybenzoate + CoA
Biological process:
  • not assigned
Cellular component:
  • not assigned
Sequence domain:
Structure domain:

Structure analysis Details

Assembly composition:
homo tetramer (preferred)
Entry contents:
1 distinct polypeptide molecule
4-hydroxybenzoyl-CoA thioesterase Chain: A
Molecule details ›
Chain: A
Length: 141 amino acids
Theoretical weight: 16.14 KDa
Source organism: Pseudomonas sp. CBS3
Expression system: Escherichia coli
  • Canonical: P56653 (Residues: 1-141; Coverage: 100%)
Sequence domains: Thioesterase-like superfamily
Structure domains: Hotdog Thioesterase

Ligands and Environments

Cofactor: Ligand BCA 1 x BCA
No bound ligands
No modified residues

Experiments and Validation Details

Entry percentile scores
X-ray source: RIGAKU RU200
Spacegroup: I222
Unit cell:
a: 52.5Å b: 55.8Å c: 93.7Å
α: 90° β: 90° γ: 90°
R R work R free
0.148 0.147 0.247
Expression system: Escherichia coli