2q0s

X-ray diffraction
1.5Å resolution

Structure of the Inhibitor bound form of M. Smegmatis Aryl Esterase

Released:

Function and Biology Details

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

Structure analysis Details

Assembly composition:
homo octamer (preferred)
PDBe Complex ID:
PDB-CPX-106477 (preferred)
Entry contents:
1 distinct polypeptide molecule
Macromolecule:
SGNH hydrolase-type esterase domain-containing protein Chains: A, B, C, D, E, F, G, H
Molecule details ›
Chains: A, B, C, D, E, F, G, H
Length: 216 amino acids
Theoretical weight: 23.45 KDa
Source organism: Mycolicibacterium smegmatis
Expression system: Escherichia coli
UniProt:
  • Canonical: A0R5U7 (Residues: 1-216; Coverage: 100%)
Gene name: MSMEG_6317
Sequence domains: GDSL-like Lipase/Acylhydrolase family
Structure domains: SGNH hydrolase

Ligands and Environments

1 bound ligand:
1 modified residue:

Experiments and Validation Details

Entry percentile scores
X-ray source: ALS BEAMLINE 8.2.1
Spacegroup: P1
Unit cell:
a: 67.754Å b: 80.096Å c: 85.974Å
α: 104.1° β: 112.1° γ: 97.4°
R-values:
R R work R free
0.135 0.134 0.16
Expression system: Escherichia coli