7bfu

X-ray diffraction
1.65Å resolution

Thermogutta terrifontis esterase 2 phosphonylated by sarin

Released:

Function and Biology Details

Reaction catalysed:
A carboxylic ester + H(2)O = an alcohol + a carboxylate
Biochemical function:
  • not assigned
Biological process:
  • not assigned
Cellular component:
  • not assigned

Structure analysis Details

Assembly composition:
monomeric (preferred)
Entry contents:
1 distinct polypeptide molecule
Macromolecule:
Abhydrolase_3 domain-containing protein Chain: A
Molecule details ›
Chain: A
Length: 287 amino acids
Theoretical weight: 31.74 KDa
Source organism: Thermogutta terrifontis
Expression system: Escherichia coli BL21
UniProt:
  • Canonical: A0A286RIX1 (Residues: 24-309; Coverage: 100%)
Gene name: THTE_3306
Sequence domains: BD-FAE

Ligands and Environments

1 bound ligand:
1 modified residue:

Experiments and Validation Details

Entry percentile scores
X-ray source: SOLEIL BEAMLINE PROXIMA 2
Spacegroup: P212121
Unit cell:
a: 52.86Å b: 67.71Å c: 75.71Å
α: 90° β: 90° γ: 90°
R-values:
R R work R free
0.18 0.178 0.22
Expression system: Escherichia coli BL21