4pkf

X-ray diffraction
2Å resolution

Benzylsuccinate synthase alpha-beta-gamma complex

Released:

Function and Biology Details

Reaction catalysed:
Toluene + fumarate = benzylsuccinate
Biochemical function:
Biological process:
  • not assigned
Cellular component:
  • not assigned

Structure analysis Details

Assembly composition:
hetero hexamer (preferred)
Entry contents:
3 distinct polypeptide molecules
Macromolecules (3 distinct):
TutD Chain: A
Molecule details ›
Chain: A
Length: 878 amino acids
Theoretical weight: 99.12 KDa
Source organism: Thauera aromatica
Expression system: Escherichia coli BL21(DE3)
UniProt:
  • Canonical: O68395 (Residues: 1-864; Coverage: 100%)
Gene name: tutD
Sequence domains:
BssB_TutG domain-containing protein Chain: B
Molecule details ›
Chain: B
Length: 81 amino acids
Theoretical weight: 9.3 KDa
Source organism: Thauera aromatica
Expression system: Escherichia coli BL21(DE3)
UniProt:
  • Canonical: O68396 (Residues: 1-81; Coverage: 100%)
Gene name: tutG
Sequence domains: Benzylsuccinate synthase beta subunit
TutF Chain: C
Molecule details ›
Chain: C
Length: 60 amino acids
Theoretical weight: 6.87 KDa
Source organism: Thauera aromatica
Expression system: Escherichia coli BL21(DE3)
UniProt:
  • Canonical: O68394 (Residues: 1-60; Coverage: 100%)
Gene name: tutF
Sequence domains: BssC/TutF protein

Ligands and Environments

3 bound ligands:

No modified residues

Experiments and Validation Details

Entry percentile scores
X-ray source: ALS BEAMLINE 8.2.2
Spacegroup: I222
Unit cell:
a: 113.424Å b: 120.421Å c: 136.048Å
α: 90° β: 90° γ: 90°
R-values:
R R work R free
0.131 0.129 0.177
Expression system: Escherichia coli BL21(DE3)