› 1t0s

X-ray diffraction
2.2Å resolution

Structure of the Toluene/o-Xylene Monooxygenase Hydroxylase with 4-bromophenol bound

Released:
DOI: 10.2210/pdb1t0s/pdb
PDB entry 1t0s coloured by chain, front view.
PDB entry 1t0s coloured by chain, side view.
PDB entry 1t0s coloured by chain, top view.
Source organism: Stutzerimonas stutzeri
Primary publication:
Crystal structure of the toluene/o-xylene monooxygenase hydroxylase from Pseudomonas stutzeri OX1. Insight into the substrate specificity, substrate channeling, and active site tuning of multicomponent monooxygenases.
Sazinsky MH, Bard J, Di Donato A, Lippard SJ
J Biol Chem 279 30600-10 (2004)
PMID: 15096510

Function and Biology Details

Biochemical function:
Biological process:
Cellular component:
  • not assigned
Sequence domains:
Structure domains:

Structure analysis Details

Assemblies composition:
hetero hexamer
hetero trimer (preferred)
PDBe Complex ID:
PDB-CPX-131505 (preferred)
Entry contents:
3 distinct polypeptide molecules
Macromolecules (3 distinct):
YHS domain-containing protein Chain: A
Molecule details ›
Chain: A
Length: 498 amino acids
Theoretical weight: 57.79 KDa
Source organism: Stutzerimonas stutzeri
Expression system: Escherichia coli BL21(DE3)
UniProt:
  • Canonical: O87798 (Residues: 1-498; Coverage: 100%)
Gene name: touA
Sequence domains:
Structure domains: Ribonucleotide Reductase, subunit A
Toluene, o-xylene monooxygenase oxygenase subunit Chain: B
Molecule details ›
Chain: B
Length: 330 amino acids
Theoretical weight: 38.38 KDa
Source organism: Stutzerimonas stutzeri
Expression system: Escherichia coli BL21(DE3)
UniProt:
  • Canonical: O87802 (Residues: 1-330; Coverage: 100%)
Gene name: touE
Sequence domains: Methane/Phenol/Alkene Hydroxylase
Structure domains: Ribonucleotide Reductase, subunit A
Toluene o-xylene monooxygenase component TouB Chain: C
Molecule details ›
Chain: C
Length: 86 amino acids
Theoretical weight: 9.99 KDa
Source organism: Stutzerimonas stutzeri
Expression system: Escherichia coli BL21(DE3)
UniProt:
  • Canonical: O87799 (Residues: 1-86; Coverage: 100%)
Gene name: touB
Sequence domains: Toluene-4-monooxygenase system protein B (TmoB)
Structure domains: TmoB-like

Ligands and Environments

4 bound ligands:
Ligand FE 2 x FE
Ligand OH 1 x OH
Ligand MCR 1 x MCR
Ligand BML 6 x BML
No modified residues

Experiments and Validation Details

Entry percentile scores
X-ray source: ALS BEAMLINE 8.2.2
Spacegroup: P3121
Unit cell:
a: 183.242Å b: 183.242Å c: 67.671Å
α: 90° β: 90° γ: 120°
R-values:
R R work R free
0.236 0.236 0.273
Expression system: Escherichia coli BL21(DE3)

Quick links

Citations

8 review citations

Biology of Pseudomonas stutzeri.
Lalucat et al. (2006)
7 more

4 mentions without citation

The natural history of ubiquitin and ubiquitin-related domains.
Burroughs et al. (2012)
3 more