› 6zvv

X-ray diffraction
1.4Å resolution

X-RAY STRUCTURE OF THE HALOALKANE DEHALOGENASE HALOTAG7-P174W LABELED WITH A CHLOROALKANE-TETRAMETHYLRHODAMINE FLUOROPHORE SUBSTRATE

Released:
DOI: 10.2210/pdb6zvv/pdb
PDB entry 6zvv coloured by chain, front view.
PDB entry 6zvv coloured by chain, side view.
PDB entry 6zvv coloured by chain, top view.
Source organism: Rhodococcus sp.
Entry authors: Tarnawski M, Frei M, Hiblot J, Johnsson K

Function and Biology Details

Reaction catalysed: 
1-haloalkane + H(2)O = a primary alcohol + halide
Biochemical function:
Biological process:
Cellular component:
  • not assigned
Sequence domains:

Structure analysis Details

Assembly composition:
monomeric (preferred)
Assembly name:
PDBe Complex ID:
PDB-CPX-141210 (preferred)
Entry contents:
1 distinct polypeptide molecule
Macromolecule:
Haloalkane dehalogenase Chains: A, B, C, D
Molecule details ›
Chains: A, B, C, D
Length: 293 amino acids
Theoretical weight: 33.32 KDa
Source organism: Rhodococcus sp.
Expression system: Escherichia coli
UniProt:
  • Canonical: P0A3G3 (Residues: 4-293; Coverage: 99%)
Gene name: dhaA
Sequence domains: alpha/beta hydrolase fold

Ligands and Environments

4 bound ligands:
Ligand OEH 4 x OEH
Ligand CL 4 x CL
Ligand GOL 2 x GOL
Ligand CA 1 x CA
No modified residues

Experiments and Validation Details

Entry percentile scores
X-ray source: SLS BEAMLINE X10SA
Spacegroup: P21
Unit cell:
a: 70.26Å b: 53.03Å c: 163.21Å
α: 90° β: 93.746° γ: 90°
R-values:
R R work R free
0.201 0.199 0.225
Expression system: Escherichia coli

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