X-ray diffraction
2.4Å resolution

Crystal Structure of 4-hydroxybutyrate coenzyme A transferase (AtoA) in complex with CoA from Shewanella oneidensis, Northeast Structural Genomics Target SoR119.

Source organism: Shewanella oneidensis MR-1
Entry authors: Forouhar F, Neely H, Hussain M, Benach J, Seetharaman J, Cunningham K, Ma LC, Owen L, Fang Y, Xiao R, Liu J, Baran MC, Acton TB, Montelione GT, Hunt JF, Tong L, Northeast Structural Genomics Consortium (NESG)

Function and Biology Details

Structure analysis Details

Assemblies composition:
homo dimer (preferred)
homo tetramer
Entry contents:
1 distinct polypeptide molecule
Acetyl-CoA hydrolase/transferase Chains: A, B
Molecule details ›
Chains: A, B
Length: 436 amino acids
Theoretical weight: 47.22 KDa
Source organism: Shewanella oneidensis MR-1
Expression system: Escherichia coli
  • Canonical: Q8EG98 (Residues: 1-428; Coverage: 100%)
Gene name: SO_1708
Sequence domains:
Structure domains:

Ligands and Environments

1 bound ligand:
1 modified residue:

Experiments and Validation Details

Entry percentile scores
X-ray source: APS BEAMLINE 24-ID-C
Spacegroup: C2221
Unit cell:
a: 80.157Å b: 111.337Å c: 179.43Å
α: 90° β: 90° γ: 90°
R R work R free
0.226 0.225 0.266
Expression system: Escherichia coli