› 3dev

X-ray diffraction
3.1Å resolution

Crystal structure of SH1221 protein from Staphylococcus haemolyticus, Northeast Structural Genomics Consortium Target ShR87

Released:
DOI: 10.2210/pdb3dev/pdb
PDB entry 3dev coloured by chain, front view.
PDB entry 3dev coloured by chain, side view.
PDB entry 3dev coloured by chain, top view.
Source organism: Staphylococcus haemolyticus JCSC1435
Entry authors: Forouhar F, Neely H, Seetharaman J, Mao L, Xiao R, Ciccosanti C, Foote EL, Wang D, Everett JK, Acton TB, Montelione GT, Tong L, Hunt JF, Northeast Structural Genomics Consortium (NESG)

Function and Biology Details

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

Structure analysis Details

Assembly composition:
homo dimer (preferred)
Assembly name:
PDBe Complex ID:
PDB-CPX-175647 (preferred)
Entry contents:
1 distinct polypeptide molecule
Macromolecule:
DHH family phosphoesterase Chains: A, B
Molecule details ›
Chains: A, B
Length: 320 amino acids
Theoretical weight: 36.59 KDa
Source organism: Staphylococcus haemolyticus JCSC1435
Expression system: Escherichia coli
UniProt:
  • Canonical: Q4L745 (Residues: 1-312; Coverage: 100%)
Gene name: SH1221
Sequence domains:
Structure domains:

Ligands and Environments

2 bound ligands:
Ligand SO4 3 x SO4
Ligand MG 2 x MG
1 modified residue:
Ligand MSE 12 x MSE

Experiments and Validation Details

Entry percentile scores
X-ray source: SSRL BEAMLINE BL9-2
Spacegroup: P3
Unit cell:
a: 106.087Å b: 106.087Å c: 86.092Å
α: 90° β: 90° γ: 120°
R-values:
R R work R free
0.193 0.193 0.245
Expression system: Escherichia coli

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