› 4q7f

X-ray diffraction
1.98Å resolution

1.98 Angstrom Crystal Structure of Putative 5'-Nucleotidase from Staphylococcus aureus in complex with Adenosine.

Released:
DOI: 10.2210/pdb4q7f/pdb
PDB entry 4q7f coloured by chain, front view.
PDB entry 4q7f coloured by chain, side view.
PDB entry 4q7f coloured by chain, top view.
Source organism: Staphylococcus aureus subsp. aureus COL
Entry authors: Minasov G, Nocadello S, Shuvalova L, Dubrovska I, Winsor J, Bagnoli F, Falugi F, Bottomley M, Grandi G, Anderson WF, Center for Structural Genomics of Infectious Diseases (CSGID)

Function and Biology Details

Biochemical function:
Biological process:
Cellular component:
Sequence domains:

Structure analysis Details

Assembly composition:
monomeric (preferred)
Assembly name:
PDBe Complex ID:
PDB-CPX-173527 (preferred)
Entry contents:
1 distinct polypeptide molecule
Macromolecule:
Bifunctional metallophosphatase/5'-nucleotidase Chain: A
Molecule details ›
Chain: A
Length: 527 amino acids
Theoretical weight: 60.64 KDa
Source organism: Staphylococcus aureus subsp. aureus COL
Expression system: Escherichia coli BL21
UniProt:
  • Canonical: Q2G1L5 (Residues: 2-511; Coverage: 100%)
Gene name: SAOUHSC_00107
Sequence domains:
Structure domains:

Ligands and Environments

3 bound ligands:
Ligand MG 1 x MG
Ligand MN 1 x MN
Ligand 3D1 1 x 3D1
1 modified residue:
Ligand MSE 12 x MSE

Experiments and Validation Details

Entry percentile scores
X-ray source: APS BEAMLINE 21-ID-F
Spacegroup: C2
Unit cell:
a: 89.584Å b: 86.452Å c: 95.647Å
α: 90° β: 116.86° γ: 90°
R-values:
R R work R free
0.188 0.187 0.218
Expression system: Escherichia coli BL21

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