PDBe 5xzr

X-ray diffraction
2.8Å resolution

The atomic structure of SHP2 E76A mutant in complex with allosteric inhibitor 9b

Released:

Function and Biology Details

Structure analysis Details

Assembly composition:
monomeric (preferred)
Entry contents:
1 distinct polypeptide molecule
Macromolecule:
Tyrosine-protein phosphatase non-receptor type 11 Chain: A
Molecule details ›
Chain: A
Length: 557 amino acids
Theoretical weight: 63.85 KDa
Source organism: Homo sapiens
Expression system: Escherichia coli BL21(DE3)
UniProt:
  • Canonical: Q06124 (Residues: 1-538; Coverage: 89%)
  • Best match: Q06124-2 (Residues: 1-534)
Gene names: PTP2C, PTPN11, SHPTP2
Sequence domains:

Ligands and Environments

1 bound ligand:

No modified residues

Experiments and Validation Details

Entry percentile scores
X-ray source: SSRF BEAMLINE BL19U1
Unit cell:
a: 41.28Å b: 55.75Å c: 219.19Å
α: 90° β: 90° γ: 90°
R-values:
R R work R free
0.242 0.24 0.281
Expression system: Escherichia coli BL21(DE3)