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Structure-based Optimization of Pyrazolo -Pyrimidine and -Pyridine Inhibitors of PI3-Kinase

X-ray diffraction
2.6Å resolution
PDB entry 3nzu coloured by chain, front view.
PDB entry 3nzu coloured by chain, side view.
PDB entry 3nzu coloured by chain, top view.
Source organism: Homo sapiens
Assembly composition:
monomeric (preferred)
Entry contents: 1 distinct polypeptide molecule

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Assemblies

Assembly 1 (preferred)
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Assembly Name: Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
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Multimeric state: monomeric
Accessible surface area: 35593.17 Å2
Buried surface area: 0.0 Å2
Dissociation area: 0 Å2
Dissociation energy (ΔGdiss): 0 kcal/mol
Dissociation entropy (TΔSdiss): 0 kcal/mol
Symmetry number: 1
PDBe Complex ID: PDB-CPX-155801

Macromolecules

Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
Chain: A
Length: 954 amino acids
Theoretical weight: 109.38 KDa
Source organism: Homo sapiens
Expression system: Spodoptera frugiperda
UniProt:
  • Canonical: P48736 (Residues: 147-1094; Coverage: 86%)
Gene name: PIK3CG
Pfam:
InterPro:
CATH:
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform in PDB entry 3nzu, assembly 1, front view.
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform in PDB entry 3nzu, assembly 1, side view.
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform in PDB entry 3nzu, assembly 1, top view.
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