› 2g9x

X-ray diffraction
2.5Å resolution

Structure of Thr 160 phosphorylated CDK2/cyclin A in complex with the inhibitor NU6271

Released:
DOI: 10.2210/pdb2g9x/pdb
PDB entry 2g9x coloured by chain, front view.
PDB entry 2g9x coloured by chain, side view.
PDB entry 2g9x coloured by chain, top view.
Source organisms:
Primary publication:
Searching for cyclin-dependent kinase inhibitors using a new variant of the cope elimination.
Griffin RJ, Henderson A, Curtin NJ, Echalier A, Endicott JA, Hardcastle IR, Newell DR, Noble ME, Wang LZ, Golding BT
J Am Chem Soc 128 6012-3 (2006)
PMID: 16669651

Function and Biology Details

Reaction catalysed: 
ATP + a protein = ADP + a phosphoprotein
Biochemical function:
Biological process:
Cellular component:
Sequence domains:
Structure domains:

Structure analysis Details

Assembly composition:
hetero dimer (preferred)
Assembly name:
PDBe Complex ID:
PDB-CPX-150314 (preferred)
Entry contents:
2 distinct polypeptide molecules
Macromolecules (2 distinct):
Cyclin-dependent kinase 2 Chains: A, C
Molecule details ›
Chains: A, C
Length: 299 amino acids
Theoretical weight: 34.14 KDa
Source organism: Homo sapiens
Expression system: Escherichia coli
UniProt:
  • Canonical: P24941 (Residues: 1-298; Coverage: 100%)
Gene names: CDK2, CDKN2
Sequence domains: Protein kinase domain
Structure domains:
Cyclin-A2 Chains: B, D
Molecule details ›
Chains: B, D
Length: 262 amino acids
Theoretical weight: 30 KDa
Source organism: Bos taurus
Expression system: Escherichia coli
UniProt:
  • Canonical: P30274 (Residues: 170-430; Coverage: 61%)
Gene name: CCNA2
Sequence domains:
Structure domains: Cyclin-like

Ligands and Environments

1 bound ligand:
Ligand NU5 2 x NU5
1 modified residue:
Ligand TPO 2 x TPO

Experiments and Validation Details

Entry percentile scores
X-ray source: ESRF BEAMLINE ID14-3
Spacegroup: P212121
Unit cell:
a: 74.58Å b: 134.986Å c: 148.513Å
α: 90° β: 90° γ: 90°
R-values:
R R work R free
0.219 0.217 0.265
Expression system: Escherichia coli

Quick links

Citations

1 review citation

Schiff base complex conjugates of bovine serum albumin as artificial metalloenzymes for eco-friendly enantioselective sulfoxidation.
Tang et al. (2018)
15 other articles

6 mentions without citation

The unfolded protein response signals through high-order assembly of Ire1.
Korennykh et al. (2009)
5 more