› 5g6v

X-ray diffraction
2.2Å resolution

Crystal structure of the PCTAIRE1 kinase in complex with inhibitor

Released:
DOI: 10.2210/pdb5g6v/pdb
PDB entry 5g6v coloured by chain, front view.
PDB entry 5g6v coloured by chain, side view.
PDB entry 5g6v coloured by chain, top view.
Source organism: Homo sapiens
Primary publication:
Structure and inhibitor specificity of the PCTAIRE-family kinase CDK16.
Dixon-Clarke SE, Shehata SN, Krojer T, Sharpe TD, von Delft F, Sakamoto K, Bullock AN
Biochem J 474 699-713 (2017)
PMID: 28057719

Function and Biology Details

Reaction catalysed: 
ATP + a protein = ADP + a phosphoprotein
Biochemical function:
Biological process:
Cellular component:
  • not assigned
Sequence domains:

Structure analysis Details

Assembly composition:
monomeric (preferred)
Assembly name:
PDBe Complex ID:
PDB-CPX-169445 (preferred)
Entry contents:
1 distinct polypeptide molecule
Macromolecule:
Cyclin-dependent kinase 16 Chains: A, B
Molecule details ›
Chains: A, B
Length: 324 amino acids
Theoretical weight: 37.31 KDa
Source organism: Homo sapiens
Expression system: Escherichia coli
UniProt:
  • Canonical: Q00536 (Residues: 163-478; Coverage: 64%)
Gene names: CDK16, PCTAIRE1, PCTK1
Sequence domains: Protein kinase domain
Structure domains:

Ligands and Environments

2 bound ligands:
Ligand 919 2 x 919
Ligand EDO 4 x EDO
No modified residues

Experiments and Validation Details

Entry percentile scores
X-ray source: DIAMOND BEAMLINE I02
Unit cell:
a: 57.19Å b: 86.94Å c: 146.25Å
α: 90° β: 90° γ: 90°
R-values:
R R work R free
0.211 0.208 0.271
Expression system: Escherichia coli

Quick links

Citations

4 review citations

Structural insights into the functional diversity of the CDK-cyclin family.
Wood et al. (2018)
3 more

2 mentions without citation

Structure and inhibitor specificity of the PCTAIRE-family kinase CDK16.
Dixon-Clarke et al. (2017)
1 more