› 2b1p

X-ray diffraction
1.9Å resolution

inhibitor complex of JNK3

Released:
DOI: 10.2210/pdb2b1p/pdb
PDB entry 2b1p coloured by chain, front view.
PDB entry 2b1p coloured by chain, side view.
PDB entry 2b1p coloured by chain, top view.
Source organism: Homo sapiens
Primary publication:
Design and synthesis of 6-anilinoindazoles as selective inhibitors of c-Jun N-terminal kinase-3.
Swahn BM, Huerta F, Kallin E, Malmström J, Weigelt T, Viklund J, Womack P, Xue Y, Ohberg L
Bioorg Med Chem Lett 15 5095-9 (2005)
PMID: 16140012

Function and Biology Details

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

Structure analysis Details

Assembly composition:
monomeric (preferred)
Assembly name:
PDBe Complex ID:
PDB-CPX-156874 (preferred)
Entry contents:
1 distinct polypeptide molecule
Macromolecule:
Mitogen-activated protein kinase 10 Chain: A
Molecule details ›
Chain: A
Length: 355 amino acids
Theoretical weight: 41.07 KDa
Source organism: Homo sapiens
Expression system: Escherichia coli
UniProt:
  • Canonical: P53779 (Residues: 46-400; Coverage: 77%)
Gene names: JNK3, JNK3A, MAPK10, PRKM10, SAPK1B
Sequence domains: Protein kinase domain
Structure domains:

Ligands and Environments

3 bound ligands:
Ligand SO4 1 x SO4
Ligand AIZ 1 x AIZ
Ligand BME 1 x BME
No modified residues

Experiments and Validation Details

Entry percentile scores
X-ray source: ESRF BEAMLINE ID14-4
Spacegroup: P212121
Unit cell:
a: 50.336Å b: 71.935Å c: 107.306Å
α: 90° β: 90° γ: 90°
R-values:
R R work R free
0.222 0.22 0.267
Expression system: Escherichia coli

Quick links

Citations

4 review citations

The isoform-specific functions of the c-Jun N-terminal Kinases (JNKs): differences revealed by gene targeting.
Bogoyevitch MA. (2006)
3 more

8 mentions without citation

Inhibitors of c-Jun N-terminal kinases: JuNK no more?
Bogoyevitch et al. (2008)
7 more