› 1uv5

X-ray diffraction
2.8Å resolution

GLYCOGEN SYNTHASE KINASE 3 BETA COMPLEXED WITH 6-BROMOINDIRUBIN-3'-OXIME

Released:
DOI: 10.2210/pdb1uv5/pdb
PDB entry 1uv5 coloured by chain, front view.
PDB entry 1uv5 coloured by chain, side view.
PDB entry 1uv5 coloured by chain, top view.
Source organism: Homo sapiens
Primary publication:
GSK-3-selective inhibitors derived from Tyrian purple indirubins.
Meijer L, Skaltsounis AL, Magiatis P, Polychronopoulos P, Knockaert M, Leost M, Ryan XP, Vonica CA, Brivanlou A, Dajani R, Crovace C, Tarricone C, Musacchio A, Roe SM, Pearl L, Greengard P
Chem Biol 10 1255-66 (2003)
PMID: 14700633

Function and Biology Details

Reactions catalysed: 
ATP + a protein = ADP + a phosphoprotein
ATP + [tau protein] = ADP + [tau protein] phosphate
Biochemical function:
Biological process:
Cellular component:
  • not assigned
Sequence domains:
Structure domain:

Structure analysis Details

Assembly composition:
homo dimer (preferred)
Assembly name:
PDBe Complex ID:
PDB-CPX-156061 (preferred)
Entry contents:
1 distinct polypeptide molecule
Macromolecule:
Glycogen synthase kinase-3 beta Chain: A
Molecule details ›
Chain: A
Length: 350 amino acids
Theoretical weight: 39.66 KDa
Source organism: Homo sapiens
Expression system: Spodoptera frugiperda
UniProt:
  • Canonical: P49841 (Residues: 35-384; Coverage: 83%)
Gene name: GSK3B
Sequence domains: Protein kinase domain
Structure domains:

Ligands and Environments

4 bound ligands:
Ligand BRW 1 x BRW
Ligand PO4 2 x PO4
Ligand CL 1 x CL
Ligand CO 1 x CO
No modified residues

Experiments and Validation Details

Entry percentile scores
X-ray source: ESRF BEAMLINE ID29
Spacegroup: P43212
Unit cell:
a: 98.333Å b: 98.333Å c: 198.017Å
α: 90° β: 90° γ: 90°
R-values:
R R work R free
0.193 0.193 0.226
Expression system: Spodoptera frugiperda

Quick links

Citations

61 review citations

The Wnt signaling pathway in development and disease.
Logan et al. (2004)
60 more

30 mentions without citation

Computer Aided Drug Design Methodologies with Natural Products in the Drug Research Against Alzheimer's Disease.
de Sousa et al. (2022)
29 more