› 2j2i

X-ray diffraction
1.9Å resolution

Crystal Structure of the humab PIM1 in complex with LY333531

Released:
DOI: 10.2210/pdb2j2i/pdb
PDB entry 2j2i coloured by chain, front view.
PDB entry 2j2i coloured by chain, side view.
PDB entry 2j2i coloured by chain, top view.
Source organism: Homo sapiens
Primary publication:
A systematic interaction map of validated kinase inhibitors with Ser/Thr kinases.
Fedorov O, Marsden B, Pogacic V, Rellos P, Müller S, Bullock AN, Schwaller J, Sundström M, Knapp S
Proc Natl Acad Sci U S A 104 20523-8 (2007)
PMID: 18077363

Function and Biology Details

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

Structure analysis Details

Assembly composition:
monomeric (preferred)
Assembly name:
PDBe Complex ID:
PDB-CPX-145753 (preferred)
Entry contents:
1 distinct polypeptide molecule
Macromolecule:
Serine/threonine-protein kinase pim-1 Chain: B
Molecule details ›
Chain: B
Length: 312 amino acids
Theoretical weight: 35.5 KDa
Source organism: Homo sapiens
Expression system: Escherichia coli BL21
UniProt:
  • Canonical: P11309 (Residues: 1-312; Coverage: 100%)
Gene name: PIM1
Sequence domains: Protein kinase domain
Structure domains:

Ligands and Environments

2 bound ligands:
Ligand SO4 1 x SO4
Ligand LY4 1 x LY4
No modified residues

Experiments and Validation Details

Entry percentile scores
X-ray source: RIGAKU FR-E
Spacegroup: P65
Unit cell:
a: 98.157Å b: 98.157Å c: 80.366Å
α: 90° β: 90° γ: 120°
R-values:
R R work R free
0.18 0.179 0.2
Expression system: Escherichia coli BL21

Quick links

Citations

51 review citations

Targeting cancer with small molecule kinase inhibitors.
Zhang et al. (2009)
50 more

14 mentions without citation

The scientific impact of the Structural Genomics Consortium: a protein family and ligand-centered approach to medically-relevant human proteins.
Gileadi et al. (2007)
13 more