› 2w3l

X-ray diffraction
2.1Å resolution

Crystal Structure of Chimaeric Bcl2-xL and Phenyl Tetrahydroisoquinoline Amide Complex

Released:
DOI: 10.2210/pdb2w3l/pdb
PDB entry 2w3l coloured by chain, front view.
PDB entry 2w3l coloured by chain, side view.
PDB entry 2w3l coloured by chain, top view.
Source organism: Homo sapiens
Primary publication:
Tetrahydroisoquinoline amide substituted phenyl pyrazoles as selective Bcl-2 inhibitors.
Porter J, Payne A, de Candole B, Ford D, Hutchinson B, Trevitt G, Turner J, Edwards C, Watkins C, Whitcombe I, Davis J, Stubberfield C
Bioorg Med Chem Lett 19 230-3 (2009)
PMID: 19027294

Function and Biology Details

Biochemical function:
  • not assigned
Biological process:
Cellular component:
  • not assigned
Sequence domains:

Structure analysis Details

Assembly composition:
monomeric (preferred)
Assembly name:
PDBe Complex ID:
PDB-CPX-145305 (preferred)
Entry contents:
1 distinct polypeptide molecule
Macromolecule:
Apoptosis regulator Bcl-2 Chains: A, B
Molecule details ›
Chains: A, B
Length: 144 amino acids
Theoretical weight: 16.87 KDa
Source organism: Homo sapiens
Expression system: Escherichia coli
UniProt:
  • Canonical: P10415 (Residues: 9-206; Coverage: 60%)
Gene name: BCL2
Sequence domains:
Structure domains: Blc2-like

Ligands and Environments

1 bound ligand:
Ligand DRO 2 x DRO
No modified residues

Experiments and Validation Details

Entry percentile scores
X-ray source: RIGAKU MICROMAX-007 HF
Spacegroup: P212121
Unit cell:
a: 68Å b: 68.32Å c: 70.67Å
α: 90° β: 90° γ: 90°
R-values:
R R work R free
0.218 0.218 0.258
Expression system: Escherichia coli

Quick links

Citations

5 review citations

From basic apoptosis discoveries to advanced selective BCL-2 family inhibitors.
Ashkenazi et al. (2017)
4 more

43 mentions without citation

Friedelin: Structure, Biosynthesis, Extraction, and Its Potential Health Impact.
Singh et al. (2023)
42 more