› 7rel

X-ray diffraction
1.55Å resolution

Crystal structure of the first bromodomain (BD1) of human BRD4 in complex with dual BRD4-JAK2 inhibitor MA9-060

Released:
DOI: 10.2210/pdb7rel/pdb
PDB entry 7rel coloured by chain, front view.
PDB entry 7rel coloured by chain, side view.
PDB entry 7rel coloured by chain, top view.
Source organism: Homo sapiens
Entry authors: Karim MR, Schonbrunn E

Function and Biology Details

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

Structure analysis Details

Assembly composition:
monomeric (preferred)
Assembly name:
PDBe Complex ID:
PDB-CPX-130112 (preferred)
Entry contents:
1 distinct polypeptide molecule
Macromolecule:
Bromodomain-containing protein 4 Chain: A
Molecule details ›
Chain: A
Length: 127 amino acids
Theoretical weight: 15.1 KDa
Source organism: Homo sapiens
Expression system: Escherichia coli
UniProt:
  • Canonical: O60885 (Residues: 44-168; Coverage: 9%)
Gene names: BRD4, HUNK1
Sequence domains: Bromodomain

Ligands and Environments

2 bound ligands:
Ligand EDO 1 x EDO
Ligand 4OW 1 x 4OW
No modified residues

Experiments and Validation Details

Entry percentile scores
X-ray source: APS BEAMLINE 22-ID
Spacegroup: P212121
Unit cell:
a: 38.1Å b: 44.159Å c: 78.888Å
α: 90° β: 90° γ: 90°
R-values:
R R work R free
0.164 0.163 0.191
Expression system: Escherichia coli

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