› 8wyp

X-ray diffraction
1.24Å resolution

High Resolution Crystal Structure of Brd4 BD-1 in Complex with a Novel Inhibitor Precursor

Released:
DOI: 10.2210/pdb8wyp/pdb
Model geometry
Fit model/data
PDB entry 8wyp coloured by chain, front view.
PDB entry 8wyp coloured by chain, side view.
PDB entry 8wyp coloured by chain, top view.
Source organism: Homo sapiens
Primary publication:
High resolution crystal structure of BRD4-BD1 in complex with a novel inhibitor precursor.
Ma X, Wang M, Wang F, Li J, Zhang Z, Zhu J, Liu B
Biochem Biophys Res Commun 690 149284 (2024)
PMID: 38006801

Function and Biology Details

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

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: 125 amino acids
Theoretical weight: 14.88 KDa
Source organism: Homo sapiens
Expression system: Escherichia coli BL21(DE3)
UniProt:
  • Canonical: O60885 (Residues: 44-167; Coverage: 9%)
Gene names: BRD4, HUNK1
Sequence domains: Bromodomain

Ligands and Environments

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

Experiments and Validation Details

wwPDB Validation report is not available for this entry.
X-ray source: SSRF BEAMLINE BL17U1
Spacegroup: P212121
Unit cell:
a: 32.32Å b: 47.32Å c: 78.76Å
α: 90° β: 90° γ: 90°
R-values:
R R work R free
0.197 0.196 0.214
Expression system: Escherichia coli BL21(DE3)

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