Ensemble refinement model

PDB 5KU3|dpdb_65fkh4mm

Ensemble refinement model

BRD4 bromodomain in complex with Cpd59 ((S)-1-(3-((2-fluoro-4-(1-methyl-1H-pyrazol-4-yl)phenyl)amino)-1-(tetrahydrofuran-3-yl)-6,7-dihydro-1H-pyrazolo[4,3-c]pyridin-5(4H)-yl)ethanone)

Program
PHENIX phenix.ensemble_refinement
Model type
Ensemble
Purpose
Refinement
Atoms
121,922
Residues
126
Protein chains
1
Alternate-location fraction
0%
Ligands
6XH, DMS, EDO, GOL, PEG

Evaluations

R-work
0.170
R-free
0.192
Clashscore
—

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
Bromodomain-containing protein 4126
  • Constructbromodomain (UNP residues 42-167)

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations