Ensemble refinement model

PDB 5S9R|dpdb_rkji75qi

Ensemble refinement model

CRYSTAL STRUCTURE OF THE FIRST BROMODOMAIN OF HUMAN BRD4 IN COMPLEX WITH BMS-986158, 2-{3-(1,4-dimethyl-1H-1,2,3-triazol-5-yl)-5-[(S)-(oxan-4-yl)(phenyl)methyl]-5H-pyrido[3,2-b]indol-7-yl}propan-2-ol

Program
PHENIX phenix.ensemble_refinement
Model type
Ensemble
Purpose
Refinement
Atoms
76,470
Residues
126
Protein chains
1
Alternate-location fraction
0%
Ligands
EDO, IOD, YWA

Evaluations

R-work
0.175
R-free
0.222
Clashscore
—

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
Bromodomain-containing protein 4128—

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations