Ensemble refinement model

PDB 5KTX|dpdb_i7g3o2wd

Ensemble refinement model

CREBBP 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
74,219
Residues
114
Protein chains
1
Alternate-location fraction
0%
Ligands
6XH, DMS, EDO

Evaluations

R-work
0.151
R-free
0.168
Clashscore
—

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
CREB-binding protein114
  • Constructbromodomain (UNP residues 1085-1196)

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations