Ensemble refinement model

PDB 2YDJ|dpdb_zohkcyvs

Ensemble refinement model

Discovery of Checkpoint Kinase Inhibitor AZD7762 by Structure Based Design and Optimization of Thiophene Carboxamide Ureas

Program
PHENIX phenix.ensemble_refinement
Model type
Ensemble
Purpose
Refinement
Atoms
295,375
Residues
503
Protein chains
2
Alternate-location fraction
0%
Ligands
CSS, PO4, YDJ

Evaluations

R-work
0.206
R-free
0.250
Clashscore
—

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
SERINE/THREONINE-PROTEIN KINASE CHK1276
  • ConstructCHK1KD, RESIDUES 1-276

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations