Ensemble refinement model

PDB 5H0B|dpdb_y38eqhtk

Ensemble refinement model

Crystal structure of HCK complexed with a pyrrolo-pyrimidine inhibitor (S)-2-(((1r,4S)-4-(4-amino-5-(4-phenoxyphenyl)-7H-pyrrolo[2,3-d]pyrimidin-7-yl)cyclohexyl)amino)-4-methylpentanoic acid

Program
PHENIX phenix.ensemble_refinement
Model type
Ensemble
Purpose
Refinement
Atoms
384,156
Residues
446
Protein chains
1
Alternate-location fraction
0%
Ligands
OOQ, PTR

Evaluations

R-work
0.179
R-free
0.211
Clashscore
—

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
Tyrosine-protein kinase HCK454
  • ConstructUNP RESIDUES 81-526
  • MutationsQ523E Q524E Q525I

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations