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Ensemble refinement model

PDB 3MJ2|dpdb_l30p9jh5

Ensemble refinement model

X-ray crystal structure of ITK complexed with inhibitor BMS-509744

Program
PHENIX phenix.ensemble_refinement
Model type
Ensemble
Purpose
Refinement
Atoms
111,330
Residues
259
Protein chains
1
Alternate-location fraction
0%
Ligand
MJG

Evaluations

R-work
0.164
R-free
0.220
Clashscore
—

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
Tyrosine-protein kinase ITK/TSK266
  • ConstructUNP residues 357-620
  • MutationsC477S E614A E617A

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations