Ensemble refinement model

PDB 3MJ1|dpdb_31rswfcg

Ensemble refinement model

X-ray crystal structure of ITK complexed with inhibitor RO5191614

Program
PHENIX phenix.ensemble_refinement
Model type
Ensemble
Purpose
Refinement
Atoms
77,645
Residues
228
Protein chains
1
Alternate-location fraction
0%
Ligand
614

Evaluations

R-work
0.180
R-free
0.233
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