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Ensemble refinement model

PDB 4L7S|dpdb_o94a2ti8

Ensemble refinement model

Kinase domain mutant of human Itk in complex with an aminobenzothiazole inhibitor

Program
PHENIX phenix.ensemble_refinement
Model type
Ensemble
Purpose
Refinement
Atoms
169,515
Residues
500
Protein chains
2
Alternate-location fraction
0%
Ligands
G7K, SO4

Evaluations

R-work
0.173
R-free
0.215
Clashscore
—

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
Tyrosine-protein kinase ITK/TSK266
  • ConstructCATALYTIC DOMAIN (UNP residues 357-620)
  • MutationY512E

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations