Ensemble refinement model

PDB 4M13|dpdb_s08m1qcw

Ensemble refinement model

Crystal structure of ITK in complex with compound 8 [4-(carbamoylamino)-1-(7-propoxynaphthalen-1-yl)-1H-pyrazole-3-carboxamide]

Program
PHENIX phenix.ensemble_refinement
Model type
Ensemble
Purpose
Refinement
Atoms
90,678
Residues
264
Protein chains
1
Alternate-location fraction
0%
Ligand
1E0

Evaluations

R-work
0.168
R-free
0.213
Clashscore
—

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
Tyrosine-protein kinase ITK/TSK269
  • ConstructUNP residues 354-620

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations