Ensemble refinement model
PDB 4MF1|dpdb_faar88hp
Ensemble refinement model
ITK kinase domain in complex with benzothiazole inhibitor 12b (1S,2S)-2-{4-[(DIMETHYLAMINO)METHYL]PHENYL}-N-[6-(1H-PYRAZOL-4-YL)-1,3-BENZOTHIAZOL-2-YL]CYCLOPROPANECARBOXAMIDE
- Program
- PHENIX phenix.ensemble_refinement
- Model type
- Ensemble
- Purpose
- Refinement
- Atoms
- 207,628
- Residues
- 489
- Protein chains
- 2
- Alternate-location fraction
- 0%
- Ligand
- 29Y
Evaluations
R-work
0.148
R-free
0.193
Clashscore
—
Macromolecules
The same in every model of this entry.
Data
L0 Raw
L1 Processed
L2 Models
L3 Evaluations