Ensemble refinement model

PDB 6TPD|dpdb_1tagfxcg

Ensemble refinement model

Fragment-based discovery of pyrazolopyridones as JAK1 inhibitors with excellent subtype selectivity

Program
PHENIX phenix.ensemble_refinement
Model type
Ensemble
Purpose
Refinement
Atoms
101,688
Residues
289
Protein chains
1
Alternate-location fraction
0%
Ligand
QZ8

Evaluations

R-work
0.206
R-free
0.260
Clashscore
—

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
Tyrosine-protein kinase JAK2289
  • MutationsY1007F/Y1008F

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations