Ensemble refinement model

PDB 4IVA|dpdb_zqc8ixjl

Ensemble refinement model

JAK2 kinase (JH1 domain) in complex with the inhibitor TRANS-4-[(8AS)-2-[(1R)-1-HYDROXYETHYL]IMIDAZO[4,5-D]PYRROLO[2,3-B]PYRIDIN-1(8AH)-YL]CYCLOHEXANECARBONITRILE

Program
PHENIX phenix.ensemble_refinement
Model type
Ensemble
Purpose
Refinement
Atoms
173,969
Residues
290
Protein chains
1
Alternate-location fraction
0%
Ligands
1J5, PTR

Evaluations

R-work
0.154
R-free
0.186
Clashscore
—

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
Tyrosine-protein kinase JAK2300
  • ConstructUNP residues 833-1132

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations