Ensemble refinement model

PDB 5EDR|dpdb_d00pndh2

Ensemble refinement model

EGFR kinase (T790M/L858R) with inhibitor compound 27: ~{N}-(1~{H}-indazol-3-yl)-7,7-dimethyl-2-(2-methylpyrazol-3-yl)-5~{H}-furo[3,4-d]pyrimidin-4-amine

Program
PHENIX phenix.ensemble_refinement
Model type
Ensemble
Purpose
Refinement
Atoms
98,650
Residues
299
Protein chains
1
Alternate-location fraction
0%
Ligand
5N4

Evaluations

R-work
0.185
R-free
0.240
Clashscore
—

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
Epidermal growth factor receptor331
  • MutationsT790M L858R E865A E866A K867A

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations