Ensemble refinement model

PDB 4AGW|dpdb_pjlvivri

Ensemble refinement model

Discovery of a small molecule type II inhibitor of wild-type and gatekeeper mutants of BCR-ABL, PDGFRalpha, Kit, and Src kinases

Program
PHENIX phenix.ensemble_refinement
Model type
Ensemble
Purpose
Refinement
Atoms
109,074
Residues
515
Protein chains
2
Alternate-location fraction
0%
Ligands
GOL, MES, NG7

Evaluations

R-work
0.233
R-free
0.292
Clashscore
—

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
PROTO-ONCOGENE TYROSINE-PROTEIN KINASE SRC286
  • ConstructKINASE DOMAIN, RESIDUES 251-533

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations