Ensemble refinement model

PDB 7U8H|dpdb_z9sy3rxw

Ensemble refinement model

Discovery of a KRAS G12V Inhibitor in vivo Tool Compound starting from an HSQC-NMR based Fragment Hit

Program
PHENIX 1.21.2_5419
Model type
Ensemble
Purpose
Refinement
Atoms
389,440
Residues
665
Protein chains
4
Alternate-location fraction
0%
Ligands
2XO, GDP, LX6, MG

Evaluations

R-work
0.175
R-free
0.218
Clashscore
—

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
GTPase KRas170
  • MutationG12V

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations