Ensemble refinement model

PDB 4QG7|dpdb_bmkrfz2j

Ensemble refinement model

S.aureus TMK in complex with a potent inhibitor compound 18, 2-(3-CHLOROPHENOXY)-3-METHOXY-4-{[(3S)-3-(5-METHYL-2,4-DIOXO-3,4-DIHYDROPYRIMIDIN-1(2H)-YL)PIPERIDIN-1-YL]METHYL}BENZOIC ACID

Program
PHENIX 2.0_5824
Model type
Ensemble
Purpose
Refinement
Atoms
225,375
Residues
395
Protein chains
2
Alternate-location fraction
0%
Ligand
32K

Evaluations

R-work
0.165
R-free
0.205
Clashscore
—

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
Thymidylate kinase205
  • Staphylococcus aureus subsp. aureus MRSA252282458
—

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations