Ensemble refinement model

PDB 4QGF|dpdb_26z30ei9

Ensemble refinement model

S.aureus TMK in complex with the potent inhibitor compound 38, 2-(3-CHLOROPHENOXY)-3-METHOXY-4-{(1R)-1-[(3S)-3-(5-METHYL-2,4-DIOXO-3,4-DIHYDROPYRIMIDIN-1(2H)-YL)PIPERIDIN-1-YL]PROPYL}BENZOIC ACID

Program
PHENIX 2.0_5824
Model type
Ensemble
Purpose
Refinement
Atoms
223,242
Residues
390
Protein chains
2
Alternate-location fraction
0%
Ligand
32B

Evaluations

R-work
0.157
R-free
0.195
Clashscore
—

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
Thymidylate kinase205
  • Staphylococcus aureus subsp. aureus MRSA252282458
  • ConstructTMK
  • Mutationsnone

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations