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Ensemble refinement model

PDB 3AMB|dpdb_nxklq48m

Ensemble refinement model

Protein kinase A sixfold mutant model of Aurora B with inhibitor VX-680

Program
PHENIX phenix.ensemble_refinement
Model type
Ensemble
Purpose
Refinement
Atoms
79,308
Residues
360
Protein chains
2
Alternate-location fraction
0%
Ligands
SEP, TPO, VX6

Evaluations

R-work
0.168
R-free
0.218
Clashscore
—

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
cAMP-dependent protein kinase catalytic subunit alpha351
  • MutationsK47R L95Q M120L V123A Q181K T183A
Entity 2
MoleculeChainsLengthOrganismUniProtDetails
cAMP-dependent protein kinase inhibitor alpha20
  • ConstructUNP residues 6-25

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations