Ensemble refinement model

PDB 2VTI|dpdb_pwkl47sh

Ensemble refinement model

Identification of N-(4-piperidinyl)-4-(2,6-dichlorobenzoylamino)-1H- pyrazole-3-carboxamide (AT7519), a Novel Cyclin Dependent Kinase Inhibitor Using Fragment-Based X-Ray Crystallography and Structure Based Drug Design.

Program
PHENIX phenix.ensemble_refinement
Model type
Ensemble
Purpose
Refinement
Atoms
119,061
Residues
280
Protein chains
1
Alternate-location fraction
0%
Ligand
LZ3

Evaluations

R-work
0.148
R-free
0.183
Clashscore
—

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
CELL DIVISION PROTEIN KINASE 2298—

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations