Ensemble refinement model

PDB 5KRS|dpdb_4k9cufkg

Ensemble refinement model

HIV-1 Integrase Catalytic Core Domain in Complex with an Allosteric Inhibitor, 3-(1H-pyrrol-1-yl)-2-thiophenecarboxylic acid

Program
PHENIX phenix.ensemble_refinement
Model type
Ensemble
Purpose
Refinement
Atoms
84,408
Residues
146
Protein chains
1
Alternate-location fraction
0%
Ligands
6XI, CAF, DMS

Evaluations

R-work
0.169
R-free
0.192
Clashscore
—

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
Integrase153
  • Human immunodeficiency virus 111676
  • MutationF185K

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations