Ensemble refinement model

PDB 7WCE|dpdb_cvu72woq

Ensemble refinement model

Crystal structure of HIV-1 integrase catalytic core domain in complex with (2S)-2-(tert-Butoxy)-2-(10-fluoro-2-(2-hydroxy-4-methylphenyl)-1,4-dimethyl-5-(methylsulfonyl)-5,6-dihydrophenanthridin-3-yl)acetic acid

Program
PHENIX 1.21.2_5419
Model type
Ensemble
Purpose
Refinement
Atoms
47,289
Residues
136
Protein chains
1
Alternate-location fraction
0%
Ligands
8Z3, CAF, GOL, SO4

Evaluations

R-work
0.191
R-free
0.211
Clashscore
—

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
Integrase catalytic166
  • Human immunodeficiency virus type 1 (NEW YORK-5 ISOLATE)11698
  • MutationF1332K

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations