qFit model

PDB 3ZCM|dpdb_yllcl8gr

qFit model

Small molecule inhibitors of the LEDGF site of HIV integrase identified by fragment screening and structure based design.

Program
Phenix 2.0_5824
Model type
Multiconformer
Purpose
Model Building
Atoms
3,231
Residues
298
Protein chains
2
Alternate-location fraction
20.47%
Ligands
ACT, GOL, PX3, SO4

Evaluations

R-work
0.146
R-free
0.172
Clashscore
—

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
HIV INTEGRASE167
  • Human immunodeficiency virus12721
  • ConstructCORE CATALYTIC DOMAIN, RESIDUES 56-212
  • MutationsYES

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations