› 4rvx

X-ray diffraction
1.96Å resolution

Crystal structure of multidrug-resistant clinical isolate A02 HIV-1 protease in complex with non-peptidic inhibitor, GRL079

Released:
DOI: 10.2210/pdb4rvx/pdb
PDB 4rvx coloured by chain and viewed from the front.
PDB 4rvx coloured by chain and viewed from the side.
PDB 4rvx coloured by chain and viewed from the top.
Source organism: Human immunodeficiency virus 1
Entry authors: Yedidi RS, Garimella H, Kaufman JD, Das D, Wingfield PT, Ghosh AK, Mitsuya H

Function and Biology Details

Biochemical function:
Biological process:
Cellular component:
  • not assigned
Sequence domains:

Structure analysis Details

Assembly composition:
homo dimer (preferred)
Entry contents:
1 distinct polypeptide molecule
Macromolecule:
Peptidase A2 domain-containing protein Chains: A, B, C, D
Molecule details ›
Chains: A, B, C, D
Length: 99 amino acids
Theoretical weight: 10.86 KDa
Source organism: Human immunodeficiency virus 1
Expression system: Escherichia coli
UniProt:
  • Canonical: Q9J006 (Residues: 1-99; Coverage: 100%)
Gene name: pol
Sequence domains: Retroviral aspartyl protease
Structure domains: Acid Proteases

Ligands and Environments

1 bound ligand:
Ligand 79G 2 x 79G
No modified residues

Experiments and Validation Details

Entry percentile scores
X-ray source: APS BEAMLINE 22-ID
Spacegroup: P21
Unit cell:
a: 53.789Å b: 89.008Å c: 56.513Å
α: 90° β: 112.98° γ: 90°
R-values:
R R work R free
0.192 0.19 0.232
Expression system: Escherichia coli

Quick links