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MolNFT v1 · #102373 · protein

Crystal structure of the HIV-1 integrase catalytic domain with GSK1264

4OJR: “Crystal structure of the HIV-1 integrase catalytic domain with GSK1264”. X-ray diffraction, 2 ligands (2SQ, SO4). MolNFT v1 #102373 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
4OJR
Type
protein
Length
131 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
HIV-1 integrase
UniProt
P03366
Ligands
2SQ, SO4

Structure

x-ray diffraction · 1 distinct chain · 55% helix, 21% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AHIV-1 integraseprotein13155% helix, 21% strandP03366

Ligands and binding sites

  • 2SQ · (2S)-tert-butoxy[4-(8-fluoro-5-methyl-3,4-dihydro-2H-chromen-6-yl)-2-methyl-1-oxo-1,2-dihydroisoquinolin-3-yl]ethanoic acid · ligand · chains A
  • SO4 · Sulfate ion · ion · chains A
  • CAC · Cacodylate ion · additive · 2 copies · chains A

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Compared structures

  • 4OJR · Crystal Structure of the HIV-1 Integrase catalytic domain with GSK1264 · the same entry in another collection · chain A against A, TM-score 1.00

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