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Ligand · LF9

LF9 · (2S)-tert-butoxy[6-(5-chloro-1H-benzimidazol-2-yl)-2,5-dimethyl-4-phenylpyridin-3-yl]ethanoic acid

LF9, (2S)-tert-butoxy[6-(5-chloro-1H-benzimidazol-2-yl)-2,5-dimethyl-4-phenylpyridin-3-yl]ethanoic acid (C26 H26 Cl N3 O3, 464.0 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its…

Component
LF9
Formula
C26 H26 Cl N3 O3
Class
ligand
Structures
4
PDB entries
2

Binding sites

LF9 in 4 structures; the first of them:

  • 4O55 · HIV-1 Integrase Catalytic Core Domain Complexed with Allosteric Inhibitor… · LF9 A301 · binds GLN95, ALA98, TYR99, LEU102, THR124, THR125, ALA128, ALA129 and 1 more
  • 4O5B · HIV-1 Integrase Catalytic Core Domain Complexed with Allosteric Inhibitor… · LF9 A301 · binds GLN95, ALA98, TYR99, LEU102, THR124, THR125, THR128, ALA129
  • 4O55 · HIV-1 integrase catalytic core domain complexed with allosteric inhibitor… · LF9 A301 · binds GLN95, ALA98, TYR99, LEU102, THR124, THR125, ALA128, ALA129 and 1 more
  • 4O5B · HIV-1 integrase catalytic core domain complexed with allosteric inhibitor… · LF9 A301 · binds GLN95, ALA98, TYR99, LEU102, THR124, THR125, THR128, ALA129

Residues it binds most

ALA 4, THR 4, GLN 4, LEU 4, TYR 4, TRP 2 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion

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