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Ligand · X0P

X0P · 2-methoxy-6-[[[3-[(4-methoxyphenyl)methylcarbamoyl]naphthalen-2-yl]methyl-methyl-amino]methyl]benzoic acid

X0P, 2-methoxy-6-[[[3-[(4-methoxyphenyl)methylcarbamoyl]naphthalen-2-yl]methyl-methyl-amino]methyl]benzoic acid (C30 H30 N2 O5, 498.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with…

Component
X0P
Formula
C30 H30 N2 O5
Class
ligand
Structures
2
PDB entries
1

Binding sites

X0P in 2 structures; the first of them:

  • 4CIG · Interrogating HIV integrase for compounds that bind- a SAMPL challenge · X0P A1217 · binds ASP167, GLN168, ALA169, GLU170, HIS171, LYS173, THR174, MET178 and 7 more
  • 4CIG · Interrogating HIV integrase for compounds that bind- a sampl challenge · X0P A1217 · binds ASP167, GLN168, ALA169, GLU170, HIS171, LYS173, THR174, MET178 and 7 more

Residues it binds most

ALA 4, GLN 4, THR 4, ASP 4, GLU 4, HIS 4, LEU 4, LYS 4, MET 4, TYR 4 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion
  • ACT · Acetate ion

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