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Ligand · O2N

O2N · 5-{[(2-{[bis(4-methoxyphenyl)methyl]carbamoyl}benzyl)(prop-2-en-1-yl)amino]methyl}-1,3-benzodioxole-4-carboxylic acid

O2N, 5-{[(2-{[bis(4-methoxyphenyl)methyl]carbamoyl}benzyl)(prop-2-en-1-yl)amino]methyl}-1,3-benzodioxole-4-carboxylic acid (C35 H34 N2 O7, 594.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding…

Component
O2N
Formula
C35 H34 N2 O7
Class
ligand
Structures
2
PDB entries
1

Binding sites

O2N in 2 structures; the first of them:

  • 3ZSO · Small molecule inhibitors of the LEDGF site of HIV type 1 integrase identified by… · O2N A1219 · binds ASP167, GLN168, ALA169, GLU170, HIS171, LYS173, THR174, MET178 and 9 more
  • 3ZSO · Small molecule inhibitors of the ledgf site of HIV type 1 integrase identified by… · O2N A1219 · binds ASP167, GLN168, ALA169, GLU170, HIS171, LYS173, THR174, MET178 and 9 more

Residues it binds most

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

Found with

  • NA · Sodium ion
  • SO4 · Sulfate ion
  • ACY · Acetic acid

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