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Ligand · 3LG

3LG · (5-{[(2R)-1-(4-{3-[(2-methoxybenzyl)oxy]propoxy}phenyl)-6-oxopiperazin-2-yl]methoxy}-1H-indol-1-yl)acetic acid

3LG, (5-{[(2R)-1-(4-{3-[(2-methoxybenzyl)oxy]propoxy}phenyl)-6-oxopiperazin-2-yl]methoxy}-1H-indol-1-yl)acetic acid (C32 H35 N3 O7, 573.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site…

Component
3LG
Formula
C32 H35 N3 O7
Class
ligand
Structures
2
PDB entries
1

Binding sites

3LG in 2 structures; the first of them:

  • 2G26 · Ketopiperazine-Based Renin Inhibitors: Optimization of the "C" Ring · 3LG B805 · binds GLN14, ASP33, GLY35, SER36, TRP40, PRO42, ALA52, HIS56 and 15 more
  • 2G26 · Ketopiperazine-based renin inhibitors: optimization of the "C" ring · 3LG B805 · binds GLN14, ASP33, GLY35, SER36, TRP40, PRO42, ALA52, HIS56 and 15 more

Residues it binds most

ALA 2, ASP 2, GLY 2, VAL 2, PHE 2, PRO 2, GLN 2, HIS 2, LEU 2, MET 2 (residue and the binding sites it lines).

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