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Ligand · 3RU

3RU · 3-(2-aminoquinolin-3-yl)-N-(cyclohexylmethyl)propanamide

3RU, 3-(2-aminoquinolin-3-yl)-N-(cyclohexylmethyl)propanamide (C19 H25 N3 O, 311.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it binds…

Component
3RU
Formula
C19 H25 N3 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

3RU in 2 structures; the first of them:

  • 3RU1 · Structure of Bace-1 (Beta-Secretase) in Complex with… · 3RU A398 · binds ASP32, GLY34, SER35, VAL69, TYR71, PHE108, ILE118, ILE126 and 5 more
  • 3RU1 · Structure of bace-1 (beta-secretase) in complex with 3-(2… · 3RU A398 · binds ASP32, GLY34, SER35, VAL69, TYR71, PHE108, ILE118, ILE126 and 5 more

Residues it binds most

ASP 2, GLY 2, ILE 2, TYR 2, ARG 2, PHE 2, SER 2, THR 2, VAL 2 (residue and the binding sites it lines).

Found with

  • IOD · Iodide ion
  • GOL · Glycerol

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