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Ligand · 46W

46W · 4-methylpiperidine-1-carboximidamide

46W, 4-methylpiperidine-1-carboximidamide (C7 H15 N3, 141.2 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 most and the ligands…

Component
46W
Formula
C7 H15 N3
Class
ligand
Structures
2
PDB entries
1

Binding sites

46W in 2 structures; the first of them:

  • 4Y4W · Endothiapepsin in complex with fragment 125 · 46W A412 · binds ASP35, GLY37, SER38, TYR79, GLY80, PHE194, ILE217, ASP219 and 3 more
  • 4Y4W · Endothiapepsin in complex with fragment 125 · 46W A412 · binds ASP35, GLY37, SER38, TYR79, GLY80, PHE194, ILE217, ASP219 and 3 more

Residues it binds most

ASP 4, GLY 4, ILE 4, PHE 4, SER 4, THR 4, TYR 4, LEU 2 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion
  • ACT · Acetate ion
  • DMS · Dimethyl sulfoxide
  • EDO · 1,2-ethanediol
  • GOL · Glycerol
  • PEG · Di(hydroxyethyl)ether

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