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Ligand · F41

F41 · N-(1,3-benzodioxol-5-yl)-2-(piperidin-1-yl)acetamide

F41, N-(1,3-benzodioxol-5-yl)-2-(piperidin-1-yl)acetamide (C14 H18 N2 O3, 262.3 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds…

Component
F41
Formula
C14 H18 N2 O3
Class
ligand
Structures
4
PDB entries
2

Binding sites

F41 in 4 structures; the first of them:

  • 3PGI · Endothiapepsin in complex with a fragment · F41 A2001 · binds ASP33, ASP35, GLY37, TYR79, GLY80, ASP81, SER83, PHE116 and 9 more
  • 4Y3Z · Endothiapepsin in complex with fragment 41 · F41 A406 · binds TYR79, GLY80, ASP81, SER83, PHE116, LEU125, ILE217, ASP219 and 5 more
  • 3PGI · Endothiapepsin in complex with a fragment · F41 A2001 · binds ASP33, ASP35, GLY37, TYR79, GLY80, ASP81, SER83, PHE116 and 9 more
  • 4Y3Z · Endothiapepsin in complex with fragment 41 · F41 A406 · binds TYR79, GLY80, ASP81, SER83, PHE116, LEU125, ILE217, ASP219 and 5 more

Residues it binds most

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

Found with

  • GOL · Glycerol
  • ACT · Acetate ion
  • EDO · 1,2-ethanediol

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