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Ligand · 812

812 · N-benzyl-4-[(2R)-pyrrolidin-2-ylmethoxy]aniline

812, N-benzyl-4-[(2R)-pyrrolidin-2-ylmethoxy]aniline (C18 H22 N2 O, 282.4 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 most and…

Component
812
Formula
C18 H22 N2 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

812 in 2 structures; the first of them:

  • 3FUI · Leukotriene A4 hydrolase in complex with N-benzyl-4-[(2R)-pyrrolidin-2-ylmethoxy]aniline · 812 A710 · binds GLN134, GLN136, ALA137, TYR267, GLY269, MET270, TRP311, PHE314 and 9 more
  • 3FUI · Leukotriene A4 hydrolase in complex with N-benzyl-4-[(2R)-pyrrolidin- 2-YLMETHOXY]ANILINE · 812 A710 · binds GLN134, GLN136, ALA137, TYR267, GLY269, MET270, TRP311, PHE314 and 9 more

Residues it binds most

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

Found with

  • YB · Ytterbium (III) ion
  • ZN · Zinc ion
  • IMD · Imidazole

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