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Ligand · 11X

11X · N-(pyridin-3-ylmethyl)aniline

11X, N-(pyridin-3-ylmethyl)aniline (C12 H12 N2, 184.2 g/mol), in the MolNFT structures on GenesisL1: bound in 6 records (3 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found…

Component
11X
Formula
C12 H12 N2
Class
ligand
Structures
6
PDB entries
3

Binding sites

11X in 6 structures; the first of them:

  • 3EJ0 · Crystal structure of inorganic pyrophosphatase from burkholderia pseudomallei with bound… · 11X A176 · binds PRO53, VAL54, ILE75, THR76, PRO77, MET117, THR118, TYR130 and 1 more
  • 3FTV · Leukotriene A4 hydrolase in complex with fragment N-(pyridin-3-ylmethyl)aniline · 11X A710 · binds GLN136, ALA137, TYR267, TRP311, PHE314, VAL367, LEU369, PRO374 and 5 more
  • 3FTW · Leukotriene A4 hydrolase in complex with fragments N-(pyridin-3-ylmethyl)aniline and… · 11X A710 · binds GLN136, ALA137, TYR267, TRP311, PHE314, VAL367, LEU369, PRO374 and 5 more
  • 3EJ0 · Crystal structure of inorganic pyrophosphatase from burkholderia pseudomallei with bound… · 11X A176 · binds PRO53, VAL54, ILE75, THR76, PRO77, MET117, THR118, TYR130 and 1 more
  • 3FTV · Leukotriene A4 hydrolase in complex with fragment N- (pyridin-3-YLMETHYL)ANILINE · 11X A710 · binds GLN136, ALA137, TYR267, TRP311, PHE314, VAL367, LEU369, PRO374 and 5 more
  • 3FTW · Leukotriene A4 hydrolase in complex with fragments N- (pyridin-3-YLMETHYL)ANILINE and… · 11X A710 · binds GLN136, ALA137, TYR267, TRP311, PHE314, VAL367, LEU369, PRO374 and 5 more

Residues it binds most

PRO 8, TYR 8, LEU 8, ALA 4, VAL 6, ASP 4, GLN 4, ILE 4, PHE 4, SER 4 (residue and the binding sites it lines).

Found with

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

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