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Ligand · N1Y

N1Y · 2-chloro-5-{[(2E)-2-(nitromethylidene)imidazolidin-1-yl]methyl}pyridine

N1Y, 2-chloro-5-{[(2E)-2-(nitromethylidene)imidazolidin-1-yl]methyl}pyridine (C10 H11 Cl N4 O2, 254.7 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…

Component
N1Y
Formula
C10 H11 Cl N4 O2
Class
ligand
Structures
4
PDB entries
2

Binding sites

N1Y in 4 structures; the first of them:

  • 3WTL · Crystal Structure of Lymnaea stagnalis Acetylcholine Binding Protein Complexed with… · N1Y A301 · binds TYR89, TRP143, THR144, TYR185, SER186, CYS187, CYS188, TYR192 and 9 more
  • 3WTM · Crystal Structure of Lymnaea stagnalis Acetylcholine-Binding Protein Q55R Mutant… · N1Y A301 · binds TRP53, ARG55, LEU102, ALA103, ARG104, LEU112, TYR113, MET114 and 7 more
  • 3WTL · Crystal structure of lymnaea stagnalis acetylcholine binding protein complexed with… · N1Y A301 · binds TYR89, TRP143, THR144, TYR185, SER186, CYS187, CYS188, TYR192 and 9 more
  • 3WTM · Crystal structure of lymnaea stagnalis acetylcholine-binding protein Q55R mutant… · N1Y A301 · binds TRP53, ARG55, LEU102, ALA103, ARG104, LEU112, TYR113, MET114 and 7 more

Residues it binds most

TYR 20, LEU 20, TRP 20, CYS 20, ARG 20, ALA 20, MET 20, THR 20, SER 14, GLN 10 (residue and the binding sites it lines).

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