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Ligand · IJ5

IJ5 · (2~{R})-2-(2-chlorophenyl)-2-oxidanyl-ethanenitrile

IJ5, (2~{R})-2-(2-chlorophenyl)-2-oxidanyl-ethanenitrile (C8 H6 Cl N O, 167.6 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it binds most and…

Component
IJ5
Formula
C8 H6 Cl N O
Class
ligand
Structures
1
PDB entries
1

Binding sites

IJ5 in 1 structure; the first of them:

  • 7YCT · HYDROXYNITRILE LYASE FROM THE MILLIPEDE, Oxidus gracilis complexed with… · IJ5 A201 · binds PRO26, LEU27, GLN28, THR41, ASN124, ASN125, ASN127, PHE163 and 4 more

Residues it binds most

ALA 6, ASN 4, LEU 6, PHE 6, ARG 6, TYR 2, GLN 4, PRO 4, THR 4, LYS 2 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion
  • GOL · Glycerol

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