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Ligand · IEJ

IEJ · O-toluenesulfonamide

IEJ, O-toluenesulfonamide (C7 H9 N O2 S, 171.2 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found with it.

Component
IEJ
Formula
C7 H9 N O2 S
Class
ligand
Structures
2
PDB entries
2

Binding sites

IEJ in 2 structures; the first of them:

  • 5PHM · Pandda analysis group deposition -- crystal structure of JMJD2D in complex with N09455A · IEJ A417 · binds SER80, GLY81, THR87, LEU230, PHE231, GLY233, SER234
  • 7Q2H · Mycolic acid methyltransferase hma (MMAA4) from mycobac-terium tuberculosis in complex… · IEJ A401 · binds GLU146, ALA147, PHE148, PHE151, GLY152, SER177, SER178, PHE209 and 2 more

Residues it binds most

PHE 4, SER 2, GLU 3, GLY 2, LYS 3, LEU 2, PRO 2, ALA 1, ARG 1, ASN 1 (residue and the binding sites it lines).

Found with

  • EDO · 1,2-ethanediol
  • OGA · N-oxalylglycine
  • NI · Nickel (II) ion
  • ZN · Zinc ion
  • SO4 · Sulfate ion
  • DMS · Dimethyl sulfoxide

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