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Ligand · IJ1

IJ1 · 2-[(3-methylbenzyl)amino]ethanesulfonic acid

IJ1, 2-[(3-methylbenzyl)amino]ethanesulfonic acid (C10 H15 N O3 S, 229.3 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 the…

Component
IJ1
Formula
C10 H15 N O3 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

IJ1 in 2 structures; the first of them:

  • 4FPK · Crystal structure of the NanB sialidase from streptococcus pneumoniae in complex with… · IJ1 A701 · binds ARG245, ASP270, SER271, ILE326, ASP327, ASP344, MET346, GLY351 and 10 more
  • 4FPK · Crystal structure of the nanb sialidase from streptococcus pneumoniae in complex with… · IJ1 A701 · binds ARG245, ASP270, SER271, ILE326, ASP327, ASP344, MET346, GLY351 and 10 more

Residues it binds most

ARG 2, ASP 2, TYR 2, SER 2, ASN 2, GLU 2, GLY 2, ILE 2, MET 2, THR 2 (residue and the binding sites it lines).

Found with

  • DMS · Dimethyl sulfoxide

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