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Ligand · 901

901 · 2-[(4-{2-acetylamino-2-[4-(1-carboxy-3-methylsulfanyl-propylcarbamoyl)-butylcarbamoyl]-ethyl}-2-ethyl-phenyl)-oxalyl-am ino]-benzoic acid

901, 2-[(4-{2-acetylamino-2-[4-(1-carboxy-3-methylsulfanyl-propylcarbamoyl)-butylcarbamoyl]-ethyl}-2-ethyl-phenyl)-oxalyl-am ino]-benzoic acid (C32 H40 N4 O10 S, 672.8 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1…

Component
901
Formula
C32 H40 N4 O10 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

901 in 2 structures; the first of them:

  • 1NZ7 · POTENT, SELECTIVE INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE 1B USING A SECOND… · 901 A322 · binds ARG24, SER28, ASP29, TYR46, ARG47, ASP48, VAL49, LYS120 and 13 more
  • 1NZ7 · Potent, selective inhibitors of protein tyrosine phosphatase 1B using a second… · 901 A322 · binds ARG24, SER28, ASP29, TYR46, ARG47, ASP48, VAL49, LYS120 and 13 more

Residues it binds most

ARG 2, GLY 2, ASP 2, GLN 2, SER 2, ALA 2, CYS 2, ILE 2, LYS 2, MET 2 (residue and the binding sites it lines).

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