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Ligand · UN7

UN7 · 3-[3-(3(S)-methylcarbamoyl-7-sulfoamino-3,4,-dihydro-1H-isoquinolin-2-yl)-3-oxo-propyl]-benzoic acid

UN7, 3-[3-(3(S)-methylcarbamoyl-7-sulfoamino-3,4,-dihydro-1H-isoquinolin-2-yl)-3-oxo-propyl]-benzoic acid (C21 H23 N3 O7 S, 461.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its…

Component
UN7
Formula
C21 H23 N3 O7 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

UN7 in 2 structures; the first of them:

  • 2F71 · Protein tyrosine phosphatase 1B with sulfamic acid inhibitors · UN7 A608 · binds TYR20, ARG24, TYR46, ASP48, VAL49, LYS120, ASP181, PHE182 and 12 more
  • 2F71 · Protein tyrosine phosphatase 1B with sulfamic acid inhibitors · UN7 A608 · binds TYR20, ARG24, TYR46, ASP48, VAL49, LYS120, ASP181, PHE182 and 12 more

Residues it binds most

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

Found with

  • MG · Magnesium ion
  • CL · Chloride ion

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