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Ligand · 214

214 · 6-[4-((2R)-2-(1H-1,2,3-benzotriazol-1-yl)-3-{4-[difluoro(phosphono)methyl]phenyl}-2-phenylpropyl)phenyl]-2-methylquinolin-8-ylphosphonic acid

214, 6-[4-((2R)-2-(1H-1,2,3-benzotriazol-1-yl)-3-{4-[difluoro(phosphono)methyl]phenyl}-2-phenylpropyl)phenyl]-2-methylquinolin-8-ylphosphonic acid (C38 H32 F2 N4 O6 P2, 740.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2…

Component
214
Formula
C38 H32 F2 N4 O6 P2
Class
ligand
Structures
2
PDB entries
1

Binding sites

214 in 2 structures; the first of them:

  • 1Q6S · The structure of phosphotyrosine phosphatase 1B in complex with compound 9 · 214 A801 · binds ARG524, ALA527, SER528, ASP529, TYR546, ARG547, ASP548, VAL549 and 18 more
  • 1Q6S · The structure of phosphotyrosine phosphatase 1B in complex with compound 9 · 214 A801 · binds ARG524, ALA527, SER528, ASP529, TYR546, ARG547, ASP548, VAL549 and 18 more

Residues it binds most

ARG 4, ASP 4, ALA 4, GLY 4, SER 4, GLN 4, TYR 4, CYS 4, ILE 4, MET 4 (residue and the binding sites it lines).

Found with

  • MG · Magnesium ion
  • CL · Chloride ion
  • MPD · (4S)-2-methyl-2,4-pentanediol

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