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Ligand · 505

505 · (2R)-1-(2,6-dimethylphenoxy)propan-2-amine

505, (2R)-1-(2,6-dimethylphenoxy)propan-2-amine (C11 H17 N O, 179.3 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
505
Formula
C11 H17 N O
Class
ligand
Structures
2
PDB entries
1

Binding sites

505 in 2 structures; the first of them:

  • 2VIN · Fragment-Based Discovery of Mexiletine Derivatives as Orally Bioavailable Inhibitors of… · 505 A1247 · binds ASP189, SER190, CYS191, GLN192, SER195, VAL213, SER214, TRP215 and 5 more
  • 2VIN · Fragment-based discovery of mexiletine derivatives as orally bioavailable inhibitors of… · 505 A1247 · binds ASP189, SER190, CYS191, GLN192, SER195, VAL213, SER214, TRP215 and 5 more

Residues it binds most

GLY 2, SER 2, CYS 2, VAL 2, ASP 2, GLN 2, TRP 2 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion
  • ACT · Acetate ion

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