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Ligand · RE7

RE7 · (1R)-1-(4-fluorophenyl)-N-[2-(1H-pyrazol-1-yl) ethyl]ethan-1-amine

RE7, (1R)-1-(4-fluorophenyl)-N-[2-(1H-pyrazol-1-yl) ethyl]ethan-1-amine (C13 H16 F N3, 233.3 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it…

Component
RE7
Formula
C13 H16 F N3
Class
ligand
Structures
1
PDB entries
1

Binding sites

RE7 in 1 structure; the first of them:

  • 5RCF · Pandda analysis group deposition -- endothiapepsin changed state model for fragment… · RE7 A401 · binds ASP15, PHE280, PRO282, ILE283, PHE291

Residues it binds most

ASP 2, PHE 2, ILE 2, SER 1, ALA 1, GLY 1, LEU 1, PRO 1, THR 1, TYR 1 (residue and the binding sites it lines).

Found with

  • ACT · Acetate ion
  • DMS · Dimethyl sulfoxide
  • GOL · Glycerol
  • PG4 · Tetraethylene glycol

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