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Ligand · F1J

F1J · (2S)-4-(4-fluorobenzyl)-N-(2-sulfanylethyl)piperazine-2-carboxamide

F1J, (2S)-4-(4-fluorobenzyl)-N-(2-sulfanylethyl)piperazine-2-carboxamide (C14 H20 F N3 O S, 297.4 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…

Component
F1J
Formula
C14 H20 F N3 O S
Class
ligand
Structures
2
PDB entries
1

Binding sites

F1J in 2 structures; the first of them:

  • 2ZJJ · Crystal structure of the human BACE1 catalytic domain in complex with… · F1J A449 · binds GLY11, GLN12, GLY13, LEU30, ASP32, TYR71, THR72, GLN73 and 10 more
  • 2ZJJ · Crystal structure of the human BACE1 catalytic domain in complex with… · F1J A449 · binds GLY11, GLN12, GLY13, LEU30, ASP32, TYR71, THR72, GLN73 and 10 more

Residues it binds most

GLY 2, ASP 2, GLN 2, ILE 2, THR 2, ARG 2, CYS 2, LEU 2, PHE 2, SER 2 (residue and the binding sites it lines).

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