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Ligand · F1K

F1K · (2S)-4-(4-fluorobenzyl)-N-(3-sulfanylpropyl)piperazine-2-carboxamide

F1K, (2S)-4-(4-fluorobenzyl)-N-(3-sulfanylpropyl)piperazine-2-carboxamide (C15 H22 F N3 O S, 311.4 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
F1K
Formula
C15 H22 F N3 O S
Class
ligand
Structures
2
PDB entries
1

Binding sites

F1K in 2 structures; the first of them:

  • 2ZJK · Crystal structure of the human BACE1 catalytic domain in complex with… · F1K A449 · binds GLY11, GLN12, GLY13, LEU30, ASP32, TYR71, CYS72, PHE108 and 7 more
  • 2ZJK · Crystal structure of the human BACE1 catalytic domain in complex with… · F1K A449 · binds GLY11, GLN12, GLY13, LEU30, ASP32, TYR71, CYS72, PHE108 and 7 more

Residues it binds most

GLY 6, ILE 6, THR 6, ARG 6, CYS 6, LEU 6, PHE 6, TRP 6, TYR 6, GLN 4 (residue and the binding sites it lines).

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