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Ligand · 4YF

4YF · (2R)-4-[2-(6-chloro-2,3-dihydro-1H-pyrrolo[3,2-c]pyridin-1-yl)-2-oxoethyl]-2-methylpiperazin-1-ium

4YF, (2R)-4-[2-(6-chloro-2,3-dihydro-1H-pyrrolo[3,2-c]pyridin-1-yl)-2-oxoethyl]-2-methylpiperazin-1-ium (C14 H20 Cl N4 O +1, 295.8 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its…

Component
4YF
Formula
C14 H20 Cl N4 O +1
Class
ligand
Structures
2
PDB entries
1

Binding sites

4YF in 2 structures; the first of them:

  • 5C7D · Fragment-Based Drug Discovery Targeting Inhibitor of Apoptosis Proteins: Compound 17 · 4YF A402 · binds LYS297, GLY306, LEU307, THR308, ASP309, TRP310, LYS311, GLU314 and 3 more
  • 5C7D · Fragment-based drug discovery targeting inhibitor of apoptosis proteins: compound 17 · 4YF A402 · binds LYS297, GLY306, LEU307, THR308, ASP309, TRP310, LYS311, GLU314 and 3 more

Residues it binds most

LYS 2, TRP 2, ASP 2, GLN 2, GLU 2, GLY 2, LEU 2, THR 2, TYR 2 (residue and the binding sites it lines).

Found with

  • ZN · Zinc ion

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