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Ligand · JF4

JF4 · (3R,5S,6R,9aR)-6,9a-dimethyl-3-(prop-1-en-2-yl)octahydro-2H-quinolizinium

JF4, (3R,5S,6R,9aR)-6,9a-dimethyl-3-(prop-1-en-2-yl)octahydro-2H-quinolizinium (C14 H26 N +1, 208.4 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
JF4
Formula
C14 H26 N +1
Class
ligand
Structures
2
PDB entries
1

Binding sites

JF4 in 2 structures; the first of them:

  • 4KVW · Crystal structure of Aspergillus terreus aristolochene synthase complexed with… · JF4 A405 · binds TYR61, LEU77, LEU80, PHE81, ASP84, PHE147, VAL173, GLY174 and 4 more
  • 4KVW · Crystal structure of aspergillus terreus aristolochene synthase complexed with… · JF4 A405 · binds TYR61, LEU77, LEU80, PHE81, ASP84, PHE147, VAL173, GLY174 and 4 more

Residues it binds most

LEU 8, ASN 8, PHE 8, ASP 8, GLY 8, TYR 8, VAL 8 (residue and the binding sites it lines).

Found with

  • POP · Pyrophosphate 2-
  • MG · Magnesium ion
  • GOL · Glycerol

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