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Ligand · AUK

AUK · 1-hydroxy-2-methyl-3-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl]quinolin-4(1H)-one

AUK, 1-hydroxy-2-methyl-3-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trien-1-yl]quinolin-4(1H)-one (C25 H33 N O2, 379.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues…

Component
AUK
Formula
C25 H33 N O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

AUK in 2 structures; the first of them:

  • 3HYX · 3-D X-Ray structure of the sulfide:qui oxidoreductase from Aquifex aeolicus in complex… · AUK A501 · binds GLY314, MET315, GLU318, ILE346, ILE348, PHE357, LYS373, TRP377 and 7 more
  • 3HYX · 3-D X-ray structure of the SULFIDE:QUINONE oxidoreductase from aquifex aeolicus in… · AUK A501 · binds GLY314, MET315, GLU318, ILE346, ILE348, PHE357, LYS373, TRP377 and 7 more

Residues it binds most

PHE 12, GLU 12, ILE 12, LEU 12, VAL 12, GLY 12, MET 12, LYS 8, TRP 8, TYR 4 (residue and the binding sites it lines).

Found with

  • FAD · Flavin-adenine dinucleotide
  • PS9 · octathiocane
  • H2S · Hydrosulfuric acid
  • SO4 · Sulfate ion
  • LMT · Dodecyl-beta-D-maltoside

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