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Ligand · J3L

J3L · (2S)-3-methyl-2-[[(2S,4R)-1-methyl-4-[(2E,4E)-octa-2,4-dienoyl]-3,5-bis(oxidanylidene)pyrrolidin-2-yl]methyl]-2-oxidanyl-butanoic acid

J3L, (2S)-3-methyl-2-[[(2S,4R)-1-methyl-4-[(2E,4E)-octa-2,4-dienoyl]-3,5-bis(oxidanylidene)pyrrolidin-2-yl]methyl]-2-oxidanyl-butanoic acid (C19 H27 N O6, 365.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB…

Component
J3L
Formula
C19 H27 N O6
Class
ligand
Structures
2
PDB entries
1

Binding sites

J3L in 2 structures; the first of them:

  • 7EGV · Acetolactate Synthase from Trichoderma harzianum with inhibitor harzianic acid · J3L B701 · binds ARG378, TRP587, PHE591, TYR592, ALA658, GLY112, ALA113, PHE197 and 2 more
  • 7EGV · Acetolactate synthase from trichoderma harzianum with inhibitor harzianic acid · J3L B701 · binds ARG378, TRP587, PHE591, TYR592, ALA658, GLY112, ALA113, PHE197 and 2 more

Residues it binds most

ALA 2, PHE 2, ARG 2, GLY 2, LYS 2, TRP 2, TYR 2 (residue and the binding sites it lines).

Found with

  • FAD · Flavin-adenine dinucleotide
  • TZD · 2-{3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-2-oxo-2,3-dihydro-1,3-thiazol-5-yl}ethyl trihydrogen diphosphate
  • MG · Magnesium ion
  • PO4 · Phosphate ion
  • SO4 · Sulfate ion
  • EDO · 1,2-ethanediol
  • PEG · Di(hydroxyethyl)ether

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