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Ligand · 3ML

3ML · [(2S)-3-methyl-5-oxo-2,5-dihydrofuran-2-yl]acetic acid

3ML, [(2S)-3-methyl-5-oxo-2,5-dihydrofuran-2-yl]acetic acid (C7 H8 O4, 156.1 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 residues it binds most and…

Component
3ML
Formula
C7 H8 O4
Class
ligand
Structures
2
PDB entries
1

Binding sites

3ML in 2 structures; the first of them:

  • 3HF5 · Crystal structure of 4-methylmuconolactone methylisomerase in complex with… · 3ML A201 · binds TYR6, LEU8, HIS26, TYR39, GLY65, CYS67, TYR78, TRP87 and 5 more
  • 3HF5 · Crystal structure of 4-methylmuconolactone methylisomerase in complex with… · 3ML A201 · binds TYR6, LEU8, HIS26, TYR39, GLY65, CYS67, TYR78, TRP87 and 5 more

Residues it binds most

TYR 8, GLY 8, LEU 8, HIS 8, CYS 8, ILE 8, PHE 8, TRP 8, VAL 4 (residue and the binding sites it lines).

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