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Ligand · MS0

MS0 · (6-methoxy-1-benzofuran-3-yl)acetic acid

MS0, (6-methoxy-1-benzofuran-3-yl)acetic acid (C11 H10 O4, 206.2 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the…

Component
MS0
Formula
C11 H10 O4
Class
ligand
Structures
4
PDB entries
2

Binding sites

MS0 in 4 structures; the first of them:

  • 3N3L · Human FPPS complex with FBS_03 · MS0 F1 · binds TYR10, LYS57, ASN59, ARG60, THR63, SER205, PHE206, PHE239 and 3 more
  • 4DDH · Pantothenate synthetase in complex with 6-methoxy-1-benzofuran-3-yl acetic acid · MS0 A403 · binds HIS44, GLY46, HIS47, ALA49, LEU50, GLY158, LYS160, ASP161 and 8 more
  • 3N3L · Human fpps complex with FBS_03 · MS0 F1 · binds TYR10, LYS57, ASN59, ARG60, THR63, SER205, PHE206, PHE239 and 3 more
  • 4DDH · Pantothenate synthetase in complex with 6-methoxy-1-benzofuran-3-yl acetic acid · MS0 A403 · binds HIS44, GLY46, HIS47, ALA49, LEU50, GLY158, LYS160, ASP161 and 8 more

Residues it binds most

LYS 6, SER 6, GLY 4, HIS 4, LEU 8, VAL 4, THR 6, TYR 4, ARG 4, ASP 4 (residue and the binding sites it lines).

Found with

  • PO4 · Phosphate ion
  • EDO · 1,2-ethanediol
  • EOH · Ethanol
  • GOL · Glycerol

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