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Ligand · 2SM

2SM · methyl 2-{[(4-methylpyrimidin-2-yl)carbamoyl]sulfamoyl}benzoate

2SM, methyl 2-{[(4-methylpyrimidin-2-yl)carbamoyl]sulfamoyl}benzoate (C14 H14 N4 O5 S, 350.4 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 residues…

Component
2SM
Formula
C14 H14 N4 O5 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

2SM in 2 structures; the first of them:

  • 3EA4 · Arabidopsis thaliana acetohydroxyacid synthase in complex with monosulfuron-ester · 2SM A695 · binds ASP376, ARG377, MET570, VAL571, TRP574, SER653
  • 3EA4 · Arabidopsis thaliana acetohydroxyacid synthase in complex with monosulfuron-ester · 2SM A695 · binds ASP376, ARG377, MET570, VAL571, TRP574, SER653

Residues it binds most

ARG 2, ASP 2, MET 2, SER 2, TRP 2, VAL 2 (residue and the binding sites it lines).

Found with

  • FAB · Flavin-adenine dinucleotide-N5-isobutyl ketone
  • TDM · 2-[(2E)-3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-2-(1-hydroxyethylidene)-4-methyl-2,3-dihydro-1,3-thiazol-5-yl]ethyl trihydrogen diphosphate
  • MG · Magnesium ion
  • NHE · 2-[N-cyclohexylamino]ethane sulfonic acid

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