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Ligand · 535

535 · ethyl 3-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxylate

535, ethyl 3-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazole-2-carboxylate (C9 H10 N2 O2 S, 210.2 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…

Component
535
Formula
C9 H10 N2 O2 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

535 in 2 structures; the first of them:

  • 3K14 · Co-crystal structure of 2C-methyl-D-erythritol 2,4-cyclodiphosphate synthase from… · 535 A164 · binds ASP10, VAL11, HIS12, HIS36, SER37, HIS44, ILE59, GLY60 and 7 more
  • 3K14 · Co-crystal structure of 2C-methyl-D-erythritol 2,4-cyclodiphosphate synthase from… · 535 A164 · binds ASP10, VAL11, HIS12, HIS36, SER37, HIS44, ILE59, GLY60 and 7 more

Residues it binds most

HIS 6, ASP 6, PHE 6, GLU 6, GLY 6, ILE 6, LEU 6, LYS 6, SER 4, VAL 4 (residue and the binding sites it lines).

Found with

  • K · Potassium ion
  • ZN · Zinc ion
  • CL · Chloride ion
  • ACT · Acetate ion

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