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Ligand · 3R9

3R9 · (3S,5S,7aR)-5-(sulfanylmethyl)tetrahydro[1,3]thiazolo[4,3-b][1,3]thiazole-3-carboxylic acid

3R9, (3S,5S,7aR)-5-(sulfanylmethyl)tetrahydro[1,3]thiazolo[4,3-b][1,3]thiazole-3-carboxylic acid (C7 H11 N O2 S3, 237.4 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site with its residues…

Component
3R9
Formula
C7 H11 N O2 S3
Class
ligand
Structures
1
PDB entries
1

Binding sites

3R9 in 1 structure; the first of them:

  • 5EV8 · Crystal structure of the metallo-beta-lactamase IMP-1 in complex with the bisthiazolidine… · 3R9 A303 · binds VAL25, TRP28, VAL31, HIS77, HIS79, ASP81, HIS139, CYS158 and 5 more

Residues it binds most

HIS 4, VAL 5, GLY 5, LYS 5, ASN 5, ASP 4, CYS 4, LEU 4, GLU 2, TRP 2 (residue and the binding sites it lines).

Found with

  • NA · Sodium ion
  • ZN · Zinc ion
  • CL · Chloride ion
  • DMS · Dimethyl sulfoxide
  • EDO · 1,2-ethanediol

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