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Ligand · WY2

WY2 · (6,7-dihydro-5H-cyclopenta[d]imidazo[2,1-b]thiazol-2-yl]-4,7-dihydro[1,4]thiazepine-3,6-dicarboxylic acid

WY2, (6,7-dihydro-5H-cyclopenta[d]imidazo[2,1-b]thiazol-2-yl]-4,7-dihydro[1,4]thiazepine-3,6-dicarboxylic acid (C15 H13 N3 O4 S2, 363.4 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site…

Component
WY2
Formula
C15 H13 N3 O4 S2
Class
ligand
Structures
4
PDB entries
2

Binding sites

WY2 in 4 structures; the first of them:

  • 1Q2P · SHV-1 class A beta-lactamase complexed with penem WAY185229 · WY2 A400 · binds MET69, SER70, LYS73, ASP104, TYR105, MET129, SER130, ASN132 and 7 more
  • 1Q2Q · Enterobacter cloacae GC1 class C beta-lactamase complexed with penem WAY185229 · WY2 A400 · binds GLY63, SER64, LYS67, LEU119, GLN120, TYR150, ASN152, TYR224 and 4 more
  • 1Q2P · Shv-1 class a beta-lactamase complexed with penem WAY185229 · WY2 A400 · binds MET69, SER70, LYS73, ASP104, TYR105, MET129, SER130, ASN132 and 7 more
  • 1Q2Q · Enterobacter cloacae GC1 class C beta-lactamase complexed with penem WAY185229 · WY2 A400 · binds GLY63, SER64, LYS67, LEU119, GLN120, TYR150, ASN152, TYR224 and 4 more

Residues it binds most

SER 4, THR 4, ASN 4, GLY 4, TYR 4, LYS 4, MET 2, ALA 2, ASP 2, GLN 2 (residue and the binding sites it lines).

Found with

  • MA4 · Cyclohexyl-hexyl-beta-D-maltoside
  • GOL · Glycerol

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