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Ligand · WBY

WBY · 6-hydroxy-2-methyl[1,3]thiazolo[4,5-d]pyrimidine-5, 7(4H,6H)-dione

WBY, 6-hydroxy-2-methyl[1,3]thiazolo[4,5-d]pyrimidine-5, 7(4H,6H)-dione (C6 H5 N3 O3 S, 199.2 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…

Component
WBY
Formula
C6 H5 N3 O3 S
Class
ligand
Structures
4
PDB entries
2

Binding sites

WBY in 4 structures; the first of them:

  • 7KE2 · Crystal structure of Staphylococcus aureus ketol-acid reductoisomerase in complex with… · WBY A401 · binds GLU230, LEU233, LEU237, SER249, ILE250, SER251, ALA254, ASP190 and 1 more
  • 7KH7 · Crystal structure of Staphylococcus aureus ketol-acid reductoisomerase in complex with… · WBY B401 · binds PRO129, GLY131, PRO132, ASP190, GLU194, GLU230, ILE234, LEU237 and 5 more
  • 7KE2 · Crystal structure of staphylococcus aureus ketol-acid reductoisomerase in complex with… · WBY A401 · binds LEU233, SER249, ILE250, SER251, ALA254, ASP190, GLU194
  • 7KH7 · Crystal structure of staphylococcus aureus ketol-acid reductoisomerase in complex with… · WBY B401 · binds PRO132, ASP190, GLU194, GLU230, ILE234, LEU237, SER249, ILE250 and 2 more

Residues it binds most

SER 8, GLU 8, LEU 8, ILE 8, ASP 8, ALA 7, PRO 2, GLY 1, VAL 1 (residue and the binding sites it lines).

Found with

  • MG · Magnesium ion
  • NAP · Nadp nicotinamide-adenine-dinucleotide phosphate
  • NDP · Nadph dihydro-nicotinamide-adenine-dinucleotide phosphate

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