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Ligand · D2S

D2S · 4,4'-disulfanediyldibenzene-1,3-diol

D2S, 4,4'-disulfanediyldibenzene-1,3-diol (C12 H10 O4 S2, 282.3 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 it binds most and the ligands…

Component
D2S
Formula
C12 H10 O4 S2
Class
ligand
Structures
2
PDB entries
1

Binding sites

D2S in 2 structures; the first of them:

  • 4FIK · Human carbonic anhydrase II H64A complexed with thioxolone hydrolysis products · D2S A304 · binds ASN67, GLU69, PHE70, ASP72, ILE91, GLN92, PHE131
  • 4FIK · Human carbonic anhydrase II H64A complexed with thioxolone hydrolysis products · D2S A304 · binds ASN67, GLU69, PHE70, ASP72, ILE91, GLN92, PHE131

Residues it binds most

PHE 2, ASN 2, ASP 2, GLN 2, GLU 2, ILE 2 (residue and the binding sites it lines).

Found with

  • TH0 · 4-mercaptobenzene-1,3-diol
  • TH7 · 2,4-dihydroxybenzenesulfenic acid
  • ZN · Zinc ion
  • SO4 · Sulfate ion
  • GOL · Glycerol

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