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Ligand · PK8

PK8 · 9-oxa-7-thia-1-azonia-8$l^{2}-zincabicyclo[4.3.0]nona-1,3,5-triene

PK8, 9-oxa-7-thia-1-azonia-8$l^{2}-zincabicyclo[4.3.0]nona-1,3,5-triene (C5 H4 N O S Zn +1, 191.5 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
PK8
Formula
C5 H4 N O S Zn +1
Class
ligand
Structures
2
PDB entries
1

Binding sites

PK8 in 2 structures; the first of them:

  • 7B83 · Structure of SARS-CoV-2 Main Protease bound to pyrithione zinc · PK8 A401 · binds THR25, THR26, LEU27, HIS41, ASN142, GLY143, CYS145, HIS164
  • 7B83 · Structure of SARS-cov-2 main protease bound to pyrithione zinc · PK8 A401 · binds THR25, THR26, LEU27, HIS41, ASN142, GLY143, CYS145, HIS164

Residues it binds most

HIS 2, THR 2, ASN 2, CYS 2, GLY 2, LEU 2 (residue and the binding sites it lines).

Found with

  • CL · Chloride ion
  • DMS · Dimethyl sulfoxide
  • IMD · Imidazole

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