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Ligand · PM6

PM6 · 9H-purine-6-thiol

PM6, 9H-purine-6-thiol (C5 H4 N4 S, 152.2 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 residues it binds most and the ligands found with it.

Component
PM6
Formula
C5 H4 N4 S
Class
ligand
Structures
4
PDB entries
2

Binding sites

PM6 in 4 structures; the first of them:

  • 3BGD · Thiopurine S-Methyltransferase · PM6 A301 · binds TRP24, PHE35, ARG147, GLY148, VAL151, ALA152, LEU180, PRO190 and 2 more
  • 3NS1 · Crystal Structure of Bovine Xanthine Oxidase in Complex with 6-Mercaptopurine · PM6 C1 · binds GLU802, LEU873, SER876, ARG880, PHE914, SER1008, PHE1009, THR1010 and 4 more
  • 3BGD · Thiopurine S-methyltransferase · PM6 A301 · binds TRP24, PHE35, ARG147, GLY148, VAL151, ALA152, LEU180, PRO190 and 2 more
  • 3NS1 · Crystal structure of bovine xanthine oxidase in complex with 6- mercaptopurine · PM6 C1 · binds GLU802, LEU873, SER876, ARG880, PHE914, SER1008, PHE1009, THR1010 and 4 more

Residues it binds most

LEU 12, PHE 12, ALA 8, ARG 8, PRO 4, SER 4, THR 8, TRP 4, VAL 6, GLN 4 (residue and the binding sites it lines).

Found with

  • FAD · Flavin-adenine dinucleotide
  • FES · Fe2/s2 (inorganic) cluster
  • MOS · Dioxothiomolybdenum(vi) ion
  • MTE · Phosphonic acidmono-(2-amino-5,6-dimercapto-4-oxo-3,7,8A,9,10,10A-hexahydro-4H-8-oxa-1,3,9,10-tetraaza-anthracen-7-ylmethyl)ester
  • SAH · S-adenosyl-L-homocysteine

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