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Ligand · HB3

HB3 · 2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamine

HB3, 2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamine (C4 H8 N4 S, 144.2 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…

Component
HB3
Formula
C4 H8 N4 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

HB3 in 2 structures; the first of them:

  • 7DNQ · Crystal structure of M.tuberculosis imidazole glycerol phosphate dehydratase in complex… · HB3 A305 · binds GLU21, HIS73, HIS74, GLU77, ASP78, HIS152
  • 7DNQ · Crystal structure of M.TUBERCULOSIS imidazole glycerol phosphate dehydratase in complex… · HB3 A305 · binds GLU21, HIS73, HIS74, GLU77

Residues it binds most

HIS 2, GLU 2, ASP 1 (residue and the binding sites it lines).

Found with

  • MN · Manganese (II) ion
  • CL · Chloride ion
  • EDO · 1,2-ethanediol

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