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Ligand · 89N

89N · (2E)-but-2-ene-1,4-diol

89N, (2E)-but-2-ene-1,4-diol (C4 H8 O2, 88.1 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
89N
Formula
C4 H8 O2
Class
ligand
Structures
4
PDB entries
2

Binding sites

89N in 4 structures; the first of them:

  • 7S5G · PCSK9 in complex with compound 19 · 89N C101 · binds CYS375, CYS378, PHE4, FTR5, PRO6
  • 7S5H · PCSK9(deltaCRD) in complex with cyclic peptide 35 · 89N C101 · binds CYS375, CYS378, PHE4, FTR5, PRO6
  • 7S5G · PCSK9 in complex with compound 19 · 89N C101 · binds CYS378, PHE5, PRO7
  • 7S5H · PCSK9(DELTACRD) in complex with cyclic peptide 35 · 89N C101 · binds CYS378, PHE5, FTR6, PRO7

Residues it binds most

CYS 4, PHE 4, PRO 4, FTR 3 (residue and the binding sites it lines).

Found with

  • DHL · 2-amino-ethanethiol
  • MPT · Beta-mercaptopropionic acid
  • GOL · Glycerol
  • 8DN · 1-(3,5-dimethylphenyl)-4-methyl-1H-1,2,3-triazole
  • B74 · (3-methylphenyl)methanol

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