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Ligand · J78

J78 · (methylpyridazine piperidine propyloxyphenyl)ethylacetate

J78, (methylpyridazine piperidine propyloxyphenyl)ethylacetate (C22 H29 N3 O3, 383.5 g/mol), in the MolNFT structures on GenesisL1: bound in 6 records (3 PDB entries). Every binding site with its residues within 4.5 Å, the residues it…

Component
J78
Formula
C22 H29 N3 O3
Class
ligand
Structures
6
PDB entries
3

Binding sites

J78 in 6 structures; the first of them:

  • 1VBA · Poliovirus (type 3, sabin strain) (P3/SABIN, P3/LEON/12A(1)B) complexed with R78206 · J78 1500 · binds ILE110, THR111, TYR112, LYS113, MET132, PHE134, PHE136, ILE157 and 13 more
  • 1VBD · Poliovirus (type 1, mahoney strain) complexed with R78206 · J78 1500 · binds ILE110, THR111, TYR112, LYS113, MET132, LEU134, PHE136, ILE157 and 13 more
  • 1VBE · Poliovirus (type 3, sabin strain, mutant 242-H2) complexed with R78206 · J78 1500 · binds ILE110, THR111, TYR112, LYS113, PHE130, MET132, LEU134, PHE136 and 14 more
  • 1VBA · Poliovirus (type 3, sabin strain) (P3/SABIN, P3/LEON/12A(1) B) complexed with R78206 · J78 1500 · binds ILE110, THR111, TYR112, LYS113, MET132, PHE134, PHE136, ILE157 and 13 more
  • 1VBD · Poliovirus (type 1, mahoney strain) complexed with R78206 · J78 1500 · binds ILE110, THR111, TYR112, LYS113, MET132, LEU134, PHE136, ILE157 and 13 more
  • 1VBE · Poliovirus (type 3, sabin strain, mutant 242-H2) complexed with R78206 · J78 1500 · binds ILE110, THR111, TYR112, LYS113, PHE130, MET132, LEU134, PHE136 and 14 more

Residues it binds most

ILE 6, TYR 6, PHE 6, LEU 6, VAL 6, MET 6, ALA 6, LYS 6, PRO 6, SER 6 (residue and the binding sites it lines).

Found with

  • MYR · Myristic acid

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