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Ligand · JEN

JEN · 3-methoxy-6-[4-(3-methylphenyl)-1-piperazinyl]pyridazine

JEN, 3-methoxy-6-[4-(3-methylphenyl)-1-piperazinyl]pyridazine (C16 H20 N4 O, 284.4 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…

Component
JEN
Formula
C16 H20 N4 O
Class
ligand
Structures
4
PDB entries
2

Binding sites

JEN in 4 structures; the first of them:

  • 1R09 · Human rhinovirus 14 complexed with antiviral compound R 61837 · JEN 11000 · binds ILE104, LEU106, PHE124, SER126, TYR128, TYR152, PHE186, VAL188 and 7 more
  • 2HWF · A comparison of the anti-rhinoviral drug binding pocket in HRV14 and HRV1A · JEN 1700 · binds ILE101, THR102, LEU103, PHE121, SER123, ILE125, TYR147, PHE182 and 8 more
  • 1R09 · Human rhinovirus 14 complexed with antiviral compound R 61837 · JEN 11000 · binds ILE104, LEU106, PHE124, SER126, TYR128, TYR152, PHE186, VAL188 and 7 more
  • 2HWF · A comparison of the anti-rhinoviral drug binding pocket in HRV14 and HRV1A · JEN 1700 · binds ILE101, THR102, LEU103, PHE121, SER123, ILE125, TYR147, PHE182 and 8 more

Residues it binds most

TYR 4, ILE 4, MET 4, PHE 4, ASN 4, LEU 4, HIS 4, SER 4, VAL 2, THR 2 (residue and the binding sites it lines).

Found with

  • DMS · Dimethyl sulfoxide

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