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Ligand · LM3

LM3 · N,N-dimethyl-6-(naphthalen-1-yl)-5-(pyridin-4-yl)pyridazin-3-amine

LM3, N,N-dimethyl-6-(naphthalen-1-yl)-5-(pyridin-4-yl)pyridazin-3-amine (C21 H18 N4, 326.4 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…

Component
LM3
Formula
C21 H18 N4
Class
ligand
Structures
2
PDB entries
1

Binding sites

LM3 in 2 structures; the first of them:

  • 4F9Y · Human P38 alpha MAPK In Complex With a Novel and Selective Small Molecule Inhibitor · LM3 A403 · binds VAL38, ALA51, VAL52, LYS53, LEU75, ILE84, LEU86, LEU104 and 9 more
  • 4F9Y · Human P38 alpha MAPK in complex with a novel and selective small molecule inhibitor · LM3 A403 · binds VAL38, ALA51, VAL52, LYS53, LEU75, ILE84, LEU86, LEU104 and 9 more

Residues it binds most

LEU 2, VAL 2, ALA 2, ASN 2, ASP 2, HIS 2, ILE 2, LYS 2, MET 2, SER 2 (residue and the binding sites it lines).

Found with

  • GG5 · 4-[3-(4-fluorophenyl)-1H-pyrazol-4-yl]pyridine
  • PEG · Di(hydroxyethyl)ether
  • BME · Beta-mercaptoethanol

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