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Ligand · IXX

IXX · 3-(5H-dibenzo[b,f]azepin-5-yl)-N,N-dimethylpropan-1-amine

IXX, 3-(5H-dibenzo[b,f]azepin-5-yl)-N,N-dimethylpropan-1-amine (C19 H24 N2, 280.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds…

Component
IXX
Formula
C19 H24 N2
Class
ligand
Structures
2
PDB entries
2

Binding sites

IXX in 2 structures; the first of them:

  • 6G9B · Crystal structure of ebolavirus glycoprotein in complex with imipramine · IXX A609 · binds ILE38, LEU43, VAL66, LEU184, ILE185, LEU186, LEU515, MET548
  • 7LWD · Cryo-EM structure of the wild-type human serotonin transporter complexed with vilazodone… · IXX A801 · binds TYR95, ALA96, ASP98, ALA169, ILE172, TYR175, PHE335, SER336 and 4 more

Residues it binds most

ILE 3, LEU 1, ALA 2, TYR 2, PHE 1, SER 1, ARG 1, ASP 1, GLN 1, GLY 1 (residue and the binding sites it lines).

Found with

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose
  • YG7 · 5-{4-[4-(5-cyano-1H-indol-3-yl)butyl]piperazin-1-yl}-1-benzofuran-2-carboxamide
  • DMS · Dimethyl sulfoxide
  • GOL · Glycerol

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