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Ligand · AXW

AXW · 6-{[(3S,4S)-4-{2-[(2-fluorobenzyl)amino]ethoxy}pyrrolidin-3-yl]methyl}-4-methylpyridin-2-amine

AXW, 6-{[(3S,4S)-4-{2-[(2-fluorobenzyl)amino]ethoxy}pyrrolidin-3-yl]methyl}-4-methylpyridin-2-amine (C20 H27 F N4 O, 358.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its…

Component
AXW
Formula
C20 H27 F N4 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

AXW in 2 structures; the first of them:

  • 3TYL · Structure of neuronal nitric oxide synthase heme domain in complex with… · AXW A800 · binds LEU337, GLN478, PRO565, VAL567, PHE584, SER585, GLY586, TRP587 and 6 more
  • 3TYL · Structure of neuronal nitric oxide synthase heme domain in complex with… · AXW A800 · binds LEU337, GLN478, PRO565, VAL567, PHE584, SER585, GLY586, TRP587 and 6 more

Residues it binds most

TRP 4, TYR 4, MET 4, GLN 4, GLU 4, GLY 4, LEU 4, PHE 4, PRO 4, SER 4 (residue and the binding sites it lines).

Found with

  • H4B · 5,6,7,8-tetrahydrobiopterin
  • HEM · Protoporphyrin IX containing Fe
  • ZN · Zinc ion
  • ACT · Acetate ion

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