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Ligand · XFL

XFL · 6,6'-(pyridine-2,6-diyldiethane-2,1-diyl)bis(4-methylpyridin-2-amine)

XFL, 6,6'-(pyridine-2,6-diyldiethane-2,1-diyl)bis(4-methylpyridin-2-amine) (C21 H25 N5, 347.5 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…

Component
XFL
Formula
C21 H25 N5
Class
ligand
Structures
2
PDB entries
1

Binding sites

XFL in 2 structures; the first of them:

  • 3N5Y · Structure of neuronal nitric oxide synthase heme domain in complex with… · XFL A800 · binds MET336, GLN478, PRO565, VAL567, MET570, PHE584, SER585, GLY586 and 7 more
  • 3N5Y · Structure of neuronal nitric oxide synthase heme domain in complex with… · XFL A800 · binds MET336, GLN478, PRO565, VAL567, MET570, PHE584, SER585, GLY586 and 7 more

Residues it binds most

MET 4, TRP 4, TYR 4, GLN 4, GLU 4, GLY 4, PHE 4, PRO 4, SER 4, VAL 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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