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Ligand · 328

328 · 4-({4-[(4-methoxypyridin-2-yl)amino]piperidin-1-yl}carbonyl)benzonitrile

328, 4-({4-[(4-methoxypyridin-2-yl)amino]piperidin-1-yl}carbonyl)benzonitrile (C19 H20 N4 O2, 336.4 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…

Component
328
Formula
C19 H20 N4 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

328 in 2 structures; the first of them:

  • 3EAI · Structure of inhibited murine iNOS oxygenase domain · 328 A905 · binds GLN257, ILE259, ARG260, ALA276, TYR341, PRO344, ALA345, VAL346 and 8 more
  • 3EAI · Structure of inhibited murine inos oxygenase domain · 328 A905 · binds GLN257, ILE259, ARG260, ALA276, TYR341, PRO344, ALA345, VAL346 and 8 more

Residues it binds most

ALA 4, ARG 4, TYR 4, TRP 4, ASN 4, ASP 4, GLN 4, GLU 4, GLY 4, ILE 4 (residue and the binding sites it lines).

Found with

  • H4B · 5,6,7,8-tetrahydrobiopterin
  • HEM · Protoporphyrin IX containing Fe
  • SO4 · Sulfate ion

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