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Ligand · I58

I58 · 4R-fluoro-N6-ethanimidoyl-L-lysine

I58, 4R-fluoro-N6-ethanimidoyl-L-lysine (C8 H16 F N3 O2, 205.2 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 binds most and the ligands…

Component
I58
Formula
C8 H16 F N3 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

I58 in 2 structures; the first of them:

  • 1R35 · Murine inducible nitric oxide synthase oxygenase dimer, tetrahydrobiopterin and… · I58 A800 · binds GLN257, TRP340, TYR341, PRO344, ALA345, VAL346, GLY365, TRP366 and 4 more
  • 1R35 · Murine inducible nitric oxide synthase oxygenase dimer, tetrahydrobiopterin and… · I58 A800 · binds GLN257, TRP340, TYR341, PRO344, ALA345, VAL346, GLY365, TRP366 and 4 more

Residues it binds most

TRP 4, TYR 4, ALA 4, ASP 4, GLN 4, GLU 4, GLY 4, MET 4, PRO 4, VAL 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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