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Ligand · N8C

N8C · 1-nitrooctane

N8C, 1-nitrooctane (C8 H17 N O2, 159.2 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 found with it.

Component
N8C
Formula
C8 H17 N O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

N8C in 2 structures; the first of them:

  • 3D9E · Nitroalkane oxidase: active site mutant D402N crystallized with 1-nitrooctane · N8C A600 · binds ILE92, VAL95, ALA96, ALA98, LEU99, PHE273, SER276, LEU279 and 4 more
  • 3D9E · Nitroalkane oxidase: active site mutant D402N crystallized with 1- nitrooctane · N8C A600 · binds ILE92, VAL95, ALA96, ALA98, LEU99, PHE273, SER276, LEU279 and 4 more

Residues it binds most

LEU 8, PHE 8, VAL 8, ALA 8, MET 8, ASN 8, SER 8, GLU 4, ILE 4 (residue and the binding sites it lines).

Found with

  • FAD · Flavin-adenine dinucleotide
  • GOL · Glycerol

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