GL1X · GenesisL1 explorer

Ligand · 0NQ

0NQ · N-{(1S)-3-[(5S)-5-tert-butyl-1-(3,3-dimethylbutyl)-4-hydroxy-2-oxo-2,5-dihydro-1H-pyrrol-3-yl]-1-ethoxy-1-oxido-1,4-dihydro-2,4,1-benzodiazaphosphinin-7-yl}methanesulfonamide

0NQ, N-{(1S)-3-[(5S)-5-tert-butyl-1-(3,3-dimethylbutyl)-4-hydroxy-2-oxo-2,5-dihydro-1H-pyrrol-3-yl]-1-ethoxy-1-oxido-1,4-dihydro-2,4,1-benzodiazaphosphinin-7-yl}methanesulfonamide (C24 H37 N4 O6 P S, 540.6 g/mol), in the MolNFT structures…

Component
0NQ
Formula
C24 H37 N4 O6 P S
Class
ligand
Structures
2
PDB entries
1

Binding sites

0NQ in 2 structures; the first of them:

  • 4EAW · HCV NS5B in complex with IDX375 · 0NQ A601 · binds PHE193, PRO197, ARG200, SER288, ASN291, TYR316, GLY317, ASP318 and 13 more
  • 4EAW · HCV NS5B in complex with IDX375 · 0NQ A601 · binds PHE193, PRO197, ARG200, SER288, ASN291, TYR316, GLY317, ASP318 and 13 more

Residues it binds most

GLY 4, SER 4, TYR 4, ASN 4, ASP 4, ARG 4, CYS 4, GLN 4, ILE 4, LEU 4 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion
  • EDO · 1,2-ethanediol
  • PEG · Di(hydroxyethyl)ether

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