GL1X · GenesisL1 explorer

Ligand · M66

M66 · (1R,2S,5S)-3-{(2S)-2-(2,3-dihydro-1H-inden-2-yl)-2-[({(1S)-2,2-dimethyl-1-[(2-oxopiperidin-1-yl)methyl]propyl}carbamoyl)amino]acetyl}-6,6-dimethyl-N-{(1S)-1-[oxo(prop-2-en-1-ylamino)acetyl]butyl}-3-azabicyclo[3.1.0]hexane-2-carboxamide

M66, (1R,2S,5S)-3-{(2S)-2-(2,3-dihydro-1H-inden-2-yl)-2-[({(1S)-2,2-dimethyl-1-[(2-oxopiperidin-1-yl)methyl]propyl}carbamoyl)amino]acetyl}-6,6-dimethyl-N-{(1S)-1-[oxo(prop-2-en-1-ylamino)acetyl]butyl}-3-azabicyclo[3.1.0]hexane-2-carboxamide…

Component
M66
Formula
C40 H58 N6 O6
Class
ligand
Structures
2
PDB entries
1

Binding sites

M66 in 2 structures; the first of them:

  • 3KN2 · HCV NS3 Protease Domain with ketoamide inhibitor · M66 A999 · binds GLN41, THR42, PHE43, VAL55, HIS57, ARG123, ILE132, LEU135 and 11 more
  • 3KN2 · HCV NS3 protease domain with ketoamide inhibitor · M66 A999 · binds GLN41, THR42, PHE43, VAL55, HIS57, ARG123, ILE132, LEU135 and 11 more

Residues it binds most

ALA 2, ARG 2, PHE 2, SER 2, VAL 2, ASP 2, CYS 2, GLN 2, GLY 2, HIS 2 (residue and the binding sites it lines).

Found with

  • ZN · Zinc ion

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