Application | Comment | Organism |
---|---|---|
drug development | binding mode of 2-O-(4-O-galloylgalloyl)-1,3,4-tri-O-galloyl-beta-D-glucose can be used as a scaffold for anti-HCV for the further reconstruction and design of new protease inhibitors | Hepacivirus C |
Cloned (Comment) | Organism |
---|---|
- |
Hepacivirus C |
Inhibitors | Comment | Organism | Structure |
---|---|---|---|
1,3,4-tri-O-galloyl-beta-D-glucose | polyphenol compound from Saxifraga melanocentra | Hepacivirus C | |
1,3,6-tri-O-galloyl-beta-D-glucose | polyphenol compound from Terminalia chebula | Hepacivirus C | |
1-O-(3-O-galloylgalloyl)-2,3,4-tri-O-galloyl-beta-D-glucose | polyphenol compound from Saxifraga melanocentra | Hepacivirus C | |
2-O-(4-O-galloylgalloyl)-1,3,4-tri-O-galloyl-beta-D-glucose | polyphenol compound from Rhodiola kirilowii | Hepacivirus C | |
3,6-di-O-galloyl-beta-D-glucose | polyphenol compound from Saxifraga melanocentra | Hepacivirus C | |
additional information | two galloyl residues at 3 and 4 positions of glucopyranose ring of inhibitors are predicted to interact with Ser139, Gly137, Ala157, and Asp81 by hydrogen bond interaction and with Ala156 and Hie57 by hydrophobic interaction and to be essential for the activities of the series of inhibitors | Hepacivirus C |
Organism | UniProt | Comment | Textmining |
---|---|---|---|
Hepacivirus C | - |
- |
- |
Purification (Comment) | Organism |
---|---|
by affinity chromatography | Hepacivirus C |
Synonyms | Comment | Organism |
---|---|---|
NS3 serine protease | - |
Hepacivirus C |
IC50 Value | IC50 Value Maximum | Comment | Organism | Inhibitor | Structure |
---|---|---|---|---|---|
0.00068 | - |
- |
Hepacivirus C | 1-O-(3-O-galloylgalloyl)-2,3,4-tri-O-galloyl-beta-D-glucose | |
0.0008 | - |
- |
Hepacivirus C | 2-O-(4-O-galloylgalloyl)-1,3,4-tri-O-galloyl-beta-D-glucose | |
0.001 | - |
- |
Hepacivirus C | 1,3,4-tri-O-galloyl-beta-D-glucose | |
0.01009 | - |
- |
Hepacivirus C | 1,3,6-tri-O-galloyl-beta-D-glucose | |
0.9497 | - |
- |
Hepacivirus C | 3,6-di-O-galloyl-beta-D-glucose |