Table 6 Binding parameters of the phytocompounds and the standard references with the amino acid residues at the active binding site of furin
Sl. No | Compound ID | Conventional hydrogen bonding | Hydrophobic interaction | Carbon-hydrogen interaction | Electrostatic interaction |
|---|---|---|---|---|---|
1 | C_18 | ASP191, SER368, THR365, ARG193, FMT601, ASN295 | – | – | – |
2 | C_4 | ARG197, THR365, FMT601 | Â | HIS194 | ARG298 |
3 | C_5 | HIS364, THR365, ASN295 | – | FMT601 | ARG298 |
4 | PGPRTRA | ASN295, FMT601, SER368, HIS194, LEU227, GLY229 | – | – | ASP258, GLU299 |
5 | Naphthofluorescein | HIS194, SER368 | LEU227 | – | – |