From: In silico panning for a non-competitive peptide inhibitor
4thround peptides | Additional round peptides | Synthesized peptides | ||||||
---|---|---|---|---|---|---|---|---|
Rank | Peptide sequence | Docking energy (kcal/mol) | Rank | Peptide sequence | Docking energy (kcal/mol) | Rank | Peptide sequence | Docking energy (kcal/mol) |
1 | GERD | -115 | 1 | GEKD | -149 | 1 | GEKD | -149 |
2 | SERG | -114 | 2 | SEKD | - 88 | 2 | GERD | -115 |
3 | DSRD | -114 | 3 | GDKD | - 87 | 3 | SERG | -114 |
4 | GDPR | -113 | 4 | DSKD | - 75 | 38 | DDDD | 22 |
5 | GDRD | -110 | 5 | GEKE | - 22 | |||
6 | SDRG | -109 | ||||||
7 | GDRG | -103 | ||||||
8 | GDGD | -99 | ||||||
9 | GEDG | -99 | ||||||
10 | GGGG | -98 |