Table 1. Ranking of BLM peptides potentially phosphorylated by Chk1 as obtained by in silico analysis.
Serial number |
Ser/Thr position |
Peptide sequence |
Residue based statistical pair potential scores (BT) |
Binding energy calculated using Insight II (Kcal mol−1) |
||
---|---|---|---|---|---|---|
VDW | ELE | TOTAL | ||||
1 | Ser646 | −7.72 | −68.724 | −36.337 | −105.061 | |
2 | Ser729 | −5.26 | −56.895 | −26.337 | −83.232 | |
3 | Thr581 | −5.03 | −55.567 | −34.583 | −90.15 | |
4 | Ser1361 | −4.81 | −43.757 | −26.804 | −70.561 | |
5 | Ser1375 | −3.79 | −53.314 | −35.054 | −88.368 | |
6 | Ser434 | −3.22 | −57.886 | −39.371 | −97.257 | |
7 | Thr1350 | −3.01 | −55.531 | −41.978 | −97.509 | |
8 | Ser367 | −2.72 | −66.311 | −43.226 | −109.537 | |
9 | Ser602 | −2.4 | −52.816 | −41.17 | −93.986 | |
10 | Thr182 | −2.08 | −53.744 | −29.651 | −83.395 |