Table 1. D-Score Values and Residues of BA and KA Interacting with Selected Proteins.
Akt
(1O6L) |
mTOR
(4JSP) |
|||
---|---|---|---|---|
D-score (kcal/mol) | interacting residues | D-score (kcal/mol) | interacting residues | |
BA | –7.5 | Thr162 | –8.4 | Lysl452 |
NF-kB
(1SVC) |
mTOR
(4JSP) |
STAT3
(6NJS) |
||||
---|---|---|---|---|---|---|
D-score (kcal/mol) | interacting residues | D-score (kcal/mol) | interacting residues | D-score (kcal/mol) | interacting residues | |
KA | –7.4 | Lysl49 | –8.1 | Arg2217 | –6.9 | Lys573 |
Asnl421 | Lys574 | |||||
Asn567 |