Table 11. Values of the Key Properties Correlated with Higher Affinities at the Four Identified Positionsa.
PAK1 (mean
pKi = 5.12) |
TYRO3 (mean pKi = 5.69) |
FLT1 (mean pKi = 6.47) |
|||||
---|---|---|---|---|---|---|---|
position | desirable property (unit) | amino acid | value | amino acid | value | amino acid | value |
13 | large size (Da) | Asn329 | 132 | Lys572 | 146 | Asn893 | 132 |
13 | electrophilicity (KD score) | Asn329 | –3.5 | Lys572 | –3.9 | Asn893 | –3.5 |
23 | large size (Da) | Gly349 | 75 | His598 | 155 | Tyr914 | 181 |
31 | small size (Da) | Lys391 | 146 | Ala647 | 89 | Ala1024 | 89 |
31 | hydrophobicity (KD score) | Lys391 | –3.9 | Ala647 | 1.8 | Ala1024 | 1.8 |
35 | hydrophobicity (KD score) | Thr406 | –0.7 | Ala662 | 1.8 | Cys1039 | 2.5 |
The KD score corresponds to the Kyte and Doolitle hydrophobicity96.