Table 3.
Δda (Å) | ΔEb (Kcal/mol) | Icc (°) | Twavd(°) | Protein–protein steric clashes |
---|---|---|---|---|
0 | 0 | 5 | 37 | ++ |
2.5 | 4 | 22 | 34 | + |
4.5 | 15 | 42 | 30 | ∼0 |
7.5 | 37 | 67 | 23 | – |
8.5 | 44 | 82 | 20 | – |
Δd: increase of the distance separating two EBS core motifs in reference to the starting structure.
ΔE: difference between total energies of constained and starting structures.
Ic: curvative intensity.
Twav: average twist of the 4 bp spacer.