Table 1 Structural statistics for the ensemble of 20 low-energy structures of AcrF1.
Number of restraints | |
|---|---|
Distance restraints * | |
Short range, |i−j|≤1 | 592 |
Medium range, 1<|i−j|<5 | 153 |
Long range, |i−j|≥5 | 384 |
Dihedral angle restraints | |
ϕ, ψ pairs | 51 |
Pairwise r.m.s.d. (Å)† | |
Backbone atoms | 0.3 |
All heavy atoms | 0.9 |
Ramachandran statistics (%) ‡ | |
Most favored regions | 81.2 |
Additional allowed regions | 17.8 |
Generously allowed regions | 0.1 |
Disallowed regions | 0.0 |