Restraints for structure calculations |
|
Total no. of restraints used |
556 |
Total no. of NOE restraints |
393 |
No. of intraresidual restraints |
139 |
No. of sequential (|i−j| = 1) restraints |
120 |
No. of medium-range (1 < |i−j| < 5) restraints |
44 |
No. of long-range (|i−j| ≥ 5) restraints |
90 |
No. of hydrogen bond restraints |
32 |
No. of dihedral angle restraints |
131 |
Root mean square deviations from experimental restraints |
|
Distance deviations (Å) |
0.018 ± 0.0011 |
Dihedral deviations (°) |
0.349 ± 0.0716 |
Deviations from idealized geometry |
|
Bonds (Å) |
0.0036 ± 0.0001 |
Angles (°) |
0.5733 ± 0.0051 |
Impropers (°) |
0.3849 ± 0.0096 |
Root mean square deviations of the 15 structures from the mean coordinates (Å) |
|
Backbone (residues Phe11 to Leu87) |
0.54 ± 0.14 |
Heavy atoms (residues Phe11 to Leu87) |
1.11 ± 0.20 |
Ramachandran plot statistics for residues Phe11 to Leu87 (%) |
|
Residues in most favored regions |
88.0 |
Residues in additional allowed regions |
11.6 |
Residues in generously allowed regions |
0.4 |
Residues in disallowed regions |
0.0 |