NMR distance and torsion angle restraints |
NOE-derived distance restraints |
Total |
316 |
Intra-residue |
216 |
Inter-residue |
100 |
Sequential |
70 |
Long-range |
30 |
Hydrogen bond restraints |
24 |
Torsion angle restraints |
65 |
G-quartet planarity restraints |
36 |
Structure statistics |
Violations |
|
Mean NOE restraint violation (Å) |
0.079 ± 0.0002 |
Max. NOE restraint violation (Å) |
0.196 |
Max. torsion angle restraint violation (°) |
4.765 |
Deviations from idealized geometry |
Bond length (Å) |
0.012 ± 0.0002 |
Bond angle (°) |
2.525 ± 0.0000 |
Pairwise heavy atom RMSD (Å) |
Overall |
2.63 |
G-quartets |
0.82 |
G-quartets and propeller (AT) loop |
0.96 |
G-quartets and diagonal (ACACA) loop |
2.60 |
G-quartets and edgewise (GAC) loop |
1.51 |
G-quartets and A4, T5, G17, C19 |
0.99 |