. Author manuscript; available in PMC: 2021 Mar 18.

Published in final edited form as: J Am Chem Soc. 2020 Mar 9;142(11):5204–5211. doi: 10.1021/jacs.9b12770

Table 1.

NMR restraints and structural statistics for the 1:1 dGMP-Pu19m2 G-quadruplex.

NOE-Based Distance Restraints
Total	520
Intra-residue	353
Inter-residue	167
Sequential	93
dGMP-Pu19m2	11
Long-range	63
Other Restraints
Hydrogen bond restraints	48
Torsion angle restraints	20
G-quartet planarity restraints	48
Structural Statistics
Pairwise heavy atom RMSD (Å)
Overall	0.99 ± 0.22
G-tetrad core	0.74 ± 0.16
Violations
Max. NOE restraint violation (Å)	0.07