Table 1.

NMR and refinement statistics for Ebola fusion loop in DPC micelles

	pH 7.0	pH 5.5
NMR distance and dihedral restraints
Distance restraints
Total NOE	665	517
Intraresidue	151	155
Interresidue	514	362
Sequential (i − j = 1)	281	216
Medium-range (i − j ≤ 4)	188	114
Long-range (i − j ≥ 5)	45	32
Total dihedral angle restraints
φ	8	10
ψ	5	10
Structure statistics
Violations (mean and SD)
Distance restraints (Å)	0.029 ± 0.001	0.024 ± 0.001
Dihedral angle restraints (°)	0.28 ± 0.10	0.20 ± 0.05
Maximum dihedral angle violation (°)	0	0
Maximum distance restraint violation (Å)	0	0
Deviations from idealized geometry
Bond lengths (Å)	0.0037 ± 0.0001	0.0029 ± 0.0001
Bond angles (°)	0.52 ± 0.01	0.48 ± 0.11
Impropers (°)	0.35 ± 0.01	0.29 ± 0.02
Average pairwise rmsd* (Å)
Heavy atoms	1.45 ± 0.43	1.06 ± 0.30
Backbone	1.95 ± 0.48	1.54 ± 0.31

*Calculated from the 20 lowest-energy structures out of 200.