Table 1.
NMR constraints and structural statistics for the refined structures of the 447–52D Fv-bound V3JR-FL peptide (30 structures)
NMR distance constraints | |
Total | 308 |
Intra-residue | 180 |
Sequential | 55 |
Medium- and long-range | 73 |
Dihedral angle | 25 |
Hydrogen bond | 2 |
NOE violations | |
Maximum individual violation, Å | 0.5 |
rmsd of NOE violation | 0.0108 ± 0.0031 |
Deviation from ideal covalent geometry | |
Bond lengths, Å | 0.0011 ± 0.0002 |
Bond angles, ° | 0.3496 ± 0.0127 |
Improper angles, ° | 0.1202 ± 0.0341 |
Mean rmsd values, Å | |
All backbone atoms | 0.85 |
All heavy atoms | 1.82 |