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. 2006 Sep 11;103(38):13950–13955. doi: 10.1073/pnas.0606312103

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