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. 2015 May 29;11(5):e1004910. doi: 10.1371/journal.ppat.1004910

Table 2. Structural statistics.

Experimental restraints 
Distance restraints A 2522
    Intra-residue 456
    Inter-residue
        Short-range (|i-j| = 1) 702
        Medium-range (1< |i-j| <5) 246
        Long-range (|i-j| >5) 708
Inter-monomer 410 (2x205)
Dihedral restraints (ϕ/ψ) 176 (2x88)
Structural quality 
Coordinate precision (Å) B *
    N, Cα, C' 0.35 ± 0.08
    Heavy atoms 0.66 ± 0.05
Restraint RMSD C
    Distance restraints (Å) 0.015 ± 0.003
    Dihedral restraints (°) 0.808 ± 0.102
Deviation from idealized geometry D
    Bond lengths (Å) 0.008
    Bond angles (°) 1.0
Ramachandran plot (%) E *
    Preferred regions 93.4
    Allowed regions 6.6
    Generously allowed regions 0
    Disallowed regions 0
WhatIf analysis F *
    1st generation packing 3.218 ± 1.105
    2nd generation packing 7.898 ± 2.540
    Ramachandran plot appearance 1.245 ± 0.578
    Chi-1/Chi-2 rotamer normality -3.492 ± 0.454
    Backbone conformation 2.384 ± 0.614

A 2412NOE cross peaks out of 2727 were assigned by CYANA. All numbers are given for the symmetric dimer.

B RMSD of the backbone coordinates to the mean structure.

C Analyzed by iCING. No distance/dihedral angle restraint was violated by more than 0.3 Å/5°, respectively, in any of the models.

D PDB validation and deposition server (ADIT).

E With Procheck.

F Structure Z-scores, a positive number is better than average.

* For residue 5–57 of the expression construct (RMSD < 2 Å).