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. 2014 Jan 17;289(12):8029–8040. doi: 10.1074/jbc.M113.515361

TABLE 2.

Summary of crystallographic refinement statistics

Model
    M11 residues (monomer A) 135
    M11 residues (monomer B) 136
    Beclin 1 DS peptide (chain C) 20
    Beclin 1 DS peptide (chain D) 22
    Water molecules 133
    Sulfate molecules 4

Data range (Å) 50–2.1
    Rwork (%)a 16.0
    Rfree (%)a 22.4

Average B-values (Å2) 34.7
    Main chain 26.7
    Side chain 28.7
    Water 48.0
    All atoms 34.7

B-factor RMSDs between bonded atoms
    Main chain 2.332
    Side chain 4.026

RMSDs from target values
    Bond lengths (Å) 0.020
    Bond angles (°) 1.985
    Dihedral angles (°) 21.33
    Improper angles (°) 1.91

Cross-validated sigma coordinate error (Å) 0.24
Ramachandran outliers 0

a R factor = Σh, |Fobs − |Fcalc|/Σh|Fobs|. Test set for Rfree consisted of 5.5% of data.