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. 2012 Nov;80(11):4004–4013. doi: 10.1128/IAI.00764-12

Table 1.

Data collection and refinement statistics parameters

Parameter Value(s) fora:
SSL4 sLex complex
Crystal data
    Space group C2 I222
Cell
    Axial lengths (Å) 96.1, 81.2, 57.3 61.9, 78.9, 97.7
    Angles (°) 90.00, 105.45, 90.00 90.00, 90.00, 90.00
Data collection
    Resolution range (Å) 27.62–1.70 (1.79–1.70) 24.42–2.50 (2.64–2.5)
    Data collection temp (K) 113 113
    No. of unique reflections 46,435 8,563
    Completeness (%) 99.7 (99.3) 99.9 (100.00)
    Mosaicity (°) 1.02 0.214
    Rmerge (%) 0.058 (0.698) 16.9 (74.7)
    Ia 17.4 (2.4) 12.0 (3.1)
Refinement
    Resolution range (Å) 27.62–1.70 24.42–2.50
    R/Rfree 0.2086/0.2614 0.1847/0.2543
    Mean B-value (Å2) 29.7 25.6
RMSD from standard values
    Bond lengths (Å) 0.025 0.017
    Bond angles (°) 2.1 1.8
Ramachandran plot
    % of residues in favored regions 97.1 95.3
    Outliers None None
a

Throughout, values in parentheses are for the outermost resolution shell.