Table 2

Crystal data of Arx1 from C. thermophilum
Data collection
    Space group P21212
    Unit cell parameters (Å) 192.0, 193.3, 70.9
    (°) 90, 90, 90
    Resolution (Å) 86.4 – 2.3 (2.42 – 2.3)
    RMergea 0.127 (0.53)
    Unique reflections 118103 (17031)
    Completeness (%) 100 (100)
    Multiplicity 5.9 (5.9)
    <I/σI> 13.7 (4.0)
Refinement
    Number of used reflections 112170
    Resolution limits (Å) 57.0 -2.3
    R factor b (%) 20.2
    Free R factor c (%) 24.2
    Rmsd bond lengths (Å) 0.016
    Rmsd bond angles (°) 1.535

a. Rmerge = ΣhΣj|Ihj - <Ih>|/ΣhΣj, where Ihj is the intensity of the jth observation of the unique reflection h.

b. R factor = Σh||Foh| - |Fch||/Σh|Foh|, where Foh and Fch are the observed and calculated structure factor amplitudes for reflection h.

c. The free R factor is equivalent to the R factor, but is calculated using 5% of reflections excluded from the maximum-likelihood refinement stages.

van Noort et al.

van Noort et al. BMC Evolutionary Biology 2013 13:7   doi:10.1186/1471-2148-13-7

Open Data