Skip to main content
. 2003 Jun 10;100(13):7497–7502. doi: 10.1073/pnas.0932597100

Table 2. Refinement statistics.

Resolution range of the reflection used 50-1.20 Å
No. of reflections used 117,875
No. of least squares parameters 41,196
Observations/parameters 2.86
Solvent content fraction 0.359
Vm 1.92 Å3/Da
No. of protein residues 433
Occupancy sum of non-H atoms 4,230.30
No. of water molecules 533
Average temperature factors
    Protein main chain 16.65 Å2
    Solvent and side chains 24.44 Å2
R factor 16.34%
Goodness of fit (SHELX) 2.085
Restrained goodness of fit 1.737
Protein stereochemistry
    rms bond lengths 0.014 Å
    rms angle 2.715
    rms ΔBiso bonded 2.92
Overall average G factor (PROCHECK) -0.10