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. 2015 Sep 26;71(Pt 10):2009–2020. doi: 10.1107/S1399004715015205

Table 3. X-ray crystallographic data-collection and refinement statistics.

Values in parentheses are for the highest resolution bin.

Data collection
Space group P63
Unit-cell parameters (, ) a = b = 90.69, c = 74.71, = = 90, = 120
Resolution range () 38.81.73 (1.771.73)
Unique reflections 36195 (1895)
Completeness (%) 99.7 (95.0)
I/(I) 20.7 (1.8)
Wilson B factor (2) 26.5
Multiplicity 4.7 (2.8)
R merge 0.037 (0.461)
Refinement
PDB code 5d7z
Resolution () 1.73
R cryst (%) 16.8
R free (%) 20.1
No. of atoms
Protein 2211
Solvent 146
Ligands 42
Mean B factor (2) 29.8
R.m.s.d., bond lengths () 0.021
R.m.s.d., angles () 2.026

The working and free sets contained 34334 and 1843 reflections, respectively, i.e. R free was calculated using 5.1% of the reflections.