Table 2.

Data Collection and Partial Refinement for Crystal-form II

Data
Space Group	P6
Unit Cell	a=218.9 b=218.9 c=68.95 α=90 β=90γ=120
Wavelength (Å)	0.9796
Resolution (Å)	50 – 3.4
Unique Reflections	50,668
Redundancy	2.3 (2.3)
Completeness (%)	99.7 (99.8)
I/σ	8.3 (2.5)
Rmerge	0.104 (0.348)
Refinement
Rwork (%)	33.5a
Rfree (%)	35.7b
RMSD bonds (Å)	0.010
RMSD angles (°)	1.174
Ramachandran
Preferred (%)	99.0
Allowed (%)	1.0
Outliers (%)	0
Number of Atoms	9,936
Protein	9,840
Ligands	96

Values in parenthesis correspond to the highest resolution bin

^aR_work = ΣΣ|F_o−F_c|/ΣF_o

^bR_free is calculated using 5% of the data omitted from refinement