Table 1. Crystallographic statistics.

Values in parentheses are for the outer resolution shell (1.231.31 for crystal form I and 1.791.85 for crystal form II).

	Crystal form I					Crystal form II
Data set	Native†	Peak	Inflection	Low-energy remote	High-energy remote	Native (home source)
Space group	I222					C2
Subunits in ASU	1					4
Unit-cell parameters
a ()	37.93					117.70
b ()	62.60					43.12
c ()	67.05					65.55
()	90.0					90.0
()	90.0					96.43
()	90.0					90.0
Wavelength ()	0.9572	0.9802	0.9800	1.0037	0.9572	1.542
Resolution range ()	23.31.23	23.31.23	23.31.23	23.31.23	23.31.23	67.421.79
No. of reflections	317517	486815	215905	299934	317517	99562
Unique reflections	24103	22983	22523	21027	24103	30085
R merge ‡	0.049 (0.44)	0.056 (0.60)	0.054 (0.58)	0.045 (0.38)	0.065 (0.51)	0.052 (0.68)
I/(I)	8.1 (1.6)	6.7 (1.2)	7.5 (1.3)	8.0 (2.0)	6.8 (1.4)	26.0 (1.6)
Completeness (%)	95.3 (88.2)	96.5 (89.0)	95.7 (88.2)	96.1 (88.2)	95.3 (88.2)	98.9 (92.1)

^†Native data for crystal form I were taken from the high-energy remote data set, with anomalous signals merged.

^‡ R _merge = , where I(hkl) is the mean intensity of multiple I_i(hkl) observations of symmetry-related reflections.