Table 1.

Crystallographic Data Collection and Refinement

Data Collection	Shrub (MR-SAD)
Space group	P4(3)
Cell dimensions
a, b, c (Å)	29.77, 29.77, 174.31
α, β, γ (°)	90, 90, 90
Wavelength	0.9792
Resolution (Å)	50–2.76 (2.91–2.76)
Rmerge	0.09 (1.09)
I/σI	15.9 (1.5)
Completeness (%)	98.1 (99.4)
Redundancy	3.6 (3.7)
Wilson B-factor	84.9
Refinement
Resolution (Å)	43.58–2.76
No. reflections	3,792
Rwork/Rfree	0.216/0.269
No. atoms
Protein	890
B-factors
Protein	94.87
RMSD
Bond lengths (Å)	0.002
Bond angles (°)	0.504
Ramachandran (%)
Favored	98.2
Allowed	1.8
Outlier	0
Rotamer outliers (%)	4.1
Clashscore	1.1