. 2014 Jun 21;33(16):1831–1844. doi: 10.15252/embj.201387557

Table 1.

Statistics for the X-ray diffraction analyses

	L-IMH	L-BH	BVH	D/L-NMH
Beamline	Diamond I02	Diamond I03	Diamond I03	Diamond I04
Wavelength (Å)	0.9795	0.97630	0.91910	0.9795
Resolution (Å)^a	3.4 (3.49-3.4)	3.8 (3.87-3.8)	3.7 (3.76-3.7)	3.7 (3.8-3.7)
Space group	P2₁2₁2₁	P2₁2₁2₁	P2₁2₁2₁	P2₁2₁2₁
Cell dimensions (Å)	87.4 106.4 100.6	95.6 106.7 107.9	90.0 107.3 109.3	87.6 106.9 106.8
No. measured reflections	49,523	47,500	52,691	35,592
No. unique reflections	12,215	10,629	11,569	10,714
Completeness (%)	92 (87)	97 (96)	98 (98)	96 (96)
Redundancy	4.1 (3.8)	4.5 (3.8)	4.6 (3.7)	3.3 (2.8)
I/σ(I)	13.2 (1.2)	12.4(1.7)	15(2.0)	8.3(2.0)
R_merge	0.054 (0.882)	0.097 (0.698)	0.066 (0.533)	0.063 (0.686)
CC(1/2) highest resolution shell	0.72	0.83	0.77	0.7
CC(1/2)^b < 0.5: a^; b^; c^* (Å)	3.9; max; 3.7	5.6; max; 5.3	4.4; max; 5.1	4.7; max; 5.1
R_factor(%)	24.8	28.4	25.7	25.6
R_free^c (%)	28.3	30.8	28.8	30.8
rms deviations from ideal values
Bonds (Å)	0.007	0.007	0.005	0.008
Angle (°)	1.2	1.0	1.1	1.3
Ramachandran outliers (%)^d	0.7	0.2	0.4	0.7

Values in parentheses refer to data in the highest resolution shell.

this is the CC(1/2) where the resolution drops below 0.5 as reported by aimless (Evans & Murshudov, 2013).

5% of test reflections.

as defined in MolProbity (Chen et al, 2010).