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. 2017 May 5;4(Pt 4):400–410. doi: 10.1107/S2052252517005140

Values in parentheses are for the outer shell.

Parameter HEWL–NaCMC HEWL–grease GI–F-127 GI–grease TRL–NACMC
Nozzle diameter (µm) 150 100 100 100 150
SLS beamline PXII PXII PXII PXII PXII
Wavelength (Å) 1.033 0.954 1.033 1.033 1.033
Space group P43212 P43212 I222 I222 P6122
Unit-cell parameters, a, b, c (Å) 79.0, 79.0, 38.1 79.0, 79.0, 38.1 93.0, 98.6, 101.8 93.0, 98.7, 101.9 93.0, 93.0, 130.0
α, β, γ (°) 90, 90, 90 90, 90, 90 90, 90, 90 90, 90, 90 90, 90, 120
No. collected images 26310 23818 24412 28084 62926
Hit rate (%) 36 91 86 57 91
No. crystal hits/indexed images 9472/5362 21715/5348 20961/8603 16122/8593 57226/4556
Indexing rate§ (%) 57 25 41 57 8
Resolution range 25.0–1.9 25.0–1.9 25.0–2.0 25.0–2.0 25.0–2.3
Completeness (%) 99.9 (100) 99.9 (100) 99.9 (100) 99.9 (100) 99.9 (100)
Multiplicity 328.5 (262.3) 252.2 (180.7) 197.1 (119.5) 185.8 (112.8) 570.4 (470.3)
I/σ(I) 11.0 (5.1) 9.5 (8.6) 5.3 (1.7) 5.1 (2.6) 10.0 (2.2)
R mrgd-F 18.3 (47.7) 15.1 (17.3) 31.5 (123.9) 27.2 (70.2) 23.6 (104.7)
CC1/2 94.4 (84.8) 87.7 (89.9) 90.8 (48.2) 81.2 (50.9) 96.9 (74.9)
Overall Wilson B factor (Å2) 29.9 20.2 28.1 22.4 40.3