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. 2024 Jun 10;55:110604. doi: 10.1016/j.dib.2024.110604

Table 2.

Data collection statistics. Processing statistics have been presented elsewhere [1].

Data collection Glucose isomerase Lysozyme
X-ray Source 1C, PLS-II 1C, PLS-II
X-ray energy (eV) 14820 14820
X-ray exposure (ms) 100 100
Collected images 20,210 18,959
Hit images 13,592 9535
Indexed patterns 17,626 3485
Space group I222 P43212
Cell dimension (Å) a, b, c
94.14, 99.94, 103.16

78.83, 78.83, 38.20
Resolution (Å) 20.00–1.70 (1.76–1.70) 20.00–2.20 (2.27–2.20)
Unique reflections 53,508 (5307) 6509 (628)
Completeness (%) 100.0 (100.0) 100.0 (100.0)
Redundancy 191.5 (256.9) 488.7 (398.5)
SNR 4.67 (4.39) 5.43 (3.74)
CC 0.8239 (0.3692) 0.8737 (0.5245)
CC* 0.9505 (0.7343) 0.9657 (0.8295)
Rsplit (%) a 25.98 (27.16) 21.21 (33.46)
Wilson B factor (Å2) 11.97 23.92

Values for the outer shell are given in parentheses.

a

Rsplit = (1/2)·hkl|IhklevenIhklodd|12|IhklevenIhklodd|, bRwork = Σ||Fobs|-|Fcalc||/Σ|Fobs|, where Fobs and Fcalc are the observed and calculated structure-factor amplitudes respectively.