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. 2022 Jul 30;5:769. doi: 10.1038/s42003-022-03745-7

Table 1.

X-ray data collection and refinement statistics.

X-ray data Refinement
Space group P65 Resolution (Å) 51.45–3.00
Cell dimensions Reflections (work/free) 13678/716
a = b, c (Å) 118.8 89.5 Rwork/Rfree 22.0/23.9
α = β, γ (°) 90 120 Number of atoms 3114
Resolution (Å)a 67.54–3.0 (3.18–3.0) Protein 2151
best in h k plane 3.14 DNA 943
best along l axis 3.00 [4Fe-4S] cluster 16
Rsym (%) 5.9 (194.5) Water 4
Mean(I/σ(I)) 12.6 (1.0) Average B factors (Å2)
CC(1/2) 0.999 (0.516) Protein 134.2
Completeness (%) 99.8 (100.0) DNA 181.4
Redundancy 6.3 (6.7) [4Fe-4S] cluster 110.7
Water 118.1
R.m.s. deviations
Bond lengths (Å) 0.003
Bond angles (°) 0.70

aValues within parentheses denote the highest resolution shell.