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. Author manuscript; available in PMC: 2009 Dec 11.
Published in final edited form as: J Struct Biol. 2004 Oct;148(1):98–109. doi: 10.1016/j.jsb.2004.04.006

Table 1.

Basic data collection and processing statistics for YckF crystals

Number of amino acid residues/methionines 185/9
Number of molecules in the asymmetric unit 2
Crystal lattice
Native P6522 a = b = 72.08, c = 245.56Å α = β = 90° γ = 120°
Se-Met P6522 a = b = 72.48, c = 244.87Å α = β = 90° γ = 120°
Crystal 1 (Se-Met)
Crystal 2 (native)
Inflection point Peak Remote Low resolution High resolution


Energy (keV) 12.65835a 12.65977a 13.000 13.100 13.100
Wavelength (Å) 0.97947 0.97936 0.95373 0.94644 0.94644
Resolution (Å) 50–2.5 50–2.61 50–2.6 50–3.2 4–1.95
No. of observations 559 946 46 1026 501 104 64 730 262 698
Uniqueb reflections 24913 22082 22 153 6880 25 054
Completeness (%)c 99.9 (100) 99.9 (100) 99.9 (100) 99.9 (100) 99.9 (100)
I/σ(I)c 50.8 (8.3) 45.7 (7.7) 48.1 (6.3) 50.5 (22.1) 31.6 (5.3)
Rsymc 0.068 (0.513) 0.074 (0.483) 0.082 (0.654) 0.039 (0.098) 0.072 (0.468)
Rmerge between low- and high-resolution passes on native crystals 0.035
a

Energy deviation from usual values of Se absorption edge reflect calibration of the monochromator at the time of the experiment.

b

Bijvoet pairs for scaling the MAD data sets were kept separately.

c

In the last resolution shell.