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. 2004 Apr 12;101(16):5910–5915. doi: 10.1073/pnas.0400891101

Table 1. Summary of crystallographic information.

Haloxyfop complex Diclofop complex Free enzyme L17051/V19671
Maximum resolution, Å 2.8 2.5 2.5 2.6
No. of observations 285,486 584,662 420,147 315,564
Rmerge,* % 9.3 (28.8) 7.6 (31.7) 6.9 (31.4) 5.0 (25.6)
Resolution range for refinement 27-2.8 30-2.5 27-2.5 28-2.6
No. of reflections 96,167 88,661 130,501 117,132
Completeness, % 88 (74) 96 (89) 86 (64) 87 (69)
R factor, % 21.8 (27.9) 21.7 (26.1) 21.9 (26.7) 21.2 (27.0)
Free R factor, % rms deviation 25.2 (30.9) 24.8 (29.5) 25.0 (29.0) 23.7 (28.9)
    Bond lengths, Å 0.009 0.007 0.007 0.007
    Bond angles, ° 1.2 1.2 1.2 1.1
*

Rmerge = Σh Σt|Ihi — <Ih>|/Σh Σt Ihi. The numbers in parentheses are for the highest-resolution shell.

R = Σh|FhoFhc|/ΣhFho.