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. Author manuscript; available in PMC: 2010 Jul 17.
Published in final edited form as: J Mol Biol. 2009 May 6;390(3):457–466. doi: 10.1016/j.jmb.2009.04.074

Table 1.

Data collection and refinement statistics

Data collection MOA in complex with Galα (1,3)[Fucα (1,2)]Gal
Space group P3
Cell parameters
 a, b, c (Å) 121.3, 121.3, 100.0
 α β γ (°) 90, 90, 120
Wavelength (Å) 0.934
Resolution (Å) 47-1.8 (1.9-1.8)
Rmerge (%) 10.9 (47.1)
I / σI 12.5 (3.3)
Completeness (%) 99.2 (98.2)
Multiplicity 8.8 (5.1)
Refinement
Resolution (Å) 30-1.8
No. unique reflections 143810
Rwork / Rfree (%) 16.4/18.9
R.m.s deviations from ideal values30
 Bond lengths (Å) 0.012
 Bond angles (Å) 1.41
Average/Wilson B-factor (Å2) 11.8/13.5
Real space correlation coefficient 0.95
Ramachandran outliers (%)1 2.5
PDBid 3EF2

Values for the highest resolution shell are shown in parenthesis.

1

Ramachandran analysis performed as described31.