Table 1.
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.
Ramachandran analysis performed as described31.