Table 1. Data Collection and Refinement Statistics for the Crystal Structure of WT XlnB2 from S. lividans 66a.
Data Collectionb | |
space group | P21 |
cell dimensions | |
a, b, c (Å) | 41.0, 66.9, 65.4 |
β (deg) | 94.1 |
resolution (Å) | 46.7–1.3 (1.44–1.3) |
Rsym | 6.7 (55.2) |
I/σI | 12.2 (2.6) |
completeness (%) | 97.5 (96.4) |
redundancy | 4.2 (4.2) |
Refinement | |
resolution (Å) | 46.7–1.3 |
no. of reflections | 81872 |
Rwork,Rfree | 12.9–16.6 |
no. of atoms | |
XlnB2 | 3055 |
water | 410 |
B factor (Å2) | |
XlnB2 | 15.5 |
water | 31.8 |
rmsd | |
bond lengths (Å) | 0.014 |
bond angles (deg) | 1.42 |
Molprobity score | 0.98 |
Ramachandran plot (%) | |
outliers | 0 |
favored | 98 |
The data set has been collected on a single crystal.
Data for the highest-resolution shell are given in parentheses.