Table 2 Crystallographic data collection and refinement statistics
Crystal | CBC ΔNLS | CBC ΔNLS |
|---|---|---|
m7GTP | m7GTP | |
NELF-E360–380 | ARS2827–871 | |
Diffraction data | ||
Beamline | ID30A1 | ID23-1 |
Wavelength (Å) | 0.966 | 0.97917 |
Space group | P21 | P1 |
Cell dimensions (Å) | a = 113.8 b = 147.2 c = 153.9 α = γ = 90° β = 91.48° | a = 70.52 b = 112.99 c = 270.98 α = γ = 90° β = 90.30° |
Resolution range of data (last shell) (Å) | 50.0–2.79 (2.87–2.79) | 50.0–2.80 (2.91–2.80) |
Completeness (last shell) (%) | 98.4 (91.6) | 97.5 (96.3) |
R-sym (last shell) (%) | 10.8 (129.2) | 9.7 (69.7) |
I/σI (last shell) | 9.2 (0.91) | 6.63 (1.20) |
CC(1/2) (last shell) | 0.995 (0.363) | 0.995 (0.585) |
Redundancy (last shell) | 2.71 (2.70) | 2.08 (2.00) |
Refinement | ||
Reflections used in refinement work (free) | 117,089 (6345) | 190,778 (10,059) |
R-work (last shell) | 0.202 (0.389) | 0.231 (0.386) |
R-free (last shell) | 0.229 (0.394) | 0.268 (0.378) |
Number of non-hydrogen atoms | 29,296 | 58,750 |
Protein | 28,756 (4x CBC) | 57,548 (8x CBC) |
Ligand | 132 (4x m7GTP) | 264 (8x m7GTP) |
Peptide | 408 (chains E, K, Z) | 938 (chains C, F, I, L, O, R, U, X) |
Geometry and B-factors | ||
RMSD (bonds) (Å) | 0.009 | 0.008 |
RMSD (angles) (°) | 1.312 | 1.194 |
Ramachandran favoured (%) | 97.0 | 97.9 |
Ramachandran outliers (%) | 0.2 | 0.03 |
Clash score | 1.03 | 0.86 |
MolProbity score | 1.17 | 0.88 |
Average B-factor | 74.4 | 73.3 |
Protein | 74.2 (4× CBC) | 72.8 (8×CBC) |
Ligand | 70.7 (4× m7GTP) | 66.3 (8× m7GTP) |
Peptide | 111.5 (chains E, K, Z) | 106.1 (chains C, F, I, L, O, R, U, X) |
