MA6 Fab + NPNA3 data collection and refinement statistics
| PDB ID . | 9CR9 . |
|---|---|
| Data collection | |
| Wavelength (Å) | 0.9795 |
| Resolution range | 47.72–1.8 (1.864–1.8) |
| Space group | P 1 21 1 |
| Unit cell dimensions | |
| a, b, c (Å) | 46.6, 61.0, 153.0 |
| α, β, γ (°) | 90, 90, 90 |
| Total reflections | 137,629 (13,558) |
| Unique reflections | 74,608 (7,426) |
| Multiplicity | 1.8 (1.8) |
| Completeness (%) | 93.3 (93.1) |
| I/σI | 5.93 (2.14) |
| Wilson B-factor | 17.1 |
| Rmerge | 0.077 (0.4335) |
| CC1/2 | 0.941 (0.626) |
| Refinement | |
| Unique reflections | 74,522 (7,401) |
| Rwork | 0.1853 (0.2749) |
| Rfree | 0.2153 (0.3039) |
| Number of non-hydrogen atoms | 7,814 |
| Macromolecules | 6,652 |
| Ligands | 0 |
| Solvent | 1,162 |
| Protein residues | 872 |
| RMSD bond lengths (Å) | 0.008 |
| RMSD bond angles (°) | 0.96 |
| Ramachandran favored (%) | 98.36 |
| Ramachandran allowed (%) | 1.64 |
| Ramachandran outliers (%) | 0.00 |
| Rotamer outliers (%) | 0.00 |
| Clashscore | 4.05 |
| Average B-factor (Å2) | 23.9 |
| Macromolecules | 22.1 |
| Solvent | 34.1 |
| PDB ID . | 9CR9 . |
|---|---|
| Data collection | |
| Wavelength (Å) | 0.9795 |
| Resolution range | 47.72–1.8 (1.864–1.8) |
| Space group | P 1 21 1 |
| Unit cell dimensions | |
| a, b, c (Å) | 46.6, 61.0, 153.0 |
| α, β, γ (°) | 90, 90, 90 |
| Total reflections | 137,629 (13,558) |
| Unique reflections | 74,608 (7,426) |
| Multiplicity | 1.8 (1.8) |
| Completeness (%) | 93.3 (93.1) |
| I/σI | 5.93 (2.14) |
| Wilson B-factor | 17.1 |
| Rmerge | 0.077 (0.4335) |
| CC1/2 | 0.941 (0.626) |
| Refinement | |
| Unique reflections | 74,522 (7,401) |
| Rwork | 0.1853 (0.2749) |
| Rfree | 0.2153 (0.3039) |
| Number of non-hydrogen atoms | 7,814 |
| Macromolecules | 6,652 |
| Ligands | 0 |
| Solvent | 1,162 |
| Protein residues | 872 |
| RMSD bond lengths (Å) | 0.008 |
| RMSD bond angles (°) | 0.96 |
| Ramachandran favored (%) | 98.36 |
| Ramachandran allowed (%) | 1.64 |
| Ramachandran outliers (%) | 0.00 |
| Rotamer outliers (%) | 0.00 |
| Clashscore | 4.05 |
| Average B-factor (Å2) | 23.9 |
| Macromolecules | 22.1 |
| Solvent | 34.1 |
Statistics for the highest resolution shell are shown in parentheses. PDB, Protein Data Bank.