8RW9
Domains 1 and 2 of Bacillus anthracis Sap S-layer in complex with Nb694
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SOLEIL BEAMLINE PROXIMA 2 |
| Synchrotron site | SOLEIL |
| Beamline | PROXIMA 2 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-12-16 |
| Detector | DECTRIS EIGER X 9M |
| Wavelength(s) | 0.9786 |
| Spacegroup name | P 1 |
| Unit cell lengths | 33.410, 113.970, 122.700 |
| Unit cell angles | 90.71, 96.01, 97.05 |
Refinement procedure
| Resolution | 42.000 - 1.990 |
| R-factor | 0.2112 |
| Rwork | 0.209 |
| R-free | 0.24920 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.046 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.21_5207) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 42.000 | 42.000 |
| High resolution limit [Å] | 1.990 | 1.990 |
| Rpim | 0.030 | 1.530 |
| Number of reflections | 118902 | 10826 |
| <I/σ(I)> | 9.5 | |
| Completeness [%] | 97.5 | |
| Redundancy | 3.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293.15 | 0.2 M Ammonium chloride, 0.1 M Hepes (pH 7.5) and 25% v/v Glycerol ethoxylate |
