8RWF
Domains 1 and 2 of Bacillus anthracis Sap S-layer in complex with Nb692
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04 |
| Synchrotron site | Diamond |
| Beamline | I04 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2022-01-26 |
| Detector | DECTRIS EIGER2 XE 16M |
| Wavelength(s) | 0.9179 |
| Spacegroup name | P 43 21 2 |
| Unit cell lengths | 213.264, 213.264, 53.267 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 106.630 - 3.110 |
| R-factor | 0.2239 |
| Rwork | 0.221 |
| R-free | 0.28460 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.171 |
| Data reduction software | XDS |
| Data scaling software | autoPROC |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.21_5207) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 106.630 | 3.220 |
| High resolution limit [Å] | 3.110 | 3.220 |
| Rpim | 0.265 | 1.080 |
| Number of reflections | 22681 | 2213 |
| <I/σ(I)> | 4.5 | |
| Completeness [%] | 99.9 | |
| Redundancy | 26.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 294 | 0.2 M Ammonium chloride, 0.1 M Hepes (pH 7.5) and 25% v/v Glycerol ethoxylate |
