5N8P
S-layer protein RsaA from C. crescentus
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 | 2016-06-29 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.97948 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 215.880, 74.960, 221.660 |
| Unit cell angles | 90.00, 118.99, 90.00 |
Refinement procedure
| Resolution | 50.000 - 2.700 |
| R-factor | 0.2589 |
| Rwork | 0.258 |
| R-free | 0.27583 |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.859 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0155) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.850 |
| High resolution limit [Å] | 2.700 | 2.700 |
| Rmerge | 0.181 | 1.315 |
| Rpim | 0.122 | 0.890 |
| Number of reflections | 160466 | 23593 |
| <I/σ(I)> | 5.5 | 1 |
| Completeness [%] | 98.4 | 98.3 |
| Redundancy | 3.1 | 3.1 |
| CC(1/2) | 0.990 | 0.565 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 293 | 0.07 M KSCN, 24 % 318 (w/v) PEG 8000, 0.075 M TAPS pH 8.5 |
