8DGE
BoGH13ASus from Bacteroides ovatus
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 21-ID-F |
| Synchrotron site | APS |
| Beamline | 21-ID-F |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2019-03-13 |
| Detector | RAYONIX MX-300 |
| Wavelength(s) | 0.97987 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 100.387, 148.443, 112.770 |
| Unit cell angles | 90.00, 91.00, 90.00 |
Refinement procedure
| Resolution | 62.000 - 1.890 |
| R-factor | 0.2122 |
| Rwork | 0.209 |
| R-free | 0.27080 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3m07 |
| RMSD bond length | 0.004 |
| RMSD bond angle | 1.290 |
| Data reduction software | xia2 |
| Data scaling software | xia2 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 62.000 | 1.960 |
| High resolution limit [Å] | 1.890 | 1.890 |
| Rmerge | 0.095 | 0.954 |
| Number of reflections | 262849 | 25868 |
| <I/σ(I)> | 8.8 | |
| Completeness [%] | 99.7 | |
| Redundancy | 5 | |
| CC(1/2) | 0.997 | 0.688 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 11% MPD, 11% PEG1000, 11% PEG3350, 0.1 M MES/Imidazole pH 6.5, 0.12M ethylene glycol mix |
