6KBC
Crystal structure of CghA with Sch210972
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE BL-17A |
| Synchrotron site | Photon Factory |
| Beamline | BL-17A |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-12-16 |
| Detector | DECTRIS PILATUS3 S 6M |
| Wavelength(s) | 0.98000 |
| Spacegroup name | P 43 21 2 |
| Unit cell lengths | 75.247, 75.247, 189.586 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 19.820 - 1.990 |
| R-factor | 0.185 |
| Rwork | 0.184 |
| R-free | 0.20870 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6kaw |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.232 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.18.2_3874) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 2.100 |
| High resolution limit [Å] | 1.990 | 1.990 |
| Rmerge | 0.071 | 0.281 |
| Number of reflections | 38280 | 5979 |
| <I/σ(I)> | 23.99 | |
| Completeness [%] | 99.7 | |
| Redundancy | 12.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | PEG 4000, MES pH 6.5 |
