5JJP
Crystal structure of CmiS6
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE BL-5A |
| Synchrotron site | Photon Factory |
| Beamline | BL-5A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2014-12-21 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 84.290, 109.210, 198.450 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 55.430 - 2.300 |
| R-factor | 0.20828 |
| Rwork | 0.206 |
| R-free | 0.24368 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3wv4 |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.586 |
| Data reduction software | iMOSFLM (1.0.7) |
| Data scaling software | SCALA (3.3.20) |
| Phasing software | MOLREP (11.0.05) |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 56.450 | 2.420 |
| High resolution limit [Å] | 2.300 | 2.300 |
| Rmerge | 0.164 | 0.666 |
| Number of reflections | 81297 | |
| <I/σ(I)> | 8.8 | 3 |
| Completeness [%] | 99.1 | 98.9 |
| Redundancy | 6.6 | 6.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 278 | PEG20000, MES, magnesium chloride |
