5U8Y
Crystal structure of Co-CAO1
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 24-ID-C |
| Synchrotron site | APS |
| Beamline | 24-ID-C |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2016-08-01 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.97919 |
| Spacegroup name | P 32 2 1 |
| Unit cell lengths | 100.440, 100.440, 447.977 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 49.000 - 2.500 |
| R-factor | 0.18656 |
| Rwork | 0.185 |
| R-free | 0.22257 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5u8x |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.507 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | REFMAC |
| Refinement software | REFMAC (5.8.0155) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 49.000 | 2.650 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rmerge | 0.281 | 2.930 |
| Number of reflections | 91967 | |
| <I/σ(I)> | 7.76 | 0.92 |
| Completeness [%] | 99.5 | 99 |
| Redundancy | 4.3 | 4.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 281 | sodium polyacrylat/HEPES pH 6.5 |
