5OCD
structure of a CDPS from Fluoribacter dumoffii
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SOLEIL BEAMLINE PROXIMA 1 |
| Synchrotron site | SOLEIL |
| Beamline | PROXIMA 1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2016-09-16 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.978570 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 185.031, 97.800, 211.282 |
| Unit cell angles | 90.00, 115.58, 90.00 |
Refinement procedure
| Resolution | 48.160 - 3.060 |
| R-factor | 0.212 |
| Rwork | 0.210 |
| R-free | 0.24900 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5mlq |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.120 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | BUSTER (2.10.3) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 190.600 | 3.240 |
| High resolution limit [Å] | 3.058 | 3.060 |
| Number of reflections | 64644 | 10162 |
| <I/σ(I)> | 12.65 | 2.48 |
| Completeness [%] | 99.0 | 97.8 |
| Redundancy | 3.7 | 3.74 |
| CC(1/2) | 0.998 | 0.954 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | EVAPORATION | 7.5 | 278 | 11% PEG3350, 0.1M Hepes pH7.5, L-proline 0.2M |
