6RCL
Crystal structure of REXO2-D199A-AA
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID29 |
| Synchrotron site | ESRF |
| Beamline | ID29 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2018-09-01 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.9762 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 35.613, 125.835, 167.910 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 41.980 - 1.970 |
| R-factor | 0.205 |
| Rwork | 0.203 |
| R-free | 0.25000 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.020 |
| Data reduction software | XDS |
| Data scaling software | Aimless (0.7.2) |
| Phasing software | PHASER |
| Refinement software | BUSTER (2.10.3) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 41.980 | 41.980 | 2.040 |
| High resolution limit [Å] | 1.970 | 7.630 | 1.970 |
| Rmerge | 0.076 | 0.040 | 1.890 |
| Rmeas | 0.082 | 0.043 | 2.022 |
| Rpim | 0.028 | 0.016 | 0.711 |
| Total number of observations | 221998 | 3744 | 20401 |
| Number of reflections | 27363 | 556 | 2609 |
| <I/σ(I)> | 13.4 | 37.7 | 1.1 |
| Completeness [%] | 100.0 | 99.6 | 100 |
| Redundancy | 8.1 | 6.7 | 7.8 |
| CC(1/2) | 0.999 | 0.998 | 0.671 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 298 | 100 mM Hepes pH 7.0, 200 mM sodium malonate, and 20 % polyethylene glycol 3350 |
