5GIJ
Crystal structure of TDR-TDIF complex
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06SA |
| Synchrotron site | SLS |
| Beamline | X06SA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-03-13 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 1 |
| Spacegroup name | P 31 2 1 |
| Unit cell lengths | 132.921, 132.921, 229.842 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 57.556 - 3.000 |
| R-factor | 0.2181 |
| Rwork | 0.217 |
| R-free | 0.23720 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4mna |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.567 |
| Data scaling software | Aimless |
| Refinement software | PHENIX (1.10_2155) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 102.930 | 3.110 |
| High resolution limit [Å] | 3.000 | 3.000 |
| Rmerge | 0.152 | |
| Number of reflections | 47698 | |
| <I/σ(I)> | 8.8 | |
| Completeness [%] | 99.8 | |
| Redundancy | 9.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 293 | 4M sodium nitrate, 0.1M sodium acetate trihydrate, pH 4.8, 200mM ammonium sulfate |
