5O62
The structure of the thermobifida fusca guanidine III riboswitch with 1-Ethylguanidine.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-05-14 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.91972 |
| Spacegroup name | P 31 2 1 |
| Unit cell lengths | 84.016, 84.016, 67.445 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 36.380 - 2.119 |
| R-factor | 0.2102 |
| Rwork | 0.208 |
| R-free | 0.25540 |
| Structure solution method | SAD |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.730 |
| Data reduction software | xia2 |
| Data scaling software | xia2 |
| Phasing software | PHENIX |
| Refinement software | PHENIX ((dev_2219: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 49.460 | 2.160 |
| High resolution limit [Å] | 2.119 | 2.119 |
| Rmerge | 0.120 | 2.877 |
| Rpim | 0.026 | 0.868 |
| Number of reflections | 29951 | 813 |
| <I/σ(I)> | 16 | 1.3 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 21.25 | 21.9 |
| CC(1/2) | 1.000 | 0.494 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.6 | 293 | 0.1 M Magnesium acetate, 0.05 M MES pH 5.6, 20% v/v 2-Methyl-2,4-pentanediol |
