9KE1
Crystal structure of ScRhaGT in complex with TDP
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL02U1 |
| Synchrotron site | SSRF |
| Beamline | BL02U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2023-04-06 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.979 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 44.959, 110.572, 157.026 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 43.260 - 1.730 |
| R-factor | 0.18586 |
| Rwork | 0.183 |
| R-free | 0.23329 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.451 |
| Data reduction software | xia2 |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 43.260 | 1.760 |
| High resolution limit [Å] | 1.730 | 1.730 |
| Number of reflections | 82623 | 82623 |
| <I/σ(I)> | 8.4 | |
| Completeness [%] | 99.9 | |
| Redundancy | 11.9 | |
| CC(1/2) | 0.800 | 0.800 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 289 | 0.2 M Sodium malonate pH 5.0, 20% w/v Polyethylene glycol 3,350 |
