8R5S
t113 - De-novo designed soluble homotetramer
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PETRA III, DESY BEAMLINE P11 |
| Synchrotron site | PETRA III, DESY |
| Beamline | P11 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2022-12-16 |
| Detector | DECTRIS EIGER2 X 16M |
| Wavelength(s) | 1.03322 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 60.711, 212.171, 72.289 |
| Unit cell angles | 90.00, 102.59, 90.00 |
Refinement procedure
| Resolution | 46.110 - 3.010 |
| R-factor | 0.2011 |
| Rwork | 0.199 |
| R-free | 0.24480 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.370 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 46.110 | 3.118 |
| High resolution limit [Å] | 3.010 | 3.010 |
| Rmerge | 0.200 | 1.800 |
| Number of reflections | 32493 | 2503 |
| <I/σ(I)> | 3.76 | |
| Completeness [%] | 89.0 | 71.47 |
| Redundancy | 5.1 | |
| CC(1/2) | 0.993 | 0.346 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 294 | 200 mM Ammonium formate, 10.5% PEG 3350, drop ratio 2:3 (condtion:protein), protein concentration 10 mg/mL |
