4UOS
Thermodynamic hyperstability in parametrically designed helical bundles
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I24 |
| Synchrotron site | Diamond |
| Beamline | I24 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2014-05-26 |
| Detector | DECTRIS PILATUS 6M |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 29.460, 72.150, 51.260 |
| Unit cell angles | 90.00, 92.90, 90.00 |
Refinement procedure
| Resolution | 23.596 - 1.630 |
| R-factor | 0.1938 |
| Rwork | 0.193 |
| R-free | 0.20640 |
| Structure solution method | AB INITIO PHASING |
| Starting model (for MR) | NONE |
| RMSD bond length | 0.028 |
| RMSD bond angle | 1.892 |
| Data reduction software | iMOSFLM |
| Data scaling software | Aimless |
| Phasing software | ACORN |
| Refinement software | PHENIX ((PHENIX.REFINE: 1.8_1069)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.700 | 1.680 |
| High resolution limit [Å] | 1.630 | 1.630 |
| Rmerge | 0.050 | 0.260 |
| Number of reflections | 28658 | |
| <I/σ(I)> | 9.6 | 2.8 |
| Completeness [%] | 97.8 | 99.6 |
| Redundancy | 3.5 | 3.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7.4 | 0.2 M AMMONIUM SULFATE, 10% W/V PEG 4000, pH 7.4 |
