4UOT
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 | 2014-05-29 |
Detector | DECTRIS PILATUS 6M |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 55.400, 88.020, 103.710 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 24.433 - 1.690 |
R-factor | 0.1785 |
Rwork | 0.178 |
R-free | 0.18450 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | ROSETTA MODEL |
RMSD bond length | 0.024 |
RMSD bond angle | 1.769 |
Data reduction software | iMOSFLM |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 35.000 | 1.730 |
High resolution limit [Å] | 1.690 | 1.690 |
Rmerge | 0.050 | 0.620 |
Number of reflections | 11034 | |
<I/σ(I)> | 16.5 | 2.3 |
Completeness [%] | 99.6 | 99.9 |
Redundancy | 5.3 | 5.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 5.6 | 0.2 M AMMONIUM SULFATE, 0.1 M SODIUM CITRATE PH 5.6 AND 25 % W/V PEG4000 |