3ZXN
Moorella thermoacetica RsbS S58E
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I02 |
Synchrotron site | Diamond |
Beamline | I02 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-05-30 |
Detector | ADSC CCD |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 49.940, 60.820, 88.910 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 29.144 - 1.900 |
R-factor | 0.1942 |
Rwork | 0.192 |
R-free | 0.24040 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2vy9 |
RMSD bond length | 0.008 |
RMSD bond angle | 1.032 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 49.940 | 2.000 |
High resolution limit [Å] | 1.900 | 1.900 |
Rmerge | 0.060 | 0.370 |
Number of reflections | 21867 | |
<I/σ(I)> | 12.2 | 2.8 |
Completeness [%] | 99.4 | 99.9 |
Redundancy | 3.6 | 3.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7 | 0.1 M HEPES PH7, 8% (W/V) PEG 8000, 0.1 M SODIUM THIOCYANATE |