8B3Z
SigE N-terminal Domain
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I03 |
Synchrotron site | Diamond |
Beamline | I03 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-10-08 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.9795 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 81.953, 165.143, 98.930 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 63.390 - 2.380 |
R-factor | 0.2009 |
Rwork | 0.198 |
R-free | 0.25560 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3ugo |
RMSD bond length | 0.004 |
RMSD bond angle | 0.571 |
Data reduction software | DIALS |
Data scaling software | DIALS |
Phasing software | MrBUMP |
Refinement software | REFMAC (5.0.32) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 63.390 | 2.500 |
High resolution limit [Å] | 2.379 | 2.379 |
Rmerge | 0.126 | |
Rmeas | 0.131 | |
Number of reflections | 27360 | 1349 |
<I/σ(I)> | 13.4 | 1.8 |
Completeness [%] | 100.0 | 99 |
Redundancy | 13 | 12.3 |
CC(1/2) | 0.999 | 0.851 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 289 | 0.5 M Potassium thiocyanate 0.1 M Tris pH 8.5 7 mg.mL-1 in a 1:1 ratio |