6G0C
Crystal structure of SdeA catalytic core
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06DA |
Synchrotron site | SLS |
Beamline | X06DA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-07-26 |
Detector | DECTRIS PILATUS 2M |
Wavelength(s) | 1.00 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 70.721, 80.824, 86.518 |
Unit cell angles | 90.00, 110.57, 90.00 |
Refinement procedure
Resolution | 44.216 - 2.802 |
R-factor | 0.2597 |
Rwork | 0.258 |
R-free | 0.29320 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | It was solved by MR on a crude model from experimental phasing experiment (data not deposited) |
RMSD bond length | 0.003 |
RMSD bond angle | 0.505 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHENIX |
Refinement software | PHENIX ((1.12_2829: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 44.216 | 2.902 |
High resolution limit [Å] | 2.802 | 2.802 |
Rmerge | 0.139 | |
Number of reflections | 43693 | |
<I/σ(I)> | 13.03 | |
Completeness [%] | 99.6 | |
Redundancy | 6.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 7 | 300 | 100mM Bis Tris Propane pH 7.0-8.0, 0.1-0.2M sodium citrate tribasic dihydrate, 20-30% PEG 3350 |