8S48
CdaA-C11 complex
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | PETRA III, EMBL c/o DESY BEAMLINE P13 (MX1) |
Synchrotron site | PETRA III, EMBL c/o DESY |
Beamline | P13 (MX1) |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-08-13 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.97625 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 41.330, 64.680, 128.650 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 35.740 - 1.650 |
R-factor | 0.1922 |
Rwork | 0.191 |
R-free | 0.21870 |
Structure solution method | FOURIER SYNTHESIS |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHENIX |
Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 35.740 | 50.000 | 1.750 |
High resolution limit [Å] | 1.650 | 17.000 | 1.650 |
Rmerge | 0.055 | 0.020 | 1.808 |
Rmeas | 0.063 | 0.022 | 2.063 |
Number of reflections | 79830 | 67 | 12861 |
<I/σ(I)> | 10.42 | ||
Completeness [%] | 99.6 | ||
Redundancy | 4.2 | ||
CC(1/2) | 0.999 | 0.999 | 0.558 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 293 | 3.7 M NaCl, 0.1M Na-HEPES pH 8.5 and 3 % DMSO |