8S49
CdaA-B06 complex
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE MASSIF-3 |
Synchrotron site | ESRF |
Beamline | MASSIF-3 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-08-15 |
Detector | DECTRIS PILATUS3 2M |
Wavelength(s) | 0.9762 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 41.660, 64.750, 129.060 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 45.710 - 1.700 |
R-factor | 0.1986 |
Rwork | 0.197 |
R-free | 0.22070 |
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] | 45.710 | 50.000 | 1.800 |
High resolution limit [Å] | 1.700 | 17.000 | 1.700 |
Rmerge | 0.055 | 0.025 | 2.046 |
Rmeas | 0.064 | 0.029 | 2.329 |
Number of reflections | 73715 | 66 | 11563 |
<I/σ(I)> | 10.06 | ||
Completeness [%] | 99.3 | ||
Redundancy | 4.2 | ||
CC(1/2) | 0.998 | 0.999 | 0.536 |
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 |