8S45
CdaA-E05 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) | 0.9677 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 41.750, 64.710, 129.040 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 39.720 - 1.690 |
| R-factor | 0.1983 |
| Rwork | 0.196 |
| R-free | 0.23570 |
| 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] | 39.720 | 50.000 | 1.790 |
| High resolution limit [Å] | 1.690 | 17.000 | 1.690 |
| Rmerge | 0.050 | 0.017 | 2.055 |
| Rmeas | 0.057 | 0.020 | 2.350 |
| Number of reflections | 74891 | 66 | 11891 |
| <I/σ(I)> | 13.12 | ||
| Completeness [%] | 99.0 | ||
| Redundancy | 4.4 | ||
| CC(1/2) | 0.999 | 1.000 | 0.521 |
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 |
