6FMT
IMISX-EP of Hg-BacA Soaking SAD
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06SA |
| Synchrotron site | SLS |
| Beamline | X06SA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2016-12-15 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 1.9 |
| Spacegroup name | C 2 2 2 |
| Unit cell lengths | 112.620, 145.550, 40.330 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 44.558 - 3.000 |
| R-factor | 0.2378 |
| Rwork | 0.236 |
| R-free | 0.27760 |
| Structure solution method | SAD |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | SHELXCD |
| Refinement software | PHENIX ((1.13rc1_2954: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 44.580 | 3.080 |
| High resolution limit [Å] | 3.000 | 3.000 |
| Rmeas | 0.480 | 3.930 |
| Number of reflections | 12841 | 977 |
| <I/σ(I)> | 10.62 | 1.97 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 65.4 | 60.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | LIPIDIC CUBIC PHASE | 293 | 40 % PEG-400, 0.3-0.5 M ammonium citrate dibasic and 0.1 M sodium citrate pH 5.0 |
