6FMR
IMISX-EP of Se-PepTSt
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 | 2015-09-07 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.97854 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 103.680, 110.890, 110.380 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 49.540 - 2.700 |
| R-factor | 0.2279 |
| Rwork | 0.227 |
| R-free | 0.25380 |
| Structure solution method | SAD |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | SHELXCD |
| Refinement software | PHENIX |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 49.540 | 2.770 |
| High resolution limit [Å] | 2.700 | 2.700 |
| Rmeas | 0.440 | 3.690 |
| Number of reflections | 33746 | 2460 |
| <I/σ(I)> | 8.9 | 1.74 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 25.4 | 23.8 |
| CC(1/2) | 0.990 | 0.450 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | LIPIDIC CUBIC PHASE | 7 | 293 | 22 %(v/v) PEG- 400, 325 mM ammonium dihydrogen phosphate, 100 mM HEPES, pH 7.0, and 10 mM cefadroxil |
