6GWA
Concanavalin B structure determined with data from the EuXFEL, the first MHz free electron laser
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | FREE ELECTRON LASER |
| Source details | EUROPEAN XFEL BEAMLINE SPB/SFX |
| Synchrotron site | European XFEL |
| Beamline | SPB/SFX |
| Temperature [K] | 293 |
| Detector technology | PIXEL |
| Collection date | 2018-06-17 |
| Detector | AGIPD |
| Wavelength(s) | 1.660 |
| Spacegroup name | P 61 |
| Unit cell lengths | 82.250, 82.250, 103.400 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 41.841 - 2.100 |
| R-factor | 0.1647 |
| Rwork | 0.162 |
| R-free | 0.21880 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1cnv |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.139 |
| Data reduction software | CrystFEL |
| Data scaling software | CrystFEL |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 42.000 | 2.200 |
| High resolution limit [Å] | 2.100 | 2.100 |
| Number of reflections | 23105 | |
| <I/σ(I)> | 6.9 | |
| Completeness [%] | 100.0 | |
| Redundancy | 650 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | BATCH MODE | 293 | Batch mode, acetone |
