5HL4
Acoustic injectors for drop-on-demand serial femtosecond crystallography
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | FREE ELECTRON LASER |
| Source details | SLAC LCLS BEAMLINE XPP |
| Synchrotron site | SLAC LCLS |
| Beamline | XPP |
| Temperature [K] | 295 |
| Detector technology | PIXEL |
| Collection date | 2013-06-07 |
| Detector | CS-PAD XPP |
| Wavelength(s) | 1.36 |
| Spacegroup name | P 63 2 2 |
| Unit cell lengths | 98.427, 98.427, 180.087 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 90.040 - 2.200 |
| R-factor | 0.27204 |
| Rwork | 0.269 |
| R-free | 0.33012 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3vcp |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.766 |
| Data reduction software | cctbx.xfel |
| Data scaling software | cctbx.xfel |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 90.040 | 2.290 |
| High resolution limit [Å] | 2.200 | 2.200 |
| Number of reflections | 25584 | |
| <I/σ(I)> | 16.5 | 3.7 |
| Completeness [%] | 99.7 | 99.9 |
| Redundancy | 53.6 | 10.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 295 | 10 mg/ml protein with 25 mM hexaamine cobalt chloride crystallized by hanging drop with precipitant 7.5% PEG 3350, 10% glycerol, and 0.1M HEPES pH 7.0. |
