6B6B
Beta-Lactamase, unmixed needles crystal form
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | FREE ELECTRON LASER |
| Source details | SLAC LCLS BEAMLINE CXI |
| Synchrotron site | SLAC LCLS |
| Beamline | CXI |
| Temperature [K] | 300 |
| Detector technology | PIXEL |
| Collection date | 2016-09-09 |
| Detector | CS-PAD CXI-1 |
| Wavelength(s) | 1.3 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 39.600, 41.600, 69.310 |
| Unit cell angles | 90.00, 104.82, 90.00 |
Refinement procedure
| Resolution | 19.374 - 1.800 |
| R-factor | 0.2166 |
| Rwork | 0.215 |
| R-free | 0.24490 |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.059 |
| Data reduction software | CrystFEL |
| Data scaling software | CrystFEL |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.12_2829: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 19.374 | 1.890 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Number of reflections | 18815 | |
| <I/σ(I)> | 9.6 | 1.2 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 985.3 | 54.5 |
| CC(1/2) | 0.391 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | free interface diffustion | 293 | 0.1 M sodium acetate pH 5.0, 45% PEG 1000 |
