6LF2
SeviL bound to asialo-GM1 saccharide
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE BL-17A |
| Synchrotron site | Photon Factory |
| Beamline | BL-17A |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2019-02-27 |
| Detector | DECTRIS PILATUS3 S 6M |
| Wavelength(s) | 0.98 |
| Spacegroup name | P 41 21 2 |
| Unit cell lengths | 61.590, 61.590, 136.783 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 34.200 - 1.600 |
| R-factor | 0.1965 |
| Rwork | 0.195 |
| R-free | 0.22840 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6lf1 |
| RMSD bond length | 0.005 |
| RMSD bond angle | 0.801 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | PHENIX (1.17.1_3660) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 43.600 | 1.627 |
| High resolution limit [Å] | 1.600 | 1.600 |
| Rpim | 0.050 | 0.426 |
| Number of reflections | 725030 | 1780 |
| <I/σ(I)> | 25.1 | |
| Completeness [%] | 99.7 | |
| Redundancy | 20.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5 | 293 | 0.1 M MIB (sodium malonate dibasic monohydrate, imidazole, boric acid), pH 5.0, 25% PEG 1500 |
