4MOR
Pyranose 2-oxidase H450G/V546C double mutant with 3-fluorinated galactose
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PETRA III, EMBL c/o DESY BEAMLINE P13 (MX1) |
| Synchrotron site | PETRA III, EMBL c/o DESY |
| Beamline | P13 (MX1) |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2013-02-12 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.946495 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 100.242, 102.469, 137.840 |
| Unit cell angles | 90.00, 91.09, 90.00 |
Refinement procedure
| Resolution | 49.330 - 1.500 |
| R-factor | 0.156 |
| Rwork | 0.156 |
| R-free | 0.19800 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.027 |
| RMSD bond angle | 2.283 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 49.330 | 1.600 |
| High resolution limit [Å] | 1.500 | 1.500 |
| Number of reflections | 442699 | |
| <I/σ(I)> | 11.9 | 1.6 |
| Completeness [%] | 99.7 | 99.7 |
| Redundancy | 7.4 | 7.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.2 | 298 | 0.1 M MES, 50 mM MgCl2, 10% (w/v) monomethylether PEG 2000, pH 5.2, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
