4MOG
Pyranose 2-oxidase V546C mutant with 3-fluorinated glucose
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 | PSI PILATUS 6M |
Wavelength(s) | 0.946496 |
Spacegroup name | P 42 21 2 |
Unit cell lengths | 102.507, 102.507, 128.626 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 48.110 - 2.000 |
R-factor | 0.187 |
Rwork | 0.186 |
R-free | 0.22400 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.019 |
RMSD bond angle | 1.889 |
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] | 48.110 | 2.100 |
High resolution limit [Å] | 2.000 | 2.000 |
Number of reflections | 46860 | |
<I/σ(I)> | 9.8 | 3.1 |
Completeness [%] | 99.8 | 99.3 |
Redundancy | 26.5 | 24.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.2 | 298 | 0.1M MES, 50mM MgCl2, 10% (w/v) monomethylether PEG 2000 , pH 5.2, VAPOR DIFFUSION, HANGING DROP, temperature 298K |