4MOF
Pyranose 2-oxidase H450G mutant with 2-fluorinated glucose
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | MAX II BEAMLINE I911-3 |
Synchrotron site | MAX II |
Beamline | I911-3 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2008-11-03 |
Detector | MARMOSAIC 225 mm CCD |
Wavelength(s) | 0.9600 |
Spacegroup name | P 42 21 2 |
Unit cell lengths | 102.340, 102.340, 128.510 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 50.000 - 1.850 |
R-factor | 0.15929 |
Rwork | 0.158 |
R-free | 0.19353 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.022 |
RMSD bond angle | 1.977 |
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] | 54.420 | 1.900 |
High resolution limit [Å] | 1.850 | 1.850 |
Number of reflections | 58446 | |
<I/σ(I)> | 17.4 | 3.2 |
Completeness [%] | 99.4 | 93.8 |
Redundancy | 14.3 | 11.9 |
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 |