4BM2
CRYSTAL STRUCTURE OF MANGANESE PEROXIDASE 4 FROM PLEUROTUS OSTREATUS - CRYSTAL FORM II
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X06DA |
Synchrotron site | SLS |
Beamline | X06DA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2012-11-06 |
Detector | DECTRIS PILATUS |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 123.670, 86.560, 40.030 |
Unit cell angles | 90.00, 107.64, 90.00 |
Refinement procedure
Resolution | 43.280 - 1.391 |
R-factor | 0.2221 |
Rwork | 0.221 |
R-free | 0.24450 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3fmu |
RMSD bond length | 0.008 |
RMSD bond angle | 1.256 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHENIX |
Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.470 |
High resolution limit [Å] | 1.400 | 1.400 |
Rmerge | 0.150 | 0.580 |
Number of reflections | 78216 | |
<I/σ(I)> | 7.5 | 2.2 |
Completeness [%] | 96.9 | 87.4 |
Redundancy | 6.4 | 6.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 0.1 M NA-ACETATE AT PH 4.6 & 2.0 M (NH4)2SO4. |