4CZQ
Crystal structure of the extralong fungal manganese peroxidase from Ceriporiopsis subvermispora in complex with cadmium
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SOLEIL BEAMLINE PROXIMA 1 |
Synchrotron site | SOLEIL |
Beamline | PROXIMA 1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2013-11-06 |
Detector | DECTRIS PILATUS 6M |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 108.620, 108.620, 68.320 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 34.349 - 1.198 |
R-factor | 0.1514 |
Rwork | 0.151 |
R-free | 0.16190 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3MQ5 |
RMSD bond length | 0.008 |
RMSD bond angle | 1.379 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 1.270 | 1.270 |
High resolution limit [Å] | 1.200 | 1.200 |
Rmerge | 0.050 | 1.290 |
Number of reflections | 128714 | |
<I/σ(I)> | 0.19 | 1.1 |
Completeness [%] | 99.8 | 98.9 |
Redundancy | 8.2 | 4.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 4.6 | 18% PEG 4000, 100MM NA-ACETATE PH 4.6 |