4USC
Crystal structure of peroxidase from palm tree Chamaerops excelsa
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | LNLS BEAMLINE W01B-MX2 |
Synchrotron site | LNLS |
Beamline | W01B-MX2 |
Temperature [K] | 100 |
Collection date | 2011-05-13 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 70.180, 100.650, 132.310 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 80.110 - 2.600 |
R-factor | 0.21964 |
Rwork | 0.218 |
R-free | 0.24585 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3hdl |
RMSD bond length | 0.016 |
RMSD bond angle | 1.731 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 80.100 | 2.690 |
High resolution limit [Å] | 2.600 | 2.600 |
Rmerge | 0.010 | 0.560 |
Number of reflections | 29525 | |
<I/σ(I)> | 10.4 | 3.7 |
Completeness [%] | 90.1 | 91.8 |
Redundancy | 4.3 | 4.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 0.17 M AMMONIUM SULFATE, 0.085 M TRIS PH 8.0, 17% PEG MME 2K, 15% GLYCEROL |