5AOG
Structure of Sorghum peroxidase
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2012-03-17 |
| Detector | DECTRIS PIXEL |
| Spacegroup name | P 31 2 1 |
| Unit cell lengths | 58.620, 58.620, 208.410 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 36.360 - 1.270 |
| R-factor | 0.13728 |
| Rwork | 0.136 |
| R-free | 0.15931 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1bgp |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.478 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 36.360 | 5.700 |
| High resolution limit [Å] | 1.270 | 1.270 |
| Rmerge | 0.030 | 0.700 |
| Number of reflections | 103499 | |
| <I/σ(I)> | 19.4 | 2.1 |
| Completeness [%] | 98.4 | 93.9 |
| Redundancy | 5.4 | 4.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 6 | 100 MM SODIUM PHOSPHATE 4 M SODIUM FORMATE PH 6.0 |
