2VO2
Crystal structure of soybean ascorbate peroxidase mutant W41A subjected to low dose X-rays
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-2 |
| Synchrotron site | ESRF |
| Beamline | ID14-2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2007-03-03 |
| Detector | ADSC CCD |
| Spacegroup name | P 42 21 2 |
| Unit cell lengths | 82.057, 82.057, 75.631 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 36.690 - 1.900 |
| R-factor | 0.177 |
| Rwork | 0.174 |
| R-free | 0.23600 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 9ggn |
| RMSD bond length | 0.016 |
| RMSD bond angle | 1.507 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | REFMAC |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 2.110 | 2.110 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.030 | 0.140 |
| Number of reflections | 17935 | |
| <I/σ(I)> | 6.2 | 0.9 |
| Completeness [%] | 99.7 | 100 |
| Redundancy | 3.55 | 3.604 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 8.3 | pH 8.3 |
