5K2J
Crystal structure of reduced Prx3 in complex with h2o2 from Vibrio vulnificus
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PAL/PLS BEAMLINE 5C (4A) |
| Synchrotron site | PAL/PLS |
| Beamline | 5C (4A) |
| Temperature [K] | 100.15 |
| Detector technology | CCD |
| Collection date | 2015-10-20 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.97960 |
| Spacegroup name | P 1 |
| Unit cell lengths | 75.080, 97.725, 97.492 |
| Unit cell angles | 78.72, 67.33, 67.34 |
Refinement procedure
| Resolution | 19.680 - 1.908 |
| R-factor | 0.197 |
| Rwork | 0.195 |
| R-free | 0.24430 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5k1g |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.572 |
| Data reduction software | DENZO |
| Data scaling software | HKL-2000 |
| Phasing software | MOLREP |
| Refinement software | PHENIX ((1.10.1_2155: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.930 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Rmerge | 0.060 | |
| Number of reflections | 182028 | |
| <I/σ(I)> | 14.5 | |
| Completeness [%] | 90.0 | |
| Redundancy | 3.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 287.15 | 0.8 M sodium citrate, 0.1 M Tris-HCl, 0.2 M sodium chloride, 500 uM H2O2 |
