3TJB
Crystal structure of wild-type human peroxiredoxin IV
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-10-21 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.97630 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 107.980, 139.430, 95.920 |
| Unit cell angles | 90.00, 102.81, 90.00 |
Refinement procedure
| Resolution | 69.710 - 2.380 |
| R-factor | 0.16563 |
| Rwork | 0.163 |
| R-free | 0.22095 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2pn8 |
| RMSD bond length | 0.017 |
| RMSD bond angle | 1.623 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.5.0110) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 69.710 | 2.440 |
| High resolution limit [Å] | 2.370 | 2.370 |
| Rmerge | 0.068 | 0.730 |
| Number of reflections | 55077 | |
| <I/σ(I)> | 9.6 | 1.7 |
| Completeness [%] | 98.8 | 99 |
| Redundancy | 3.7 | 3.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.3 | 289 | 0.1 M HEPES, pH 7.3, 11% PEG8000, 8% ethylene glycol, VAPOR DIFFUSION, SITTING DROP, temperature 289K |
