3TJF
Crystal Structure of human peroxiredoxin IV C51A mutant in reduced form
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 | 2010-12-05 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.97 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 108.348, 138.849, 96.236 |
| Unit cell angles | 90.00, 103.97, 90.00 |
Refinement procedure
| Resolution | 28.770 - 2.040 |
| R-factor | 0.16152 |
| Rwork | 0.160 |
| R-free | 0.19711 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2pn8 |
| RMSD bond length | 0.016 |
| RMSD bond angle | 1.458 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.5.0110) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 28.970 | 2.090 |
| High resolution limit [Å] | 2.040 | 2.040 |
| Rmerge | 0.051 | 0.708 |
| Number of reflections | 87136 | |
| <I/σ(I)> | 16.3 | 2.2 |
| Completeness [%] | 99.4 | 96.4 |
| Redundancy | 4.3 | 4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 289 | 1.55 M ammonium sulfate, 12% glycerol, 0.1 M Tris, pH 8.5, VAPOR DIFFUSION, SITTING DROP, temperature 289K |
