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 |