6IU0
Peroxiredoxin from Thermococcus kodakaraensis (0Cys mutant)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL38B1 |
Synchrotron site | SPring-8 |
Beamline | BL38B1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2017-11-04 |
Detector | MARRESEARCH |
Wavelength(s) | 1 |
Spacegroup name | P 6 |
Unit cell lengths | 141.307, 141.307, 48.531 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 38.020 - 2.380 |
R-factor | 0.21538 |
Rwork | 0.213 |
R-free | 0.26995 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3w6g |
RMSD bond length | 0.022 |
RMSD bond angle | 1.929 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | MOLREP |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.000 | 2.420 |
High resolution limit [Å] | 2.380 | 2.380 |
Number of reflections | 22561 | |
<I/σ(I)> | 11.3 | |
Completeness [%] | 100.0 | |
Redundancy | 9.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 0.1M HEPES-NaOH (pH 7.5), 20% PEG4000, and 8% 2-propanol |