3UW8
Crystal Structure Analysis of the Ser305Thr Variants of KatG from Haloarcula marismortui
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU RU300 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2005-11-14 |
Detector | RIGAKU RAXIS IV |
Wavelength(s) | 1.5418 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 315.410, 81.120, 75.020 |
Unit cell angles | 90.00, 99.84, 90.00 |
Refinement procedure
Resolution | 24.810 - 2.350 |
R-factor | 0.257 |
Rwork | 0.257 |
R-free | 0.30900 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.011 |
RMSD bond angle | 1.900 |
Data reduction software | CrystalClear |
Data scaling software | SCALA |
Phasing software | CNS |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 25.000 | 2.430 |
High resolution limit [Å] | 2.350 | 2.350 |
Rmerge | 0.103 | 0.320 |
Number of reflections | 77588 | |
<I/σ(I)> | 9.1 | 3.6 |
Completeness [%] | 99.6 | 100 |
Redundancy | 6 | 5.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6 | 293 | 2.36-2.58M Ammonium sulfate, 0.5M potassium chloride, 20mM sodium phosphate, VAPOR DIFFUSION, HANGING DROP, temperature 293K |