3VLH
Crystal Structure Analysis of the Arg409Leu Variants of KatG from HALOARCULA MARISMORTUI
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE AR-NW12A |
| Synchrotron site | Photon Factory |
| Beamline | AR-NW12A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2006-03-01 |
| Detector | ADSC QUANTUM 210 |
| Wavelength(s) | 1 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 317.146, 81.860, 75.558 |
| Unit cell angles | 90.00, 99.98, 90.00 |
Refinement procedure
| Resolution | 37.070 - 1.730 |
| Rwork | 0.249 |
| R-free | 0.26800 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.500 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | CNS |
| Refinement software | CNS |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 37.070 | 1.790 |
| High resolution limit [Å] | 1.730 | 1.730 |
| Rmerge | 0.098 | 0.318 |
| Number of reflections | 195739 | |
| <I/σ(I)> | 34.3 | 1.6 |
| Completeness [%] | 99.0 | 93.2 |
| Redundancy | 7.1 | 2.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6 | 288 | 2.36-2.58M Ammonium sulfate, 0.5M potassium chloride, 20mM sodium phosphate, VAPOR DIFFUSION, HANGING DROP, temperature 288K |
