1RWL
Extracellular domain of Mycobacterium tuberculosis PknD
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 8.3.1 |
| Synchrotron site | ALS |
| Beamline | 8.3.1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2003-07-27 |
| Detector | ADSC QUANTUM 210 |
| Wavelength(s) | 1.0719 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 43.940, 94.580, 71.770 |
| Unit cell angles | 90.00, 98.10, 90.00 |
Refinement procedure
| Resolution | 30.000 - 1.900 |
| R-factor | 0.216 |
| Rwork | 0.214 |
| R-free | 0.26200 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1rwi |
| RMSD bond length | 0.017 |
| RMSD bond angle | 1.634 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | EPMR |
| Refinement software | CNS |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 2.000 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Rmerge | 0.069 | 0.514 |
| Number of reflections | 17505 | |
| <I/σ(I)> | 8.5 | 2.8 |
| Completeness [%] | 99.1 | 98.9 |
| Redundancy | 3.5 | 3.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8 | 295 | sodium acetate, HEPES, cadmium sulfate, p-chloromercurybenzene sulfonic acid, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 295K |
