2IXC
RmlC M. tuberculosis with dTDP-rhamnose
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SRS BEAMLINE PX14.1 |
| Synchrotron site | SRS |
| Beamline | PX14.1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Detector | ADSC CCD |
| Spacegroup name | P 1 |
| Unit cell lengths | 44.778, 56.845, 90.700 |
| Unit cell angles | 89.90, 78.28, 82.33 |
Refinement procedure
| Resolution | 36.200 - 1.790 |
| R-factor | 0.154 |
| Rwork | 0.151 |
| R-free | 0.19600 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.339 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 36.000 | 1.900 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rmerge | 0.060 | 0.300 |
| Number of reflections | 84823 | |
| <I/σ(I)> | 7.5 | 1.8 |
| Completeness [%] | 93.0 | 89 |
| Redundancy | 2.2 | 2.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 23% (w/v) polyethylene glycol (PEG) 8000, 0.2 M calcium acetate hydrate, 0.1 M sodium cacodylate (pH 5.8) |
