6HFW
Mycobacterium tuberculosis DprE1 in complex with CMP1
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID29 |
| Synchrotron site | ESRF |
| Beamline | ID29 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2013-09-25 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 1.0725 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 78.340, 84.730, 80.900 |
| Unit cell angles | 90.00, 103.20, 90.00 |
Refinement procedure
| Resolution | 56.690 - 2.470 |
| R-factor | 0.17042 |
| Rwork | 0.168 |
| R-free | 0.22027 |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.192 |
| Data scaling software | SCALA |
| Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 56.690 | 2.600 |
| High resolution limit [Å] | 2.470 | 2.470 |
| Number of reflections | 33896 | |
| <I/σ(I)> | 11.3 | |
| Completeness [%] | 96.8 | |
| Redundancy | 2.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | MICROBATCH | 298 | 20mM in 30% PPG, 100mM Imidazole,pH 7.4 |
