6E4D
Atomic structure of Mycobacterium tuberculosis DppA
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | CHESS BEAMLINE F1 |
| Synchrotron site | CHESS |
| Beamline | F1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2018-03-28 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.97 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 52.620, 68.951, 62.108 |
| Unit cell angles | 90.00, 106.34, 90.00 |
Refinement procedure
| Resolution | 14.921 - 1.252 |
| R-factor | 0.1684 |
| Rwork | 0.168 |
| R-free | 0.18780 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6e3d |
| RMSD bond length | 0.005 |
| RMSD bond angle | 0.789 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.12_2829) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 15.000 | 1.290 |
| High resolution limit [Å] | 1.250 | 1.250 |
| Rpim | 0.050 | 0.359 |
| Number of reflections | 114948 | |
| <I/σ(I)> | 30.4 | 3.4 |
| Completeness [%] | 98.7 | 89.6 |
| Redundancy | 4.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6 | 295 | 0.2 M Sodium malonate pH 6.0 and 22% (w/v) PEG3350 |
