7EWE
Mycobacterium tuberculosis HigA2 (Form III)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04 |
| Synchrotron site | Diamond |
| Beamline | I04 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2020-02-16 |
| Detector | DECTRIS EIGER2 XE 16M |
| Wavelength(s) | 0.98 |
| Spacegroup name | P 31 2 1 |
| Unit cell lengths | 86.890, 86.890, 153.910 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 75.360 - 3.410 |
| R-factor | 0.2063 |
| Rwork | 0.202 |
| R-free | 0.27740 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 7ewc |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.849 |
| Data reduction software | xia2 |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 76.960 | 3.680 |
| High resolution limit [Å] | 3.400 | 3.410 |
| Number of reflections | 9603 | 1930 |
| <I/σ(I)> | 7.9 | |
| Completeness [%] | 97.8 | |
| Redundancy | 4.9 | |
| CC(1/2) | 0.997 | 0.507 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 25% (w/v) PEG 4000, 0.2M ammonium sulfate, 0.1M sodium acetate trihydrate pH4.6 |
