6FWV
The Bacillus anthracis TIE protein
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04-1 |
| Synchrotron site | Diamond |
| Beamline | I04-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-12-11 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.9282 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 208.824, 66.500, 106.581 |
| Unit cell angles | 90.00, 116.81, 90.00 |
Refinement procedure
| Resolution | 93.180 - 2.580 |
| R-factor | 0.2231 |
| Rwork | 0.221 |
| R-free | 0.25560 |
| Structure solution method | SAD |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.138 |
| Data reduction software | xia2 |
| Data scaling software | xia2 |
| Phasing software | SHELXD |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 93.180 | 2.650 |
| High resolution limit [Å] | 2.580 | 2.580 |
| Rmerge | 0.064 | 0.778 |
| Number of reflections | 40944 | |
| <I/σ(I)> | 13.1 | 1.2 |
| Completeness [%] | 99.0 | 98.4 |
| Redundancy | 3.7 | 3.3 |
| CC(1/2) | 1.000 | 0.600 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 293 | PEG 6000, sodium cacodylate, zinc acetate, methanol |
