1T6T
putative protein from Aquifex aeolicus
Experimental procedure
| Experimental method | SAD |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-ID |
| Synchrotron site | APS |
| Beamline | 19-ID |
| Temperature [K] | 150 |
| Detector technology | CCD |
| Collection date | 2003-12-21 |
| Detector | CUSTOM-MADE |
| Wavelength(s) | 0.97885 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 45.906, 58.405, 54.124 |
| Unit cell angles | 90.00, 98.99, 90.00 |
Refinement procedure
| Resolution | 26.730 - 1.800 |
| R-factor | 0.181 |
| Rwork | 0.180 |
| R-free | 0.20800 |
| Structure solution method | SAD |
| RMSD bond length | 0.004 |
| RMSD bond angle | 1.000 |
| Data reduction software | d*TREK |
| Data scaling software | SCALEPACK |
| Phasing software | SOLVE |
| Refinement software | CNS (1.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 26.730 | 1.870 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Number of reflections | 22463 | |
| <I/σ(I)> | 3.7 | |
| Completeness [%] | 85.3 | 43.6 |
| Redundancy | 3.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 294 | ethanol, sodium cacodylate, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 294K |
