6BEV
Human Single Domain Sulfurtranferase TSTD1
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 23-ID-B |
| Synchrotron site | APS |
| Beamline | 23-ID-B |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-08-21 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.7293 |
| Spacegroup name | P 1 |
| Unit cell lengths | 37.903, 40.246, 47.201 |
| Unit cell angles | 113.31, 90.20, 117.50 |
Refinement procedure
| Resolution | 23.403 - 1.043 |
| R-factor | 0.1304 |
| Rwork | 0.130 |
| R-free | 0.14410 |
| Structure solution method | SAD |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.981 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | SOLVE |
| Refinement software | PHENIX |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 23.403 | 23.403 | 1.110 |
| High resolution limit [Å] | 1.040 | 3.120 | 1.040 |
| Rmerge | 0.030 | 0.016 | 0.567 |
| Rmeas | 0.033 | 0.017 | 0.616 |
| Total number of observations | 703860 | ||
| Number of reflections | 101056 | 3916 | 15651 |
| <I/σ(I)> | 24.19 | 107.55 | 2.19 |
| Completeness [%] | 95.7 | 98.9 | 91.6 |
| Redundancy | 6.965 | 6.985 | 6.594 |
| CC(1/2) | 1.000 | 1.000 | 0.953 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293.15 | 0.09 M sodium cacodylate, pH 6.5, 0.1 M sodium citrate |
