2ZQ5
Crystal structure of sulfotransferase STF1 from Mycobacterium tuberculosis H37Rv (type1 form)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL41XU |
| Synchrotron site | SPring-8 |
| Beamline | BL41XU |
| Temperature [K] | 100 |
| Wavelength(s) | 1.000 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 40.864, 95.761, 48.038 |
| Unit cell angles | 90.00, 106.43, 90.00 |
Refinement procedure
| Resolution | 46.080 - 2.000 |
| R-factor | 0.176 |
| Rwork | 0.176 |
| R-free | 0.19800 |
| Structure solution method | MIR |
| RMSD bond length | 0.004 |
| RMSD bond angle | 1.100 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | SOLVE |
| Refinement software | CNS (1.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.550 |
| High resolution limit [Å] | 1.500 | 1.500 |
| Rmerge | 0.034 | 0.125 |
| Number of reflections | 56164 | |
| <I/σ(I)> | 26.1 | 10 |
| Completeness [%] | 99.3 | 98.3 |
| Redundancy | 4.1 | 3.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.1 | 293 | 20% PEG 3350, 0.1M bis-tris pH 7.1, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
