7SHG
Polysaccharide ribofuranosyl transferase from Thermobacillus composti
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | CLSI BEAMLINE 08B1-1 |
| Synchrotron site | CLSI |
| Beamline | 08B1-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-08-05 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.9811 |
| Spacegroup name | P 2 21 21 |
| Unit cell lengths | 71.740, 82.500, 234.920 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 49.160 - 2.500 |
| R-factor | 0.2522 |
| Rwork | 0.251 |
| R-free | 0.29490 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | AlphaFold2 |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.487 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.19_4092) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.600 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rmerge | 0.133 | 1.153 |
| Number of reflections | 83914 | 9187 |
| <I/σ(I)> | 6.22 | 1.13 |
| Completeness [%] | 90.0 | 88.9 |
| Redundancy | 4.93 | |
| CC(1/2) | 0.997 | 0.675 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 293 | 10 mM MgCl2, 10% PEG 20000, 100 mM Na HEPES pH 7.5 |
