6WTE
Structure of radical S-adenosylmethionine methyltransferase, TsrM, from Kitasatospora setae with cobalamin and [4Fe-4S] cluster bound
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 21-ID-F |
| Synchrotron site | APS |
| Beamline | 21-ID-F |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2018-11-17 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.97872 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 49.368, 103.759, 105.970 |
| Unit cell angles | 90.00, 95.08, 90.00 |
Refinement procedure
| Resolution | 43.140 - 1.670 |
| R-factor | 0.1911 |
| Rwork | 0.190 |
| R-free | 0.21460 |
| Structure solution method | SAD |
| RMSD bond length | 0.004 |
| RMSD bond angle | 0.732 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | AutoSol |
| Refinement software | PHENIX (1.18_3845) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.730 |
| High resolution limit [Å] | 1.660 | 1.660 |
| Rpim | 0.340 | |
| Number of reflections | 123027 | 12117 |
| <I/σ(I)> | 9.44 | 2.19 |
| Completeness [%] | 99.8 | |
| Redundancy | 7.3 | |
| CC(1/2) | 0.800 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 0.2 M sodium acetate, 0.1 M MES, pH 6.5, and 15% (w/v) PEG 8000 |
