3GYQ
Structure of the Thiostrepton-Resistance Methyltransferase S-adenosyl-L-methionine Complex
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-1 |
| Synchrotron site | ESRF |
| Beamline | ID23-1 |
| Temperature [K] | 180 |
| Detector technology | CCD |
| Collection date | 2007-08-29 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 0.9763 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 40.960, 55.770, 215.580 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 19.388 - 2.450 |
| R-factor | 0.218 |
| Rwork | 0.215 |
| R-free | 0.26800 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1ipa |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.630 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | MOLREP |
| Refinement software | PHENIX |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 19.600 | 2.510 |
| High resolution limit [Å] | 2.450 | 2.450 |
| Number of reflections | 18976 | |
| <I/σ(I)> | 10.2 | 2.85 |
| Completeness [%] | 95.8 | 90 |
| Redundancy | 4.4 | 4.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 8 | 293 | 27% PEG 4000, 0.2M sodium acetate, 0.1M Tris buffer pH 8.0, VAPOR DIFFUSION, temperature 293K |
