8BH0
O-Methyltransferase Plu4890 in complex with SAH and AQ-270b
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06SA |
| Synchrotron site | SLS |
| Beamline | X06SA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2022-05-21 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 1 |
| Unit cell lengths | 56.940, 105.620, 124.470 |
| Unit cell angles | 94.37, 90.22, 104.97 |
Refinement procedure
| Resolution | 30.000 - 1.700 |
| R-factor | 0.179 |
| Rwork | 0.178 |
| R-free | 0.20530 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 8bgt |
| RMSD bond length | 0.002 |
| RMSD bond angle | 1.144 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 49.000 | 1.800 |
| High resolution limit [Å] | 1.700 | 1.700 |
| Rmerge | 0.048 | 0.644 |
| Number of reflections | 291332 | 45939 |
| <I/σ(I)> | 11.5 | 2 |
| Completeness [%] | 94.8 | 94.7 |
| Redundancy | 3.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 298 | 0.2 M Ammoniumsulfate, 0.1 M MES pH 6.5, 30 % PEG5000MME |
