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 |