6LAU
the wildtype SAM-VI riboswitch bound to SAH
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL19U1 |
Synchrotron site | SSRF |
Beamline | BL19U1 |
Temperature [K] | 80 |
Detector technology | PIXEL |
Collection date | 2018-07-08 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 1.102 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 56.088, 85.021, 93.392 |
Unit cell angles | 90.00, 105.78, 90.00 |
Refinement procedure
Resolution | 39.729 - 3.109 |
R-factor | 0.1937 |
Rwork | 0.191 |
R-free | 0.25160 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6las |
RMSD bond length | 0.010 |
RMSD bond angle | 1.380 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX (1.10_2155) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 40.000 | 40.000 | 3.150 |
High resolution limit [Å] | 3.100 | 8.390 | 3.100 |
Rmerge | 0.148 | 0.040 | 1.125 |
Rmeas | 0.161 | 0.043 | 1.232 |
Rpim | 0.061 | 0.016 | 0.492 |
Total number of observations | 100278 | ||
Number of reflections | 14922 | 752 | 676 |
<I/σ(I)> | 2.7 | ||
Completeness [%] | 97.8 | 94.6 | 91.5 |
Redundancy | 6.7 | 6.6 | 6 |
CC(1/2) | 0.999 | 0.669 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 289 | 0.1 M sodium acetate trihydrate pH 4.6, 10% w/v polyethylene glycol 4,000 |