7SGY
Cannabis sativa bibenzyl synthase
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | CLSI BEAMLINE 08ID-1 |
| Synchrotron site | CLSI |
| Beamline | 08ID-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2020-03-01 |
| Detector | DECTRIS PILATUS3 S 6M |
| Wavelength(s) | 0.98011 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 69.440, 59.580, 70.940 |
| Unit cell angles | 90.00, 107.70, 90.00 |
Refinement procedure
| Resolution | 44.690 - 2.500 |
| R-factor | 0.1867 |
| Rwork | 0.184 |
| R-free | 0.22770 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6dxb |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.460 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.18.2_3874) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 44.690 | 2.600 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rmeas | 0.587 | |
| Number of reflections | 19257 | 2127 |
| <I/σ(I)> | 9.23 | |
| Completeness [%] | 99.6 | 99.6 |
| Redundancy | 3.36 | |
| CC(1/2) | 0.997 | 0.818 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8 | 293 | 5 mg/ml protein, 0.15 M potassium bromide, 30 % polyethylene glycol mono-methyl ether 2000 |
