6KD0
Crystal Structure of Vibralactone Cyclase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL18U1 |
Synchrotron site | SSRF |
Beamline | BL18U1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2019-05-02 |
Detector | DECTRIS PILATUS3 S 6M |
Wavelength(s) | 0.988 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 47.324, 80.234, 59.184 |
Unit cell angles | 90.00, 102.36, 90.00 |
Refinement procedure
Resolution | 50.000 - 1.800 |
Rwork | 0.180 |
R-free | 0.19870 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5lk6 |
Data reduction software | HKL-3000 |
Data scaling software | HKL-3000 |
Phasing software | MOLREP |
Refinement software | REFMAC (5) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.830 |
High resolution limit [Å] | 1.800 | 1.800 |
Rmerge | 0.099 | 0.631 |
Rpim | 0.064 | 0.423 |
Number of reflections | 39851 | 1915 |
<I/σ(I)> | 13.1 | 1.3 |
Completeness [%] | 100.0 | 100 |
Redundancy | 3.3 | 3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 20% PEG 3350 |