7E4M
Class I Pimarane-Type Diterpene Synthases Stt4548
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL17U1 |
Synchrotron site | SSRF |
Beamline | BL17U1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2019-11-15 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.97918 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 66.870, 64.908, 70.583 |
Unit cell angles | 90.00, 108.75, 90.00 |
Refinement procedure
Resolution | 66.840 - 1.570 |
R-factor | 0.1804 |
Rwork | 0.179 |
R-free | 0.20890 |
Structure solution method | SAD |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | AutoSol |
Refinement software | PHENIX (1.17.1_3660) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 66.840 | 1.680 |
High resolution limit [Å] | 1.570 | 1.580 |
Rmerge | 0.067 | |
Rpim | 0.468 | |
Number of reflections | 31104 | 1555 |
<I/σ(I)> | 13.4 | |
Completeness [%] | 90.0 | |
Redundancy | 6.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 289 | 0.1M Sodium chloride, 0.1M BIS-TRIS pH 6.5, 1.5M Ammonium sulfate |