7E4O
Class I Pimarane-Type Diterpene Synthases from Actinomycetes
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL19U1 |
Synchrotron site | SSRF |
Beamline | BL19U1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2019-06-09 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.97918 |
Spacegroup name | P 42 21 2 |
Unit cell lengths | 89.013, 89.013, 70.634 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 27.360 - 2.500 |
R-factor | 0.228 |
Rwork | 0.223 |
R-free | 0.27590 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 7e4n |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX (1.17.1_3660) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.000 | 2.590 |
High resolution limit [Å] | 2.500 | 2.500 |
Rmerge | 0.084 | 0.515 |
Number of reflections | 10288 | 1001 |
<I/σ(I)> | 45 | 4.8 |
Completeness [%] | 100.0 | |
Redundancy | 25.8 | 25.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 289 | 15% v/v Tacsimate TM pH 7.0, 0.1M HEPES pH 7.0, 2% w/v Polyethylene glycol 3350 |