3S9V
abietadiene synthase from Abies grandis
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-D |
Synchrotron site | APS |
Beamline | 21-ID-D |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2009-10-30 |
Detector | MARMOSAIC 300 mm CCD |
Wavelength(s) | 0.9792 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 92.840, 189.085, 99.895 |
Unit cell angles | 90.00, 91.45, 90.00 |
Refinement procedure
Resolution | 50.000 - 2.300 |
Rwork | 0.197 |
R-free | 0.25090 |
Structure solution method | SAD, MOLECULAR REPLACEMENT |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | PHASER (2.1.4) |
Refinement software | CNS |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 2.340 |
High resolution limit [Å] | 2.300 | 6.240 | 2.300 |
Rmerge | 0.092 | 0.048 | 0.360 |
Number of reflections | 148465 | ||
<I/σ(I)> | 10.3 | ||
Completeness [%] | 97.7 | 92 | 96.6 |
Redundancy | 3.2 | 3 | 3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.1 | 277 | 25% PEG 8000, 0.1 M sodium citrate, 0.1 M ammonium dibasic phosphate, pH 5.1, VAPOR DIFFUSION, HANGING DROP, temperature 277K |