1DGP
ARISTOLOCHENE SYNTHASE FARNESOL COMPLEX
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X12B |
Synchrotron site | NSLS |
Beamline | X12B |
Temperature [K] | 123 |
Detector technology | CCD |
Collection date | 1999-03-25 |
Detector | ADSC QUANTUM 4 |
Spacegroup name | I 4 2 2 |
Unit cell lengths | 208.200, 208.200, 139.600 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 20.000 - 2.800 |
R-factor | 0.235 |
Rwork | 0.234 |
R-free | 0.26400 |
RMSD bond length | 0.007 |
RMSD bond angle | 1.100 * |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | PHASES |
Refinement software | CNS |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 2.960 |
High resolution limit [Å] | 2.800 | 2.810 |
Rmerge | 0.101 | 0.402 |
Total number of observations | 157067 * | |
Number of reflections | 47681 | |
<I/σ(I)> | 11.5 | |
Completeness [%] | 93.7 | 95.2 |
Redundancy | 3.3 | 3.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | unknown * | 8 | 277 | This particular structure is not described in this paper. * |
1 | unknown * | 8 | 277 | This particular structure is not described in this paper. * |