4S13
Ferulic Acid Decarboxylase (FDC1)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-ID |
| Synchrotron site | APS |
| Beamline | 19-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2013-11-22 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.979 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 251.963, 120.995, 159.560 |
| Unit cell angles | 90.00, 121.93, 90.00 |
Refinement procedure
| Resolution | 47.049 - 2.348 |
| R-factor | 0.1727 |
| Rwork | 0.171 |
| R-free | 0.21470 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.112 |
| Data reduction software | HKL-3000 |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 2.390 |
| High resolution limit [Å] | 2.348 | 6.370 | 2.350 |
| Rmerge | 0.107 | 0.055 | 0.492 |
| Number of reflections | 162530 | ||
| <I/σ(I)> | 17.2 | ||
| Completeness [%] | 96.1 | 99 | 69.3 |
| Redundancy | 3.7 | 3.7 | 3.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 277 | 100 mM HEPES, pH 7.5; 10% PEG 6000; and 5% MPD, VAPOR DIFFUSION, HANGING DROP, temperature 277K |
