4UU3
Ferulic acid decarboxylase from Enterobacter sp.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-1 |
| Synchrotron site | ESRF |
| Beamline | ID23-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2013-07-27 |
| Detector | DECTRIS PILATUS |
| Spacegroup name | P 2 21 21 |
| Unit cell lengths | 39.426, 83.833, 133.278 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 39.986 - 1.150 |
| R-factor | 0.1217 |
| Rwork | 0.121 |
| R-free | 0.13300 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3nx2 |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.349 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.200 |
| High resolution limit [Å] | 1.130 | 1.130 |
| Rmerge | 0.070 | 0.700 |
| Number of reflections | 157334 | |
| <I/σ(I)> | 14.2 | 2.4 |
| Completeness [%] | 99.7 | 98.4 |
| Redundancy | 9.1 | 7.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 0.15 M POTASSIUM BROMIDE AND 30% W/V PEG MONOMETHYL ETHER 2000 20MG/ML PROTEIN (IN 100MM MES, L-MALIC ACID, TRIS PH 7.0 AND 250MM NACL) |
