4UU2
Ferulic acid decarboxylase from Enterobacter sp., single mutant
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID29 |
Synchrotron site | ESRF |
Beamline | ID29 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2013-12-13 |
Detector | DECTRIS PILATUS 6M |
Spacegroup name | P 2 21 21 |
Unit cell lengths | 39.210, 83.880, 132.020 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 41.940 - 1.490 |
R-factor | 0.1592 |
Rwork | 0.158 |
R-free | 0.17650 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | NATIVE STRUCTURE OF THE SAME PROTEIN |
RMSD bond length | 0.006 |
RMSD bond angle | 1.030 |
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] | 41.900 | 1.590 |
High resolution limit [Å] | 1.490 | 1.490 |
Rmerge | 0.100 | 0.670 |
Number of reflections | 71286 | |
<I/σ(I)> | 11.8 | 2.4 |
Completeness [%] | 98.7 | 93.2 |
Redundancy | 8.4 | 7.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 0.2 M AMMONIUM SULFATE, 0.1 M BIS-TRIS PH 5.5 AND 25 % W/V PEG 3350 20MG/ML PROTEIN (IN 100 MM SUCCINIC ACID, SODIUM DIHYDROGEN PHOSPHATE MONOHYDRATE AND GLYCINE, PH 7.0) |