2W2A
Crystal Structure of p-coumaric Acid Decarboxylase from Lactobacillus plantarum: structural insights into the active site and decarboxylation catalytic mechanism
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 | CCD |
Collection date | 2007-07-21 |
Detector | ADSC CCD |
Spacegroup name | P 43 |
Unit cell lengths | 43.181, 43.181, 232.498 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 40.490 - 1.380 |
R-factor | 0.192 |
Rwork | 0.191 |
R-free | 0.20900 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2gc9 |
RMSD bond length | 0.006 |
RMSD bond angle | 1.022 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 46.500 | 1.450 |
High resolution limit [Å] | 1.380 | 1.380 |
Rmerge | 0.110 | 0.540 |
Number of reflections | 86850 | |
<I/σ(I)> | 13 | 2.8 |
Completeness [%] | 100.0 | 100 |
Redundancy | 7.2 | 7.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 |