4BEU
Structure of Vibrio cholerae broad spectrum racemase
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 | 2011-06-16 |
Detector | DECTRIS PILATUS 6M |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 96.621, 51.093, 76.731 |
Unit cell angles | 90.00, 101.15, 90.00 |
Refinement procedure
Resolution | 47.399 - 1.150 |
R-factor | 0.1641 |
Rwork | 0.163 |
R-free | 0.17310 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2rjg |
RMSD bond length | 0.010 |
RMSD bond angle | 1.325 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 47.300 | 1.210 |
High resolution limit [Å] | 1.150 | 1.150 |
Rmerge | 0.050 | 0.210 |
Number of reflections | 128145 | |
<I/σ(I)> | 11.5 | 4.3 |
Completeness [%] | 98.5 | 98.5 |
Redundancy | 3.3 | 3.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 7.5 | 0.1M BIS-TRIS PROPANE PH 7.5, 0.2 M SODIUM IODIDE, 20% PEG 3350 |