2V8D
Crystal structure of mutant E159A of beta-alanine synthase from Saccharomyces kluyveri
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID14-4 |
Synchrotron site | ESRF |
Beamline | ID14-4 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-05-07 |
Detector | ADSC CCD |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 61.117, 77.143, 108.228 |
Unit cell angles | 90.00, 97.12, 90.00 |
Refinement procedure
Resolution | 45.220 - 2.300 |
R-factor | 0.232 |
Rwork | 0.230 |
R-free | 0.27600 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1r43 |
RMSD bond length | 0.010 |
RMSD bond angle | 1.131 |
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] | 50.000 | 2.400 |
High resolution limit [Å] | 2.300 | 2.300 |
Rmerge | 0.080 | 0.460 |
Number of reflections | 43156 | |
<I/σ(I)> | 11.9 | 2 |
Completeness [%] | 97.0 | 88 |
Redundancy | 3.2 | 2.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6 | 293 | TRISODIUM CITRATE, DIOXANE, ACETONE, DTT, PH 6.0, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 293K |