2VU1
Biosynthetic thiolase from Z. ramigera. Complex of with O-pantheteine- 11-pivalate.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | EMBL/DESY, HAMBURG BEAMLINE BW7A |
Synchrotron site | EMBL/DESY, HAMBURG |
Beamline | BW7A |
Temperature [K] | 100 |
Detector technology | CCD |
Detector | MARRESEARCH |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 84.298, 78.737, 148.339 |
Unit cell angles | 90.00, 92.93, 90.00 |
Refinement procedure
Resolution | 20.000 - 1.510 |
R-factor | 0.21574 |
Rwork | 0.215 |
R-free | 0.24726 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.019 |
RMSD bond angle | 1.709 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Refinement software | REFMAC (5.3.0028) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 1.550 |
High resolution limit [Å] | 1.510 | 1.510 |
Rmerge | 0.090 | 0.550 |
Number of reflections | 284637 | |
<I/σ(I)> | 8.7 | 2.1 |
Completeness [%] | 93.8 | 70.1 |
Redundancy | 3.5 | 2.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 5 | pH 5 |