2C4U
Crystal structure of the apo form of the 5'-Fluoro-5'-deoxyadenosine synthase enzyme from Streptomyces cattleya
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID29 |
Synchrotron site | ESRF |
Beamline | ID29 |
Temperature [K] | 130 |
Detector technology | CCD |
Collection date | 2005-08-31 |
Detector | ADSC CCD |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 103.911, 128.064, 146.497 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 96.230 - 2.500 |
R-factor | 0.218 |
Rwork | 0.215 |
R-free | 0.27300 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1rqr |
RMSD bond length | 0.012 |
RMSD bond angle | 1.427 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 73.320 | 2.640 |
High resolution limit [Å] | 2.500 | 2.500 |
Rmerge | 0.110 | 0.640 |
Number of reflections | 67793 | |
<I/σ(I)> | 12.2 | 3.6 |
Completeness [%] | 99.5 | 99.9 |
Redundancy | 3.6 | 3.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 4 | 0.2 M SODIUM THIOCYANATE 20% W/V PEG 3350, pH 4.00 |