1W3Z
SeMet derivative of BbCRASP-1 from Borrelia Burgdorferi
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID29 |
Synchrotron site | ESRF |
Beamline | ID29 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2003-10-10 |
Detector | ADSC CCD |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 91.558, 91.558, 146.517 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 76.700 - 3.200 |
R-factor | 0.239 |
Rwork | 0.239 |
Structure solution method | MAD |
RMSD bond length | 0.011 |
RMSD bond angle | 1.013 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | HYSS |
Refinement software | TNT (5.6) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 73.300 | 3.370 |
High resolution limit [Å] | 3.200 | 3.200 |
Rmerge | 0.090 | 0.420 |
Number of reflections | 10849 | |
<I/σ(I)> | 4 | 1.8 |
Completeness [%] | 100.0 | 100 |
Redundancy | 7.6 | 7.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6 | 25% PEG600 200 MM IMIDAZOLE PH 6.0 5% GLYCEROL |