Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | CHESS BEAMLINE A1 |
Synchrotron site | CHESS |
Beamline | A1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2003-10-04 |
Detector | CUSTOM (SBC2 3K) |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 148.577, 148.577, 177.239 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 46.230 - 2.900 |
R-factor | 0.169 |
Rwork | 0.167 |
R-free | 0.20600 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1TXV |
RMSD bond length | 0.005 |
RMSD bond angle | 0.925 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | REFMAC (5.3.0037) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 3.000 |
High resolution limit [Å] | 2.900 | 2.900 |
Rmerge | 0.140 | 0.580 |
Number of reflections | 50516 | |
<I/σ(I)> | 12.1 | 2 |
Completeness [%] | 99.8 | 98.2 |
Redundancy | 7 | 6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 277 | 10-12% PEG3350, 0.7 M MAGNESIUM ACETATE, 0.1 M IMIDAZOLE, PH 6.5, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 277K |