1OO2
Crystal structure of transthyretin from Sparus aurata
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ELETTRA BEAMLINE 5.2R |
Synchrotron site | ELETTRA |
Beamline | 5.2R |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2003-02-08 |
Detector | MARRESEARCH |
Wavelength(s) | 1.2 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 96.452, 65.622, 70.834 |
Unit cell angles | 90.00, 97.40, 90.00 |
Refinement procedure
Resolution | 48.000 * - 1.560 |
R-factor | 0.1973 |
Rwork | 0.197 |
R-free | 0.22300 * |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1f41 |
RMSD bond length | 0.019 |
RMSD bond angle | 0.020 |
Data reduction software | MOSFLM |
Data scaling software | CCP4 ((SCALA)) |
Phasing software | AMoRE |
Refinement software | SHELXL-97 |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.000 * | 1.640 |
High resolution limit [Å] | 1.560 * | 1.560 |
Rmerge | 0.055 | 0.146 * |
Total number of observations | 239286 * | |
Number of reflections | 60660 | |
<I/σ(I)> | 7 | 7 |
Completeness [%] | 97.2 | 89.9 |
Redundancy | 3.9 | 3.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4.6 | 20 * | PEG 400, cadmio chloride, sodium acetate, pH 4.6, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | reservoir | 50 (mM) | ||
2 | 1 | reservoir | sodium acetate | 50 (mM) | |
3 | 1 | reservoir | PEG400 | 15 (%(w/v)) | pH4.6 |