2A3W
Decameric structure of human serum amyloid P-component bound to Bis-1,2-{[(Z)-2-carboxy-2-methyl-1,3-dioxane]-5-yloxycarbamoyl}-ethane
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 8.3.1 |
Synchrotron site | ALS |
Beamline | 8.3.1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2004-04-21 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 1.115879 |
Spacegroup name | P 1 |
Unit cell lengths | 96.712, 105.325, 146.007 |
Unit cell angles | 86.53, 78.15, 76.78 |
Refinement procedure
Resolution | 100.000 - 2.200 |
R-factor | 0.19005 |
Rwork | 0.188 |
R-free | 0.22930 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1lgn |
RMSD bond length | 0.007 |
RMSD bond angle | 1.122 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | REFMAC (5.1.24) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 60.000 | 2.280 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.043 | |
Number of reflections | 269382 | |
<I/σ(I)> | 15.5 | 3.2 |
Completeness [%] | 97.1 | 95.6 |
Redundancy | 2 | 1.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 294 | PEG 4000, PEG 400, sodium acetate, calcium acetate, sorbitol, pH 5.5, VAPOR DIFFUSION, HANGING DROP, temperature 294K |