3TV8
Pharmacological Chaperoning in Human alpha-Galactosidase
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X6A |
Synchrotron site | NSLS |
Beamline | X6A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-10-16 |
Detector | ADSC QUANTUM 210 |
Wavelength(s) | 0.9793 |
Spacegroup name | P 32 2 1 |
Unit cell lengths | 90.465, 90.465, 216.544 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 44.540 - 2.639 |
R-factor | 0.2033 |
Rwork | 0.201 |
R-free | 0.23880 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 3hg2 |
RMSD bond length | 0.008 |
RMSD bond angle | 1.155 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.690 |
High resolution limit [Å] | 2.639 | 2.639 |
Rmerge | 0.172 | 0.685 |
Number of reflections | 31099 | |
<I/σ(I)> | 3.9 | |
Completeness [%] | 99.8 | 99.8 |
Redundancy | 5.8 | 5.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 4.6 | 293 | 20% PEG 4000, 200mM Ammonium Sulfate, 100mM Sodium Acetate, pH 4.6, vapor diffusion, hanging drop, temperature 293K |