3T84
Human Carbonic Anhydrase II in complex with Acetylated Carbohydrate Sulfamates
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX1 |
Synchrotron site | Australian Synchrotron |
Beamline | MX1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-07-28 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.95375 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 42.460, 41.430, 72.080 |
Unit cell angles | 90.00, 104.70, 90.00 |
Refinement procedure
Resolution | 24.664 - 2.000 |
R-factor | 0.1613 |
Rwork | 0.159 |
R-free | 0.20640 |
Structure solution method | FOURIER SYNTHESIS |
RMSD bond length | 0.007 |
RMSD bond angle | 1.145 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHENIX |
Refinement software | PHENIX ((phenix.refine: 1.4_118)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 25.000 | 2.110 |
High resolution limit [Å] | 2.000 | 2.000 |
Number of reflections | 31909 | |
Completeness [%] | 100.0 | 99.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 9.5 | 289 | 2.9M (NH4)2SO4, 0.1M Glycine, pH 9.5, VAPOR DIFFUSION, HANGING DROP, temperature 289K |