3U2M
Crystal structure of human ALR mutant C142/145S
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SEALED TUBE |
Source details | OXFORD DIFFRACTION ENHANCE ULTRA |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-11-06 |
Detector | OXFORD ONYX CCD |
Wavelength(s) | 1.541 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 50.400, 76.880, 62.460 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 34.940 - 2.000 |
R-factor | 0.23559 |
Rwork | 0.230 |
R-free | 0.29122 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3o55 |
RMSD bond length | 0.019 |
RMSD bond angle | 1.736 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.000 | 2.100 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.090 | 0.500 |
Number of reflections | 8795 | |
<I/σ(I)> | 7.1 | 1.8 |
Completeness [%] | 93.6 | 93.1 |
Redundancy | 4.5 | 2.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6 | 298 | 0.1 M MES, 20% PEG6000 , pH 6.0, VAPOR DIFFUSION, SITTING DROP, temperature 298K |