3EGU
Crystal structure of the N114A mutant of ABL-SH3 domain
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | BRUKER AXS MICROSTAR |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2006-02-02 |
Detector | BRUKER SMART 6000 |
Wavelength(s) | 1.54 |
Spacegroup name | P 32 1 2 |
Unit cell lengths | 51.350, 51.350, 46.386 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 13.610 - 2.250 |
R-factor | 0.222 |
Rwork | 0.220 |
R-free | 0.26700 |
RMSD bond length | 0.012 |
RMSD bond angle | 2.102 |
Data reduction software | DENZO |
Data scaling software | SAINT |
Phasing software | MOLREP |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 44.470 | 2.250 |
High resolution limit [Å] | 2.150 | 2.150 |
Rmerge | 0.053 | 0.303 |
Number of reflections | 3936 | |
<I/σ(I)> | 3.97 | |
Completeness [%] | 99.9 | 100 |
Redundancy | 8.85 | 4.07 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 288 | 2M ammonium sulphate, 5% PEG300, 10% glycerol, and 0.1 M of buffer solution, pH 7, vapor diffusion, hanging drop, temperature 288K |