2F2V
alpha-spectrin SH3 domain A56G mutant
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | BRUKER AXS MICROSTAR |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2005-10-05 |
Detector | BRUKER PROTEUM X8 |
Wavelength(s) | 1.54 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 23.932, 41.617, 45.981 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 20.000 - 1.850 |
R-factor | 0.17526 |
Rwork | 0.173 |
R-free | 0.22324 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1shg |
RMSD bond length | 0.009 |
RMSD bond angle | 1.248 |
Data reduction software | SAINT |
Data scaling software | SADABS |
Phasing software | MOLREP |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.000 | 1.950 |
High resolution limit [Å] | 1.850 | 1.850 |
Rmerge | 0.027 | 0.079 |
Number of reflections | 3983 | |
<I/σ(I)> | 31.37 | 11.5 |
Completeness [%] | 93.7 | 70.4 |
Redundancy | 3.32 | 1.17 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6.5 | 288 | 2M Sodium Formiate, 0.1 M MES, pH 6.5, VAPOR DIFFUSION, SITTING DROP, temperature 288K |