2HDA
Yes 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 | 2006-01-30 |
Detector | BRUKER SMART 6500 |
Wavelength(s) | 1.54 |
Spacegroup name | P 63 2 2 |
Unit cell lengths | 46.009, 46.009, 90.431 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 14.860 - 1.900 |
R-factor | 0.21619 |
Rwork | 0.214 |
R-free | 0.26969 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1fyn |
RMSD bond length | 0.011 |
RMSD bond angle | 2.065 |
Phasing software | MOLREP |
Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.950 |
High resolution limit [Å] | 1.810 | 1.810 |
Rmerge | 0.047 | 0.238 |
Number of reflections | 5626 | |
<I/σ(I)> | 28.37 | 5.19 |
Completeness [%] | 99.3 | 97.5 |
Redundancy | 10.08 | 4.19 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 9 | 288 | 1.6 M ammonium sulphate, 0.1 M bicine, pH 9.0, VAPOR DIFFUSION, HANGING DROP, temperature 15K, temperature 288K |