5IHK
Crystal Structure of the alpha spectrin SH3 domain mutant N47A
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALBA BEAMLINE XALOC |
Synchrotron site | ALBA |
Beamline | XALOC |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2015-10-24 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.97949 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 33.550, 42.371, 49.544 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 19.928 - 1.350 |
R-factor | 0.1604 |
Rwork | 0.159 |
R-free | 0.19150 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3m0r |
RMSD bond length | 0.007 |
RMSD bond angle | 0.984 |
Data reduction software | XDS |
Data scaling software | Aimless (0.5.1) |
Phasing software | PHASER |
Refinement software | PHENIX |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 19.930 | 19.930 | 1.370 |
High resolution limit [Å] | 1.350 | 7.390 | 1.350 |
Rmerge | 0.032 | 0.019 | 0.827 |
Number of reflections | 15744 | ||
<I/σ(I)> | 32.1 | ||
Completeness [%] | 97.9 | 95.5 | 97.4 |
Redundancy | 12.1 | 9.5 | 10.6 |
CC(1/2) | 1.000 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5 | 298 | 0.1M Sodium Acetate, 1 M Ammonium sulphate, 1 M Proline |