4A7T
Structure of human I113T SOD1 mutant complexed with isoproteranol in the p21 space group
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SOLEIL BEAMLINE PROXIMA 1 |
Synchrotron site | SOLEIL |
Beamline | PROXIMA 1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-05-10 |
Detector | ADSC QUANTUM 315r |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 37.890, 68.020, 49.310 |
Unit cell angles | 90.00, 103.95, 90.00 |
Refinement procedure
Resolution | 39.140 - 1.450 |
R-factor | 0.15827 |
Rwork | 0.157 |
R-free | 0.18774 |
Structure solution method | OTHER |
Starting model (for MR) | NONE |
RMSD bond length | 0.016 |
RMSD bond angle | 1.620 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | REFMAC |
Refinement software | REFMAC (5.5.0102) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 39.200 | 1.540 |
High resolution limit [Å] | 1.450 | 1.450 |
Rmerge | 0.050 | 0.260 |
Number of reflections | 42297 | |
<I/σ(I)> | 15.21 | 4.34 |
Completeness [%] | 98.0 | 94.2 |
Redundancy | 3.6 | 3.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 5 | 100 MM SODIUM ACETATE PH 5, 150 MM SODIUM CHLORIDE, 2.5 AMMONIUM SULPHATE |