1UXL
I113T mutant of human SOD1
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SRS BEAMLINE PX14.2 |
| Synchrotron site | SRS |
| Beamline | PX14.2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2002-11-15 |
| Detector | ADSC CCD |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 166.042, 203.546, 144.021 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 20.000 - 1.600 |
| R-factor | 0.172 |
| Rwork | 0.170 |
| R-free | 0.18800 * |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1hl5 |
| RMSD bond length | 0.016 * |
| RMSD bond angle | 1.600 * |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.0) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.660 |
| High resolution limit [Å] | 1.600 | 1.600 |
| Rmerge | 0.051 | 0.420 * |
| Number of reflections | 317774 | |
| <I/σ(I)> | 15 | 3 |
| Completeness [%] | 99.6 | 99.7 |
| Redundancy | 10 | 5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | Vapor diffusion, hanging drop * | 7.5 | 100 MM NACL, 2.4M AMMONIUM SULPHATE PH 7.5 |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | drop | protein | 10 (mg/ml) | |
| 2 | 1 | reservoir | PEG2000 | 15 (%) | |
| 3 | 1 | reservoir | calcium acetate | 0.2 (M) | |
| 4 | 1 | reservoir | ammonium sulfate | 2.4 (M) | |
| 5 | 1 | reservoir | 100 (mM) | ||
| 6 | 1 | reservoir | Tris-HCl | 100 (mM) | pH7.5 |
