6QZM
H30 MnSOD-3 Mutant I
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I02 |
| Synchrotron site | Diamond |
| Beamline | I02 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2013-04-29 |
| Detector | DECTRIS PILATUS3 S 6M |
| Wavelength(s) | 0.97 |
| Spacegroup name | P 41 21 2 |
| Unit cell lengths | 81.490, 81.490, 138.660 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 40.740 - 1.600 |
| R-factor | 0.18922 |
| Rwork | 0.188 |
| R-free | 0.20596 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3dc5 |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.331 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 40.740 | 1.641 |
| High resolution limit [Å] | 1.600 | 1.600 |
| Rmerge | 0.067 | |
| Number of reflections | 59113 | 3872 |
| <I/σ(I)> | 14.7 | |
| Completeness [%] | 100.0 | |
| Redundancy | 6.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | bicine ammonium sulfate |
