6DTK
Heterodimers of FALS mutant SOD enzyme
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX1 |
Synchrotron site | Australian Synchrotron |
Beamline | MX1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2013-02-17 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.953700 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 162.699, 201.671, 143.834 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 47.570 - 2.000 |
R-factor | 0.158 |
Rwork | 0.156 |
R-free | 0.19000 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1fun |
RMSD bond length | 0.013 |
RMSD bond angle | 1.361 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0230) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 47.570 | 2.050 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.086 | 0.871 |
Number of reflections | 158995 | |
<I/σ(I)> | 25.25 | 2.47 |
Completeness [%] | 99.9 | 98.9 |
Redundancy | 14.2 | 13.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 298 | 2-3 M Ammonium sulfate or Sodium malonate |