1UNF
The crystal structure of the eukaryotic FeSOD from Vigna unguiculata suggests a new enzymatic mechanism
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE BM14 |
Synchrotron site | ESRF |
Beamline | BM14 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2002-11-15 |
Detector | MARRESEARCH |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 81.985, 48.163, 63.671 |
Unit cell angles | 90.00, 119.76, 90.00 |
Refinement procedure
Resolution | 28.770 - 1.970 |
R-factor | 0.15 |
Rwork | 0.148 |
R-free | 0.19200 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1dt0 |
RMSD bond length | 0.014 |
RMSD bond angle | 1.585 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | EPMR |
Refinement software | REFMAC (5.2.0005) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 1.900 |
High resolution limit [Å] | 1.800 | 1.800 |
Rmerge | 0.100 | 0.770 |
Number of reflections | 20443 | |
<I/σ(I)> | 6.2 | 0.9 |
Completeness [%] | 99.0 | 99 |
Redundancy | 3.3 | 3.1 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 5 | 200 MM AMMONIUM SULFATE, 100 MM SODIUM ACETATE PH 5.0, 25%(W/V) POLYETHYLENE GLYCOL 4000 |