1XDC
Hydrogen Bonding in Human Manganese Superoxide Dismutase containing 3-Fluorotyrosine
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 8.3.1 |
| Synchrotron site | ALS |
| Beamline | 8.3.1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2003-07-20 |
| Detector | ADSC QUANTUM 315 |
| Spacegroup name | P 21 21 2 |
| Unit cell lengths | 74.036, 75.419, 67.818 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 41.600 - 1.850 |
| R-factor | 0.212 |
| Rwork | 0.212 |
| R-free | 0.25200 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1n0j |
| RMSD bond length | 0.005 |
| RMSD bond angle | 1.200 |
| Data reduction software | XFIT |
| Data scaling software | SCALEPACK |
| Refinement software | CNS (1.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 41.680 | 1.970 |
| High resolution limit [Å] | 1.850 | 1.850 |
| Number of reflections | 32365 | |
| Completeness [%] | 97.8 | 94.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7.8 | 293 | 25 MM K2HPO4 AND 22% POLY (ETHYLENE GLYCOL) (PEG) 2000 MONOMETHYL ETHER, PH 7.8, VAPOR DIFFUSION, SITTING DROP, temperature 293K, pH 7.80 |
