2IC1
Crystal Structure of Human Cysteine Dioxygenase in Complex with Substrate Cysteine
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-ID |
| Synchrotron site | APS |
| Beamline | 19-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2006-02-16 |
| Detector | SBC-2 |
| Wavelength(s) | 0.97932 |
| Spacegroup name | P 65 |
| Unit cell lengths | 131.100, 131.100, 34.300 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 42.910 - 2.700 |
| R-factor | 0.181 |
| Rwork | 0.178 |
| R-free | 0.21500 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2atf |
| RMSD bond length | 0.017 |
| RMSD bond angle | 1.900 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | CNS |
| Refinement software | CNS |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.760 |
| High resolution limit [Å] | 2.700 | 2.700 |
| Rmerge | 0.150 | 0.355 |
| Number of reflections | 9527 | |
| <I/σ(I)> | 11.7 | 2.7 |
| Completeness [%] | 99.5 | 96 |
| Redundancy | 5.3 | 3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 289 | 0.1 M Sodium cacodylate, 0.2 M Magnesium chloride, 17.6% PEG 8000, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 289K |
