2F2H
Structure of the YicI thiosugar Michaelis complex
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 8.2.2 |
| Synchrotron site | ALS |
| Beamline | 8.2.2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2005-04-01 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 0.95516 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 162.317, 175.841, 210.742 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 28.640 - 1.950 |
| R-factor | 0.182 |
| Rwork | 0.180 |
| R-free | 0.22500 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1xsi |
| RMSD bond length | 0.018 |
| RMSD bond angle | 1.748 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | CNS |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 28.640 | 2.060 |
| High resolution limit [Å] | 1.950 | 1.950 |
| Rmerge | 0.097 | 0.433 |
| Number of reflections | 375731 | |
| <I/σ(I)> | 7.3 | 1.7 |
| Completeness [%] | 86.5 | 88.9 |
| Redundancy | 3.4 | 3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 288 | 10 mg/ml protein, 100mM Na Acetate, pH 6.5, 2M Ammonium Sulphate , VAPOR DIFFUSION, HANGING DROP, temperature 288K |
