3G01
Structure of GrC mutant E192R/E193G
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 17-ID |
| Synchrotron site | APS |
| Beamline | 17-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2006-05-02 |
| Detector | ADSC QUANTUM 210 |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 61 |
| Unit cell lengths | 71.375, 71.375, 207.171 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 59.230 - 2.500 |
| R-factor | 0.213 |
| Rwork | 0.212 |
| R-free | 0.23600 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1a1u |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.345 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA (3.2.17) |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 61.812 | 61.810 | 2.640 |
| High resolution limit [Å] | 2.496 | 7.910 | 2.500 |
| Rmerge | 0.067 | 0.032 | 0.716 |
| Total number of observations | 2777 | 13433 | |
| Number of reflections | 20089 | ||
| <I/σ(I)> | 9.362 | 17.9 | 1.1 |
| Completeness [%] | 97.6 | 93.8 | 98.6 |
| Redundancy | 4.6 | 4.5 | 4.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.6 | 298 | 0.2M ammonium sulfate, 0.25g/ml PEG 3350, 0.1M sodium cacodylate, pH 6.6, vapor diffusion, hanging drop, temperature 298K |
