1S12
Crystal structure of TM1457
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 5.0.2 |
| Synchrotron site | ALS |
| Beamline | 5.0.2 |
| Temperature [K] | 90 |
| Detector technology | CCD |
| Collection date | 2002-07-05 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 0.97960 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 50.890, 63.280, 65.500 |
| Unit cell angles | 90.00, 108.01, 90.00 |
Refinement procedure
| Resolution | 19.980 - 2.000 |
| R-factor | 0.214 |
| Rwork | 0.214 |
| R-free | 0.27600 |
| Structure solution method | SAD |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.400 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | SOLVE |
| Refinement software | CNS (1.0) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.400 | 2.030 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Number of reflections | 26634 | |
| Completeness [%] | 98.1 | 94.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 295 | 1.4M NaCitrate, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 295K |
