4M5F
complex structure of Tse3-Tsi3
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL17U |
| Synchrotron site | SSRF |
| Beamline | BL17U |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-06-13 |
| Detector | ADSC QUANTUM 315r |
| Spacegroup name | P 41 21 2 |
| Unit cell lengths | 92.242, 92.242, 169.765 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 33.340 - 2.500 |
| R-factor | 0.197 |
| Rwork | 0.193 |
| R-free | 0.24400 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4m5e |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.154 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | SOLVE |
| Refinement software | PHENIX ((phenix.refine: 1.6.4_486)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.590 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Number of reflections | 26198 | |
| Completeness [%] | 85.0 | 95 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7.8 | 293 | 0.8M Na2HPO4/KH2PO4, pH 7.8, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
