1SN5
Crystal Structure of Sea Bream Transthyretin in complex with Triiodothyronine at 1.90A Resolution
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | EMBL/DESY, HAMBURG BEAMLINE X11 |
| Synchrotron site | EMBL/DESY, HAMBURG |
| Beamline | X11 |
| Temperature [K] | 100 |
| Spacegroup name | P 41 |
| Unit cell lengths | 58.284, 58.284, 138.904 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 19.760 - 1.900 |
| R-factor | 0.17658 |
| Rwork | 0.173 |
| R-free | 0.21081 |
| Structure solution method | FOURIER SYNTHESIS |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.444 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | CNS |
| Refinement software | REFMAC (5.0) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 1.970 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Rmerge | 0.054 | 0.434 |
| Number of reflections | 36032 | |
| Completeness [%] | 98.8 | 96.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5 | 296 | PEG 1550 MME, sodium citrate, ammonium sulphate, nickel sulphate, crystals were soaked in triiodothyronine, pH 5.0, VAPOR DIFFUSION, HANGING DROP, temperature 296K |
