1JE1
5'-DEOXY-5'-METHYLTHIOADENOSINE PHOSPHORYLASE COMPLEX WITH GUANOSINE AND SULFATE
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | CHESS BEAMLINE A1 |
| Synchrotron site | CHESS |
| Beamline | A1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 0.9023 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 101.800, 87.600, 101.800 |
| Unit cell angles | 90.00, 119.99, 90.00 |
Refinement procedure
| Resolution | 20.000 - 1.800 |
| R-factor | 0.217 * |
| Rwork | 0.217 |
| R-free | 0.23700 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | native complex |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.218 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | CNS |
| Refinement software | CNS |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rmerge | 0.057 | 0.316 |
| Total number of observations | 543683 * | |
| Number of reflections | 139268 | |
| <I/σ(I)> | 7.4 | 2.3 |
| Completeness [%] | 82.0 | 41.7 |
| Redundancy | 3.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.4 | 291 | used microseeding * |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | drop | protein | 7-10 (mg/ml) | |
| 2 | 1 | reservoir | dioxane | 28-30 (%) | |
| 3 | 1 | reservoir | MPD | 12 (%) | |
| 4 | 1 | reservoir | 0.12 (M) | ||
| 5 | 1 | reservoir | 0.04 (M) | ||
| 6 | 1 | reservoir | Tris-HCl | 0.1 (M) |
