2YLY
Sulfonamides as selective Estrogen Receptor beta Agonists.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS |
| Synchrotron site | APS |
| Temperature [K] | 100 |
| Spacegroup name | I 4 2 2 |
| Unit cell lengths | 116.720, 116.720, 186.660 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 30.000 - 3.200 |
| R-factor | 0.2372 |
| Rwork | 0.235 |
| R-free | 0.27490 |
| Structure solution method | OTHER |
| Starting model (for MR) | NONE |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.250 |
| Refinement software | BUSTER (2.9.6) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 3.500 |
| High resolution limit [Å] | 3.200 | 3.200 |
| Rmerge | 0.080 | |
| Number of reflections | 10980 | |
| Completeness [%] | 100.0 | |
| Redundancy | 6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 |
