1DHT
ESTROGENIC 17-BETA HYDROXYSTEROID DEHYDROGENASE COMPLEXED DIHYDROTESTOSTERONE
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X12C |
| Synchrotron site | NSLS |
| Beamline | X12C |
| Temperature [K] | 100 |
| Collection date | 1997-02 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 123.660, 45.190, 61.300 |
| Unit cell angles | 90.00, 99.10, 90.00 |
Refinement procedure
| Resolution | 8.000 - 2.240 |
| R-factor | 0.189 * |
| Rwork | 0.188 |
| R-free | 0.27800 * |
| Structure solution method | DIFFERENCE FOURIER |
| Starting model (for MR) | 1iol |
| RMSD bond length | 0.010 * |
| RMSD bond angle | 1.460 * |
| Data scaling software | SCALEPACK |
| Phasing software | X-PLOR (3.1) |
| Refinement software | X-PLOR (3.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 40.000 | 2.340 |
| High resolution limit [Å] | 2.240 * | 2.240 |
| Rmerge | 0.038 | 0.041 |
| Total number of observations | 39772 * | |
| Number of reflections | 14692 | |
| Completeness [%] | 97.0 | 96 |
| Redundancy | 2.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | Vapor diffusion, hanging drop * | 7.5 * | pH 7.20 |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | reservoir | PEG4000 | 30 (%) | |
| 2 | 1 | reservoir | beta-octylglucoside | 0.06 (%(w/v)) | |
| 3 | 1 | reservoir | 0.12 (M) | ||
| 4 | 1 | reservoir | HEPES | 0.1 (M) | |
| 5 | 1 | drop | protain | 1 (mM) | saturating |
