1FDT
HUMAN 17-BETA-HYDROXYSTEROID-DEHYDROGENASE TYPE 1 COMPLEXED WITH ESTRADIOL AND NADP+
Experimental procedure
| Source type | ROTATING ANODE |
| Source details | RIGAKU RUH2R |
| Temperature [K] | 130 |
| Detector technology | AREA DETECTOR |
| Collection date | 1995-02 |
| Detector | XENTRONICS |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 122.770, 43.790, 60.530 |
| Unit cell angles | 90.00, 99.47, 90.00 |
Refinement procedure
| Resolution | 10.000 - 2.200 |
| R-factor | 0.193 |
| Rwork | 0.193 |
| R-free | 0.24300 |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.630 * |
| Data reduction software | XENGEN (V. 2.0) |
| Data scaling software | XENGEN (V. 2.0) |
| 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] | 2.150 | 2.150 |
| Rmerge | 0.058 * | |
| Total number of observations | 29073 * | |
| Number of reflections | 13157 | |
| <I/σ(I)> | 14.8 | 2 |
| Completeness [%] | 73.6 | |
| Redundancy | 2.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | Vapor diffusion, hanging drop * | Zhu, D.-W., (1993) J. Mol. Biol., 234, 242. * |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | drop | enzyme | 10 (mg/ml) | |
| 2 | 1 | drop | beta-octylglucoside | 2 (mM) | |
| 3 | 1 | drop | glycerol | 20 (%) | |
| 4 | 1 | reservoir | HEPES | 100 (mM) | |
| 5 | 1 | reservoir | 100 (mM) | ||
| 6 | 1 | reservoir | PEG4000 | 24-26 (%) |
