2X1H
Crystal structure of the human MGC45594 gene product in complex with raloxifene
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I02 |
| Synchrotron site | Diamond |
| Beamline | I02 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2009-12-09 |
| Detector | ADSC CCD |
| Spacegroup name | P 1 |
| Unit cell lengths | 46.650, 52.040, 75.440 |
| Unit cell angles | 94.32, 91.44, 102.24 |
Refinement procedure
| Resolution | 40.500 - 1.750 |
| R-factor | 0.2102 |
| Rwork | 0.208 |
| R-free | 0.24300 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2wek |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.731 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 40.500 | 1.840 |
| High resolution limit [Å] | 1.750 | 1.750 |
| Rmerge | 0.100 | 0.580 |
| Number of reflections | 64609 | |
| <I/σ(I)> | 10 | 2.2 |
| Completeness [%] | 92.7 | 92.8 |
| Redundancy | 3.9 | 3.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 1.6M NA MALONATE PH7.0, 1% W/V JEFFAMINE ED 2001, 0.1M HEPES PH 8.0 |
