6I67
Crystal structure of human ERRg LBD in complex with tetrahydro-2-naphtol
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID30B |
| Synchrotron site | ESRF |
| Beamline | ID30B |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-04-10 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.9798 |
| Spacegroup name | P 41 21 2 |
| Unit cell lengths | 64.085, 64.085, 133.800 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 45.315 - 1.750 |
| R-factor | 0.1727 |
| Rwork | 0.171 |
| R-free | 0.20840 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2zbs |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.891 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHENIX |
| Refinement software | PHENIX ((1.12_2829: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 45.315 | 1.840 |
| High resolution limit [Å] | 1.750 | 1.750 |
| Rmeas | 0.082 | 0.559 |
| Number of reflections | 53683 | 4120 |
| <I/σ(I)> | 17.7 | 4.2 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 12.2 | 12.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 8.5 | 293 | 0-100 mM Sodium acetate 100 mM Tris 23-26% PEG8000 |
