6WMS
Crystal Structure of Human REV-ERBbeta Ligand Binding Domain Co-Bound to Heme and NCoR ID2 Peptide
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 5.0.2 |
| Synchrotron site | ALS |
| Beamline | 5.0.2 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2019-09-09 |
| Detector | DECTRIS PILATUS3 S 6M |
| Wavelength(s) | 0.97741 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 55.586, 73.400, 59.673 |
| Unit cell angles | 90.00, 101.91, 90.00 |
Refinement procedure
| Resolution | 43.699 - 2.000 |
| R-factor | 0.1913 |
| Rwork | 0.188 |
| R-free | 0.23950 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3cqv |
| RMSD bond length | 0.008 |
| RMSD bond angle | 0.892 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.11.1_2575) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 44.000 | 2.070 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.313 | |
| Number of reflections | 31527 | 31527 |
| <I/σ(I)> | 10.44 | 1.94 |
| Completeness [%] | 99.1 | 98.93 |
| Redundancy | 2 | |
| CC(1/2) | 1.000 | 0.754 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 295 | 0.2 M Mg formate dihydrate, 20% w/v PEG 3350 |
