5AYG
Crystal Structure of the Human ROR gamma Ligand Binding Domain With 3g
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE BL-17A |
| Synchrotron site | Photon Factory |
| Beamline | BL-17A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2009-02-19 |
| Detector | ADSC QUANTUM 270 |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 61 |
| Unit cell lengths | 99.240, 99.240, 127.840 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 85.940 - 2.600 |
| R-factor | 0.18578 |
| Rwork | 0.184 |
| R-free | 0.22673 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3bow |
| RMSD bond length | 0.012 |
| RMSD bond angle | 2.052 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0107) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 85.940 | 2.740 |
| High resolution limit [Å] | 2.600 | 2.600 |
| Rmerge | 0.057 | 0.309 |
| Number of reflections | 22021 | |
| <I/σ(I)> | 29.7 | 6.6 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 10.6 | 7.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 293 | 0.1M Tris-HCl , pH 7.5, 0.5M Na/K tartrate, 2.5M, MPD |
