4YAY
XFEL structure of human Angiotensin Receptor
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | FREE ELECTRON LASER |
| Source details | SLAC LCLS BEAMLINE CXI |
| Synchrotron site | SLAC LCLS |
| Beamline | CXI |
| Temperature [K] | 294 |
| Detector technology | PIXEL |
| Collection date | 2014-02-01 |
| Detector | CS-PAD CXI-1 |
| Wavelength(s) | 1.56 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 72.800, 41.000, 167.700 |
| Unit cell angles | 90.00, 99.40, 90.00 |
Refinement procedure
| Resolution | 32.910 - 2.900 |
| R-factor | 0.2306 |
| Rwork | 0.228 |
| R-free | 0.27420 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | GPCR hybrid model |
| RMSD bond length | 0.010 |
| RMSD bond angle | 0.950 |
| Data reduction software | CrystFEL |
| Data scaling software | CrystFEL |
| Phasing software | PHASER |
| Refinement software | BUSTER (2.10.0) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 32.629 | 3.000 |
| High resolution limit [Å] | 2.900 | 2.900 |
| Number of reflections | 11190 | |
| <I/σ(I)> | 8.2 | 0.84 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 1288 | 215 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | LIPIDIC CUBIC PHASE | 5 | 294 | 100 mM sodium citrate, pH 5.0, 450 mM NH4H2PO4, 28% (v/v) PEG400 and 4% (v/v) DMSO |
