3KJ6
Crystal structure of a Methylated beta2 Adrenergic Receptor-Fab complex
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 23-ID-B |
| Synchrotron site | APS |
| Beamline | 23-ID-B |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2008-08-04 |
| Detector | MARRESEARCH |
| Wavelength(s) | 1.0 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 338.600, 48.600, 88.900 |
| Unit cell angles | 90.00, 104.40, 90.00 |
Refinement procedure
| Resolution | 44.409 - 3.400 |
| R-factor | 0.242 |
| Rwork | 0.238 |
| R-free | 0.28000 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.669 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER |
| Refinement software | PHENIX |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 3.520 |
| High resolution limit [Å] | 3.400 | 7.320 | 3.400 |
| Rmerge | 0.117 | 0.062 | 0.383 |
| Number of reflections | 19946 | ||
| <I/σ(I)> | 6.5 | ||
| Completeness [%] | 98.2 | 98.1 | 90.2 |
| Redundancy | 5.4 | 5.7 | 3.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | bicelles, vapor diffusion | 7 | 298 | AmSO4, pH 7, bicelles, vapor diffusion, temperature 298K |
