7XKA
Structure of human beta2 adrenergic receptor bound to constrained epinephrine
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SPRING-8 BEAMLINE BL32XU |
Synchrotron site | SPring-8 |
Beamline | BL32XU |
Temperature [K] | 80 |
Detector technology | PIXEL |
Collection date | 2018-07-15 |
Detector | DECTRIS EIGER X 9M |
Wavelength(s) | 1.000 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 49.600, 66.560, 302.720 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 19.960 - 3.100 |
R-factor | 0.2309 |
Rwork | 0.226 |
R-free | 0.27240 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4lde |
RMSD bond length | 0.003 |
RMSD bond angle | 0.539 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHENIX |
Refinement software | PHENIX (1.17.1_3660) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 19.960 | 3.200 |
High resolution limit [Å] | 3.100 | 3.100 |
Number of reflections | 18898 | 1618 |
<I/σ(I)> | 6.73 | |
Completeness [%] | 99.0 | 97.2 |
Redundancy | 11.3 | |
CC(1/2) | 0.983 | 0.598 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | LIPIDIC CUBIC PHASE | 293 | 100mM Tris-HCl, pH 8.0, 150-200mM lithium acetate, 43-45% PEG400 |