5F8U
Ligand occupancy in crystal structure of beta1-adrenergic receptor previously submitted by Huang et al
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X25 |
Synchrotron site | NSLS |
Beamline | X25 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Detector | PSI PILATUS 6M |
Wavelength(s) | 1.0 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 229.660, 79.590, 69.040 |
Unit cell angles | 90.00, 101.83, 90.00 |
Refinement procedure
Resolution | 67.570 - 3.350 |
R-factor | 0.34617 |
Rwork | 0.344 |
R-free | 0.38165 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4gpo |
RMSD bond length | 0.013 |
RMSD bond angle | 1.629 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Refinement software | REFMAC (5.8.0047) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 67.570 | 3.440 |
High resolution limit [Å] | 3.350 | 3.350 |
Rmerge | 0.141 | |
Number of reflections | 17463 | |
<I/σ(I)> | 6.3 | 1.7 |
Completeness [%] | 98.2 | 97 |
Redundancy | 4.3 | 4.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 |