6RZ8
Crystal structure of the human cysteinyl leukotriene receptor 2 in complex with ONO-2080365
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-1 |
Synchrotron site | ESRF |
Beamline | ID23-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-06-23 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.976250 |
Spacegroup name | I 4 |
Unit cell lengths | 78.440, 78.440, 172.030 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 29.924 - 2.700 |
R-factor | 0.1964 |
Rwork | 0.194 |
R-free | 0.24650 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6rz4 |
RMSD bond length | 0.004 |
RMSD bond angle | 0.748 |
Data reduction software | XDS (20161205) |
Data scaling software | XSCALE (20180319) |
Phasing software | PHASER (1.12-2829) |
Refinement software | PHENIX (1.12-2829) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 30.000 | 2.800 |
High resolution limit [Å] | 2.700 | 2.700 |
Rmerge | 0.239 | 2.758 |
Rpim | 0.066 | 0.766 |
Number of reflections | 14227 | |
<I/σ(I)> | 9.8 | 1.2 |
Completeness [%] | 100.0 | 100 |
Redundancy | 14 | 13.8 |
CC(1/2) | 0.990 | 0.410 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | LIPIDIC CUBIC PHASE | 8 | 293 | 100 mM K Formate 30% v/v PEG400 100 mM TRIS-HCl pH 8.0 |