6E5L
Crystal structure of human cellular retinol binding protein 1 in complex with abnormal-cannabidiol (abn-CBD)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 24-ID-C |
Synchrotron site | APS |
Beamline | 24-ID-C |
Temperature [K] | 80 |
Detector technology | CCD |
Collection date | 2017-11-05 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.9791 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 37.219, 40.890, 92.139 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 46.070 - 1.170 |
R-factor | 0.1198 |
Rwork | 0.118 |
R-free | 0.14600 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5h8t |
RMSD bond length | 0.007 |
RMSD bond angle | 0.916 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | PHENIX ((1.10.1_2155: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 46.070 | 1.190 |
High resolution limit [Å] | 1.170 | 1.170 |
Rpim | 0.050 | |
Number of reflections | 47869 | 2384 |
<I/σ(I)> | 11.6 | 5.5 |
Completeness [%] | 99.3 | 99.5 |
Redundancy | 5.8 | |
CC(1/2) | 0.990 | 0.690 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5.5 | 295 | 0.1 M BisTris, pH 5.5, and 25% PEG 3350 |