5OCH
The crystal structure of human ABCB8 in an outward-facing state
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I24 |
| Synchrotron site | Diamond |
| Beamline | I24 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-01-27 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.9686 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 181.080, 98.500, 214.870 |
| Unit cell angles | 90.00, 90.50, 90.00 |
Refinement procedure
| Resolution | 72.610 - 3.400 |
| R-factor | 0.232 |
| Rwork | 0.231 |
| R-free | 0.25100 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3zdq |
| RMSD bond length | 0.008 |
| RMSD bond angle | 0.930 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | BUSTER (2.10.2) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 72.610 | 3.460 |
| High resolution limit [Å] | 3.400 | 3.400 |
| Rmerge | 0.220 | 7.300 |
| Rpim | 0.090 | 2.984 |
| Number of reflections | 104497 | 5020 |
| <I/σ(I)> | 7 | 0.3 |
| Completeness [%] | 99.9 | 98 |
| Redundancy | 6.9 | 6.8 |
| CC(1/2) | 0.998 | 0.078 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 293 | 0.1M HEPES pH 7.5 -- 18% PEG3350 |
