5OUH
Humanized alpha-AChBP (acetylcholine binding protein) in complex with lobeline.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04-1 |
| Synchrotron site | Diamond |
| Beamline | I04-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-04-16 |
| Detector | DECTRIS PILATUS 2M |
| Wavelength(s) | 0.92818 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 87.785, 113.320, 146.964 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 89.740 - 2.500 |
| R-factor | 0.2092 |
| Rwork | 0.207 |
| R-free | 0.24990 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5afm |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.400 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | DIMPLE |
| Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 89.740 | |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rmerge | 0.141 | 2.890 |
| Rmeas | 0.152 | 3.130 |
| Rpim | 0.057 | 1.190 |
| Number of reflections | 51511 | |
| <I/σ(I)> | 12.7 | |
| Completeness [%] | 100.0 | |
| Redundancy | 13.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 0.1 M HEPES pH 7.5, 8% ethylene glycol and 10% PEG8000. |
