8P1F
X-ray structure of acetylcholine-binding protein (AChBP) in complex with FL001909.
Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04 |
| Synchrotron site | Diamond |
| Beamline | I04 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2020-07-22 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.979 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 116.710, 140.710, 147.170 |
| Unit cell angles | 90.00, 109.68, 90.00 |
Refinement procedure
| Resolution | 49.370 - 2.100 |
| R-factor | 0.22657 |
| Rwork | 0.225 |
| R-free | 0.25479 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.549 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 49.370 | 2.175 |
| High resolution limit [Å] | 2.100 | 2.100 |
| Rmeas | 0.080 | 1.578 |
| Number of reflections | 259396 | 25710 |
| <I/σ(I)> | 15.49 | |
| Completeness [%] | 99.7 | |
| Redundancy | 6.9 | |
| CC(1/2) | 0.999 | 0.507 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | PEG3350 3% Ammonium sulphate 1.8M HEPES buffer 0.1M, pH 7.75 |
