7QT3
Antibody FenAb609 - fentanyl complex
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06DA |
| Synchrotron site | SLS |
| Beamline | X06DA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-01-14 |
| Detector | DECTRIS PILATUS 2M-F |
| Wavelength(s) | 1 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 77.273, 111.414, 114.812 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 45.190 - 1.700 |
| R-factor | 0.2025 |
| Rwork | 0.201 |
| R-free | 0.23080 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 7qt0 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.19.2_4158) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 45.190 | 1.760 |
| High resolution limit [Å] | 1.700 | 1.700 |
| Number of reflections | 109391 | 10846 |
| <I/σ(I)> | 11.31 | 0.95 |
| Completeness [%] | 99.9 | 99.71 |
| Redundancy | 6.7 | 6.5 |
| CC(1/2) | 0.999 | 0.608 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.5 | 299 | 20 % (W/V) PEG6000, 0,1 M NaCitrate |
