7QT4
Antibody FenAb709 - 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 | 2021-06-06 |
| Detector | DECTRIS PILATUS 2M-F |
| Wavelength(s) | 1 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 75.190, 138.690, 101.070 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 55.320 - 2.320 |
| R-factor | 0.2108 |
| Rwork | 0.209 |
| R-free | 0.24760 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 7qt0 |
| Data reduction software | MOSFLM |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.19.2_4158) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 55.320 | 2.410 |
| High resolution limit [Å] | 2.320 | 2.320 |
| Rmerge | 0.286 | |
| Number of reflections | 22297 | 2274 |
| <I/σ(I)> | 16.19 | 7.3 |
| Completeness [%] | 94.8 | 100 |
| Redundancy | 10.9 | 11.2 |
| CC(1/2) | 0.971 | 0.978 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 4.5 | 281 | 40 % (V/V) MPD, 0.1 M Sodium Acetate |
