9G6R
Fab-IP8 in complex with rocuronium
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SOLEIL BEAMLINE PROXIMA 1 |
| Synchrotron site | SOLEIL |
| Beamline | PROXIMA 1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2019-02-28 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.9785657 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 56.496, 55.170, 76.892 |
| Unit cell angles | 90.00, 104.87, 90.00 |
Refinement procedure
| Resolution | 39.470 - 1.720 |
| R-factor | 0.16345 |
| Rwork | 0.162 |
| R-free | 0.20281 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.592 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0425) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 44.300 | 1.760 |
| High resolution limit [Å] | 1.720 | 1.720 |
| Number of reflections | 48808 | 3369 |
| <I/σ(I)> | 13.9 | |
| Completeness [%] | 99.3 | |
| Redundancy | 8.5 | |
| CC(1/2) | 0.999 | 0.706 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 291 | 60 % (w/v) MPD 0.01 M CaCl2 0.1 M Na Acetate pH 4.6 |
