6BKL
Influenza A M2 transmembrane domain bound to rimantadine
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 8.3.1 |
| Synchrotron site | ALS |
| Beamline | 8.3.1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2016-04-30 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 1.1158 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 36.460, 47.840, 48.530 |
| Unit cell angles | 90.00, 96.76, 90.00 |
Refinement procedure
| Resolution | 48.193 - 1.995 |
| R-factor | 0.1919 |
| Rwork | 0.186 |
| R-free | 0.24390 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3lbw |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.735 |
| Data reduction software | MOSFLM |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.11.1_2575: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.193 | 2.050 |
| High resolution limit [Å] | 1.995 | 1.995 |
| Rmerge | 0.114 | 0.348 |
| Number of reflections | 10589 | 754 |
| <I/σ(I)> | 7.1 | 2.9 |
| Completeness [%] | 93.3 | 90.8 |
| Redundancy | 4.8 | 4.5 |
| CC(1/2) | 0.994 | 0.959 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | LIPIDIC CUBIC PHASE | 293 | 0.2 M MgCl2, 0.1 M sodium acetate / acetic acid pH 4.5, 20% w/v PEG 8000, monoolein, rimantadine |
