6G9I
Crystal structure of Ebolavirus glycoprotein in complex with clomipramine
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04 |
| Synchrotron site | Diamond |
| Beamline | I04 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2016-08-07 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.9795 |
| Spacegroup name | H 3 2 |
| Unit cell lengths | 114.206, 114.206, 306.426 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 52.095 - 2.190 |
| R-factor | 0.191 |
| Rwork | 0.190 |
| R-free | 0.20840 |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.745 |
| Data reduction software | xia2 |
| Data scaling software | xia2 |
| Refinement software | PHENIX ((1.13_2998: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 60.600 | 2.230 |
| High resolution limit [Å] | 2.190 | 2.190 |
| Rmerge | 0.080 | |
| Number of reflections | 40019 | 1962 |
| <I/σ(I)> | 26.9 | 2.6 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 38.9 | 33.4 |
| CC(1/2) | 1.000 | 0.940 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 5.2 | 293 | 9% (w/v) PEG 6000 and 0.1 M Sodium citrate tribasic dihydrate |
