7BII
Crystal structure of Nematocida HUWE1
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06SA |
| Synchrotron site | SLS |
| Beamline | X06SA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2020-02-15 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 1 |
| Spacegroup name | P 1 |
| Unit cell lengths | 95.519, 96.218, 199.655 |
| Unit cell angles | 92.22, 100.45, 95.33 |
Refinement procedure
| Resolution | 196.030 - 3.037 |
| R-factor | 0.2039 |
| Rwork | 0.202 |
| R-free | 0.23300 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3g1n |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.850 |
| Data reduction software | XDS |
| Data scaling software | STARANISO |
| Phasing software | PHASER |
| Refinement software | BUSTER (2.10.3 (6-FEB-2020)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 196.030 | 3.393 |
| High resolution limit [Å] | 3.037 | 3.037 |
| Number of reflections | 75499 | 3785 |
| <I/σ(I)> | 5.6 | 1.6 |
| Completeness [%] | 89.4 | |
| Redundancy | 3.8 | |
| CC(1/2) | 0.998 | 0.741 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6.6 | 277 | 10.4% PEG 4000, 100mM MgCl2, 100mM HEPES pH 6.6, 6mM DTT |
