7XVQ
Crystal structure of AcrIIC4
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL17U1 |
| Synchrotron site | SSRF |
| Beamline | BL17U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-07-03 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.9791 |
| Spacegroup name | P 1 |
| Unit cell lengths | 46.917, 48.468, 49.147 |
| Unit cell angles | 66.80, 95.72, 65.88 |
Refinement procedure
| Resolution | 42.940 - 1.800 |
| R-factor | 0.2311 |
| Rwork | 0.227 |
| R-free | 0.28480 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | alphafold2 |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.922 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.20_4459) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 42.940 | 1.864 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Number of reflections | 28492 | 2793 |
| <I/σ(I)> | 8.05 | |
| Completeness [%] | 89.0 | |
| Redundancy | 1.9 | |
| CC(1/2) | 0.994 | 0.872 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 291.15 | Sodium malonate, Polyethylene glycol 3350 |
