7FAO
Top7 surface mutant K42A Q43A K46A K57S K58S, and I68R
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE BL-5A |
| Synchrotron site | Photon Factory |
| Beamline | BL-5A |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-05-12 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 1.0000 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 24.015, 86.298, 40.130 |
| Unit cell angles | 90.00, 97.18, 90.00 |
Refinement procedure
| Resolution | 19.910 - 1.430 |
| R-factor | 0.2048 |
| Rwork | 0.203 |
| R-free | 0.24220 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1qys |
| RMSD bond length | 0.005 |
| RMSD bond angle | 0.731 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | MOLREP |
| Refinement software | PHENIX (1.17.1-3660) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 19.910 | 1.480 |
| High resolution limit [Å] | 1.430 | 1.430 |
| Rmerge | 0.034 | 0.495 |
| Rmeas | 0.040 | 0.592 |
| Rpim | 0.022 | 0.322 |
| Number of reflections | 29603 | 2966 |
| <I/σ(I)> | 17 | 2.5 |
| Completeness [%] | 98.8 | 99.9 |
| Redundancy | 3.2 | 3.2 |
| CC(1/2) | 0.999 | 0.886 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 292 | PEG 8000, Sodium Cacodylate, Magnesium Acetate |
