9NKS
Coevolved affibody pair A7B3
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL12-2 |
| Synchrotron site | SSRL |
| Beamline | BL12-2 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2023-08-15 |
| Detector | DECTRIS EIGER2 XE 16M |
| Wavelength(s) | .9795 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 33.527, 70.663, 70.052 |
| Unit cell angles | 90.00, 93.28, 90.00 |
Refinement procedure
| Resolution | 35.330 - 1.600 |
| R-factor | 0.212 |
| Rwork | 0.210 |
| R-free | 0.24440 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.004 |
| RMSD bond angle | 0.651 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.21.2_5419) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 35.330 | 1.640 |
| High resolution limit [Å] | 1.600 | 1.600 |
| Rmerge | 0.064 | 3.160 |
| Rmeas | 0.070 | 3.420 |
| Rpim | 0.026 | 1.290 |
| Number of reflections | 42640 | 3021 |
| <I/σ(I)> | 10.3 | 0.59 |
| Completeness [%] | 98.8 | 98.25 |
| Redundancy | 6.9 | 7 |
| CC(1/2) | 0.999 | 0.323 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 7.5 | 295 | 0.05 M MgCl2, 0.1 M HEPES pH 7.5, 30% PEG MME 550 |
