6SH9
EngBF DARPin Fusion 4b D12
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 | 2019-04-05 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 1.0000305674358714 |
| Spacegroup name | P 65 |
| Unit cell lengths | 192.010, 192.010, 122.050 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 49.200 - 2.400 |
| R-factor | 0.163 |
| Rwork | 0.161 |
| R-free | 0.19300 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2zxq |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.140 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | REFMAC |
| Refinement software | BUSTER (2.10.3) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 49.200 | 49.200 | 2.050 |
| High resolution limit [Å] | 2.000 | 8.940 | 2.000 |
| Rmerge | 0.371 | 0.060 | 14.170 |
| Rmeas | 0.390 | 0.063 | 14.970 |
| Total number of observations | 1800744 | ||
| Number of reflections | 172028 | 1995 | 12624 |
| <I/σ(I)> | 5.03 | 27.07 | 0.12 |
| Completeness [%] | 99.9 | 99.3 | 99.6 |
| Redundancy | 10.468 | 10.762 | 9.552 |
| CC(1/2) | 0.994 | 0.998 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 277.15 | PEG 20,000 MPD MES sodium chloride manganese chloride |
