9D2C
Crystal Structure of Tungbindin Treated with Proteinase K
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-002 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2024-06-04 |
| Detector | DECTRIS PILATUS 200K |
| Wavelength(s) | 1.5418 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 54.901, 76.696, 103.119 |
| Unit cell angles | 90.00, 102.32, 90.00 |
Refinement procedure
| Resolution | 43.950 - 2.380 |
| R-factor | 0.1862 |
| Rwork | 0.183 |
| R-free | 0.23390 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.177 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.21_5207) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 43.950 | 2.410 |
| High resolution limit [Å] | 2.380 | 2.380 |
| Rmerge | 0.130 | 0.330 |
| Number of reflections | 53472 | 403 |
| <I/σ(I)> | 12.55 | 2.42 |
| Completeness [%] | 88.5 | |
| Redundancy | 5.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 293 | 0.1M HEPES pH 7.0 15% PEG 4000 0.1M MgCl2 |
