9IAT
Bc8.121 Fab
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-002 |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2023-02-16 |
| Detector | MAR scanner 345 mm plate |
| Wavelength(s) | 1.54 |
| Spacegroup name | P 31 2 1 |
| Unit cell lengths | 72.638, 72.638, 153.694 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 39.720 - 1.540 |
| R-factor | 0.2008 |
| Rwork | 0.199 |
| R-free | 0.23160 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.843 |
| Data reduction software | autoPROC |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.21.2_5419) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 39.720 | 1.560 |
| High resolution limit [Å] | 1.540 | 1.540 |
| Rmerge | 0.076 | |
| Number of reflections | 70168 | 3455 |
| <I/σ(I)> | 10.1 | |
| Completeness [%] | 100.0 | |
| Redundancy | 8.4 | |
| CC(1/2) | 0.998 | 0.358 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 292 | 10% (w/v) PEG 6K, 10 mM sodium acetate, 30% (w/v) EtOH |
