8I12
InuAMN8
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL17U |
| Synchrotron site | SSRF |
| Beamline | BL17U |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2021-02-20 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 0.9791 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 61.630, 79.220, 94.570 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 48.640 - 1.360 |
| R-factor | 0.1248 |
| Rwork | 0.124 |
| R-free | 0.14940 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.386 |
| Data reduction software | DIALS (3.7.2) |
| Data scaling software | DIALS (3.7.2) |
| Phasing software | PHENIX (10.1-2155) |
| Refinement software | PHENIX (1.10.1-2155) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 94.570 | 1.390 |
| High resolution limit [Å] | 1.360 | 1.360 |
| Rmerge | 0.053 | 0.111 |
| Number of reflections | 99430 | 9000 |
| <I/σ(I)> | 26.7 | 7.4 |
| Completeness [%] | 99.3 | 91.3 |
| Redundancy | 12.2 | 7.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 291 | JCSG4-60 0.1 M HEPES pH 6.5, 30% (w/v) PEG 6000 |
