8Z3T
Structure of P-98/N44
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL19U1 |
| Synchrotron site | SSRF |
| Beamline | BL19U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2023-07-15 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.978610 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 62.915, 35.970, 107.113 |
| Unit cell angles | 90.00, 92.75, 90.00 |
Refinement procedure
| Resolution | 31.220 - 2.010 |
| R-factor | 0.2546 |
| Rwork | 0.248 |
| R-free | 0.31620 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.026 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.20_4459: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 31.220 | 2.130 |
| High resolution limit [Å] | 2.008 | 2.010 |
| Rmerge | 0.213 | 1.019 |
| Number of reflections | 16306 | 2602 |
| <I/σ(I)> | 4.91 | 1.18 |
| Completeness [%] | 97.4 | 96.6 |
| Redundancy | 5.817 | 5.49 |
| CC(1/2) | 0.985 | 0.434 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 291 | Lithium sulfate monohydrate, BIS-TRIS, Polyethylene glycol 3350 |
