9FMN
Structure of Human PADI6
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2023-02-21 |
| Detector | DECTRIS EIGER2 XE 16M |
| Wavelength(s) | 0.9763 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 104.044, 123.332, 126.540 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 54.060 - 2.440 |
| R-factor | 0.2606 |
| Rwork | 0.258 |
| R-free | 0.30740 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.004 |
| RMSD bond angle | 0.609 |
| Data reduction software | DIALS |
| Data scaling software | xia2.multiplex |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 54.060 | 2.520 |
| High resolution limit [Å] | 2.440 | 2.440 |
| Rmerge | 0.360 | 5.620 |
| Number of reflections | 61221 | 6051 |
| <I/σ(I)> | 4.98 | |
| Completeness [%] | 99.2 | |
| Redundancy | 13.8 | |
| CC(1/2) | 0.996 | 0.390 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 20.9% w/v PEG3350, 0.2 M KSCN, 0.1 M Bis-Tris propane, pH 6.5 |
