8ZVO
AtKAI2 apo structure
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | AichiSR BEAMLINE BL2S1 |
| Synchrotron site | AichiSR |
| Beamline | BL2S1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2022-10-05 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 1.12 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 50.700, 55.790, 52.870 |
| Unit cell angles | 90.00, 115.94, 90.00 |
Refinement procedure
| Resolution | 47.540 - 1.490 |
| R-factor | 0.1477 |
| Rwork | 0.146 |
| R-free | 0.17240 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4jym |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.913 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.540 | 1.580 |
| High resolution limit [Å] | 1.490 | 1.490 |
| Rmerge | 0.045 | 0.313 |
| Number of reflections | 42773 | 12465 |
| <I/σ(I)> | 18.95 | 4.45 |
| Completeness [%] | 96.7 | |
| Redundancy | 3.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 293 | 0.1 M Tris-HCl (pH 7.0 to 9.0) with 1.25 to 2.0 M ammonium sulfate and 12% (v/v) glycerol |
