7YAW
Crystal structure of ZAK in complex with compound YH-180
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 | 2021-06-21 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.97853 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 57.675, 142.772, 179.132 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 31.690 - 2.100 |
R-factor | 0.2085 |
Rwork | 0.207 |
R-free | 0.24280 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5x5o |
Data reduction software | DENZO |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX (1.19.2_4158) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 31.690 | 2.150 |
High resolution limit [Å] | 2.100 | 2.100 |
Rpim | 0.050 | 0.487 |
Number of reflections | 83627 | 5784 |
<I/σ(I)> | 2 | 2 |
Completeness [%] | 96.0 | |
Redundancy | 20 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 298 | 0.05 M Magnesium acetate, 0.05 M Sodium acetate pH 5.0, 28% PEG400 |