6ZUC
X-RAY CRYSTAL STRUCTURE OF THE CsPYL1-Lig1-HAB1 TERNARY COMPLEX
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALBA BEAMLINE XALOC |
Synchrotron site | ALBA |
Beamline | XALOC |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-11-14 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.979257 |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 42.959, 62.733, 186.926 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 46.730 - 2.370 |
R-factor | 0.1843 |
Rwork | 0.181 |
R-free | 0.24340 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 5mn0 |
RMSD bond length | 0.008 |
RMSD bond angle | 0.979 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | PHENIX (1.17.1_3660) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 46.730 | 2.460 |
High resolution limit [Å] | 2.370 | 2.370 |
Number of reflections | 20948 | 1899 |
<I/σ(I)> | 5.6 | |
Completeness [%] | 98.5 | 87.8 |
Redundancy | 5.5 | 4.4 |
CC(1/2) | 0.992 | 0.778 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | MICROBATCH | 7.5 | 291 | 30%PEG 3350 |