9QK3

X-ray crystal structure of SlPYL1-Coumaric Acid 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	2024-06-14
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.979
Spacegroup name	P 32 2 1
Unit cell lengths	89.869, 89.869, 51.621
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	44.930 - 1.650
R-factor	0.225
Rwork	0.224
R-free	0.24660
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.004
RMSD bond angle	0.672
Data reduction software	autoPROC
Data scaling software	autoPROC
Refinement software	PHENIX (1.21.2_5419)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	44.930	1.650
High resolution limit [Å]	1.650	1.650
Number of reflections	26794	1440
<I/σ(I)>	1.32
Completeness [%]	91.7
Redundancy	1.34
CC(1/2)	0.766	0.766

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	MICROBATCH	7	295	3.5 M ammonium sulfate pH 7.0