8ZVC

ShosT with PRPP-Mg

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	2023-08-16
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.97915
Spacegroup name	P 21 21 21
Unit cell lengths	66.779, 79.153, 89.988
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	25.520 - 1.800
R-factor	0.1658
Rwork	0.164
R-free	0.19720
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.006
RMSD bond angle	0.834
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.630
High resolution limit [Å]	1.600	1.600
Number of reflections	59288	1035
<I/σ(I)>	15
Completeness [%]	93.1
Redundancy	11.4
CC(1/2)	0.750	0.608

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		289	18% PEG 6000, 0.1M MES pH6.5