9JWF

Crystal structure of OsSPS3 complexed with YH24787

This is a non-PDB format compatible entry.

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	2024-06-22
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.979230
Spacegroup name	P 21 21 21
Unit cell lengths	56.523, 89.761, 127.849
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.830 - 2.300
R-factor	0.2023
Rwork	0.199
R-free	0.26490
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	0.852
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX ((1.16_3549: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.830	2.382
High resolution limit [Å]	2.300	2.300
Number of reflections	29453	2888
<I/σ(I)>	19.82
Completeness [%]	99.4
Redundancy	10.198
CC(1/2)	0.999	0.945

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		291	PEG3350, Bis-Tris, Ammonium sulfate