9JW5

Crystal structure of OsSPS3 complexed with YH24786

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	56.179, 89.875, 127.547
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.638 - 2.146
R-factor	0.2053
Rwork	0.203
R-free	0.25970
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	0.817
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]	47.640	2.223
High resolution limit [Å]	2.146	2.146
Number of reflections	35977	3453
<I/σ(I)>	15.43
Completeness [%]	99.7
Redundancy	10.419
CC(1/2)	0.998	0.829

Crystallization Conditions

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