9HDK

Structure of s.c.Osh6 in complex with Ist2 732-756 and POPS

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PETRA III, EMBL c/o DESY BEAMLINE P13 (MX1)
Synchrotron site	PETRA III, EMBL c/o DESY
Beamline	P13 (MX1)
Temperature [K]	100
Detector technology	PIXEL
Collection date	2024-07-30
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.9762
Spacegroup name	C 2 2 21
Unit cell lengths	61.728, 175.697, 96.163
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	32.430 - 1.930
R-factor	0.1862
Rwork	0.185
R-free	0.21320
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	0.822
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.21.2_5419)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.000
High resolution limit [Å]	1.930	1.930
Rmerge	0.083	1.800
Number of reflections	41459	4022
<I/σ(I)>	18
Completeness [%]	99.4
Redundancy	7.18

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	5.5	293	100mM BisTris pH 5.5, 200mM KCl, 75mM MgCl2, 28.5-29% PEG400