9Y5X

Crystal structure of shorter construct of SHP2 unbound N-SH2 domain

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS-II BEAMLINE 17-ID-1
Synchrotron site	NSLS-II
Beamline	17-ID-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2025-08-01
Detector	DECTRIS EIGER X 9M
Wavelength(s)	0.919716
Spacegroup name	P 43 21 2
Unit cell lengths	63.271, 63.271, 76.284
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	31.640 - 1.800
R-factor	0.2133
Rwork	0.211
R-free	0.25000
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.017
RMSD bond angle	1.779
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.21.2_5419)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	31.640	1.930
High resolution limit [Å]	1.795	1.795
Number of reflections	15043	2930
<I/σ(I)>	20.8
Completeness [%]	100.0
Redundancy	26.3
CC(1/2)	0.999	0.352

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		298	0.1 M MES pH 6.0, 2.05 M ammonium sulfate