8BFC

Binary structure of 14-3-3s and RND3 phosphopeptide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PETRA III, DESY BEAMLINE P11
Synchrotron site	PETRA III, DESY
Beamline	P11
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-03-03
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.0332
Spacegroup name	C 2 2 21
Unit cell lengths	82.366, 112.395, 62.680
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	45.590 - 1.400
R-factor	0.1644
Rwork	0.164
R-free	0.17220
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6y1d
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	MOLREP
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	45.590	1.420
High resolution limit [Å]	1.400	1.400
Number of reflections	57311	2675
<I/σ(I)>	15.2	3.9
Completeness [%]	99.7
Redundancy	5.3
CC(1/2)	0.996	0.914

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		277	0.095 M Hepes pH 7.1, 0.19 M CaCl2, 25% PEG400, 5% glycerol