7OQU

Ternary complex of 14-3-3 sigma, Amot-p130 phosphopeptide, and WQ180

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID30B
Synchrotron site	ESRF
Beamline	ID30B
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-02-05
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.97626
Spacegroup name	C 2 2 21
Unit cell lengths	82.611, 111.835, 62.277
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	66.450 - 1.400
R-factor	0.1718
Rwork	0.171
R-free	0.18240
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4jc3
RMSD bond length	0.009
RMSD bond angle	0.933
Data reduction software	DIALS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.13_2998)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	66.450	1.420
High resolution limit [Å]	1.400	1.400
Rmerge	0.107	1.672
Number of reflections	57063	2810
<I/σ(I)>	12.1	1.9
Completeness [%]	100.0	100
Redundancy	12.9	13
CC(1/2)	0.998	0.799

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		277.15	0.095 M Hepes pH7.5, 26%PEG 400, 0.19 M CaCl2, and 5 % Glycerol