30TQ

14-3-3sigma protein binding to TSC2-wt peptide and stabilizer 3'deAc FC-A.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE MASSIF-3
Synchrotron site	ESRF
Beamline	MASSIF-3
Temperature [K]	100
Detector technology	PIXEL
Collection date	2024-11-21
Detector	DECTRIS EIGER X 4M
Wavelength(s)	0.967697
Spacegroup name	C 2 2 21
Unit cell lengths	82.486, 112.490, 63.051
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	45.803 - 1.600
Rwork	0.184
R-free	0.20530
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.005
RMSD bond angle	0.965
Data reduction software	autoPROC
Data scaling software	Aimless
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0431 (refmacat 0.4.126))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	45.803	1.630
High resolution limit [Å]	1.600	1.600
Number of reflections	38924	1978
<I/σ(I)>	19.6	5
Completeness [%]	99.6
Redundancy	10.9
CC(1/2)	0.998	0.918

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		277	0.095 M HEPES pH=7.1-7.7 0.19 M CaCl2 5% glycerol 24-29% PEG400