9FVL

Dimeric 14-3-3 zeta in complex with unphosphorylated MAP2c peptide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PETRA III, EMBL c/o DESY BEAMLINE P14 (MX2)
Synchrotron site	PETRA III, EMBL c/o DESY
Beamline	P14 (MX2)
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-11-09
Detector	DECTRIS EIGER2 X CdTe 16M
Wavelength(s)	0.9762
Spacegroup name	P 1 21 1
Unit cell lengths	74.310, 69.108, 82.619
Unit cell angles	90.00, 112.09, 90.00

Refinement procedure

Resolution	48.780 - 2.080
R-factor	0.23618
Rwork	0.234
R-free	0.28255
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.008
RMSD bond angle	1.874
Data reduction software	XDS (XDSGUI)
Data scaling software	Aimless
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0425)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.780	2.140
High resolution limit [Å]	2.080	2.080
Rmerge	0.102	0.977
Rmeas	0.111	1.055
Rpim	0.042	0.395
Total number of observations	325384	24898
Number of reflections	46317	3557
<I/σ(I)>	11.7	2
Completeness [%]	99.3
Redundancy	7	7
CC(1/2)	0.998	0.805

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	293.15	100 mM HEPES pH(7.5), 400 mM Sodium acetate, 8mM Cadmium sulfate