7EXE

Crystal structure of mouse 14-3-3zeta in complex with doubly phosphorylated ADAM22 peptide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL45XU
Synchrotron site	SPring-8
Beamline	BL45XU
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-05-12
Detector	DECTRIS PILATUS 6M
Wavelength(s)	1.0
Spacegroup name	P 21 21 21
Unit cell lengths	72.197, 85.546, 111.869
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	49.480 - 2.750
R-factor	0.2436
Rwork	0.242
R-free	0.26660
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1qja
RMSD bond length	0.003
RMSD bond angle	0.412
Data reduction software	XDS
Data scaling software	XDS
Phasing software	MOLREP
Refinement software	PHENIX (1.17.1_3660)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	49.500	2.920
High resolution limit [Å]	2.750	2.750
Rmeas	0.351	2.311
Number of reflections	18575	2927
<I/σ(I)>	14.13	1.38
Completeness [%]	99.9	99.8
Redundancy	12.9	13.5
CC(1/2)	0.998	0.918

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	PEG2000MME