5ULO

Crystal Structure of 14-3-3 zeta in Complex with a Serine 124-phosphorylated TBC1D7 peptide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	CLSI BEAMLINE 08ID-1
Synchrotron site	CLSI
Beamline	08ID-1
Temperature [K]	100
Detector technology	CCD
Collection date	2014-09-16
Detector	RAYONIX MX-300
Wavelength(s)	0.97931
Spacegroup name	P 21 21 21
Unit cell lengths	69.709, 71.575, 129.899
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	29.890 - 2.140
R-factor	0.228
Rwork	0.227
R-free	0.27000
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1a38
RMSD bond length	0.010
RMSD bond angle	0.980
Data reduction software	HKL-3000
Data scaling software	SCALEPACK
Phasing software	PHASER
Refinement software	BUSTER (2.10.2)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.180
High resolution limit [Å]	2.140	5.810	2.140
Rmerge	0.059	0.036	0.979
Rmeas	0.063	0.040
Rpim	0.023	0.015	0.363
Total number of observations	291490
Number of reflections	36479		1830
<I/σ(I)>	14.4
Completeness [%]	99.5	92.7	100
Redundancy	8	6.8	8.2
CC(1/2)		0.999	0.839

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	293	25% PEG 3350, 0.2 M NaCl, 0.1 M HEPES pH7.5,5%~15% Ethylene Glycol