5LNV

Crystal structure of Arabidopsis thaliana Pdx1-I320 complex from multiple crystals

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID23-1
Synchrotron site	ESRF
Beamline	ID23-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2013-12-15
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.976253
Spacegroup name	H 3
Unit cell lengths	178.576, 178.576, 117.375
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	46.748 - 2.240
R-factor	0.1795
Rwork	0.177
R-free	0.21990
Structure solution method	FOURIER SYNTHESIS
RMSD bond length	0.011
RMSD bond angle	1.355
Data scaling software	Aimless (0.3.11)
Refinement software	PHENIX (1.10_2155)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	46.750	46.750	2.290
High resolution limit [Å]	2.240	10.510	2.240
Rmerge	0.216	0.081	1.361
Rmeas	0.246
Rpim	0.115
Total number of observations	284330
Number of reflections	66626
<I/σ(I)>	30.5
Completeness [%]	99.3	96.7	99.2
Redundancy	4.3	4.5	4.2
CC(1/2)	0.978	0.991	0.426

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.8	298	0.1 M Tris pH7,1-8.5, 0.4 M sodium acetate pH5.5, 4.8-11.85%(w/v) PEG4000
1	VAPOR DIFFUSION, HANGING DROP	7.8	298	0.1 M Tris pH7,1-8.5, 0.4 M sodium acetate pH5.5, 4.8-11.85%(w/v) PEG4000