4JDA

Complex structure of abscisic acid receptor PYL3 with (-)-ABA

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U
Synchrotron site	SSRF
Beamline	BL17U
Temperature [K]	130
Detector technology	CCD
Collection date	2010-07-01
Detector	RAYONIX MX-225
Wavelength(s)	1
Spacegroup name	P 65
Unit cell lengths	142.738, 142.738, 99.802
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	38.120 - 2.650
R-factor	0.24459
Rwork	0.243
R-free	0.26728
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4dsc
RMSD bond length	0.008
RMSD bond angle	1.287
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	REFMAC (5.7.0029)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.700
High resolution limit [Å]	2.650	2.650
Number of reflections	32032
Completeness [%]	95.1	70.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8.5	293	20% PEG 8000, 0.1M Tris-HCl, 0.2M MgCl2, pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K