6J4T

Crystal structure of arabidopsis ADAL complexed with IMP

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-01-07
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97849
Spacegroup name	P 21 21 21
Unit cell lengths	50.630, 81.921, 87.150
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	30.000 - 1.820
R-factor	0.18959
Rwork	0.187
R-free	0.22896
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6j23
RMSD bond length	0.011
RMSD bond angle	1.661
Data reduction software	iMOSFLM
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	REFMAC (5.8.0232)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.920
High resolution limit [Å]	1.820	1.820
Rmerge		0.135
Number of reflections	32042
<I/σ(I)>	11.8
Completeness [%]	96.8
Redundancy	10.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8.5	293	0.2 M Ammonium acetate, 0.1 M Tris pH 8.5, 25% w/v Polyethylene glycol 3350