6WAO

Crystal structure of Arabidopsis thaliana isochorismoyl-glutamate A pyruvoyl-glutamate lyase in complex with (2-(3-carboxyphenoxy)acetyl)-L-glutamic acid

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-E
Synchrotron site	APS
Beamline	24-ID-E
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-02-16
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.97918
Spacegroup name	P 21 21 21
Unit cell lengths	55.136, 75.353, 193.513
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	59.450 - 1.760
R-factor	0.1744
Rwork	0.172
R-free	0.21180
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6dd2
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.17.1_3660)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	59.450	9.130
High resolution limit [Å]	1.760	1.760
Rmerge	0.063	0.596
Rmeas	0.066	0.650
Rpim	0.018	0.257
Number of reflections	81189	51695
<I/σ(I)>	25.6	3.5
Completeness [%]	99.8	96.2
Redundancy	13.3	12
CC(1/2)	1.000	0.924

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		300	0.2 M Potassium Sodium Tartrate 20 % (w/v) PEG 3350