8GY0

Agrocybe pediades linalool sunthase (Ap.LS)

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	2021-10-24
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.97918
Spacegroup name	P 1 21 1
Unit cell lengths	69.925, 80.665, 69.906
Unit cell angles	90.00, 96.05, 90.00

Refinement procedure

Resolution	46.804 - 1.988
Rwork	0.214
R-free	0.27450
Structure solution method	MAD
Starting model (for MR)	1ps1 2wbu
RMSD bond length	0.008
RMSD bond angle	1.448
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MADSYS
Refinement software	REFMAC (5.8.0267)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.010
High resolution limit [Å]	1.980	1.980
Number of reflections	48065	1368
<I/σ(I)>	29.7
Completeness [%]	90.5
Redundancy	5.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.6	295.15	10mM MgCl2, 0.2 M Sodium citrate tribasic dihydrate pH 5.6, 2% v/v Tacsimate pH 5 and 18% PEG 3350