7WGI

Crystal structure of AflSQS from Aspergillus flavus

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSRRC BEAMLINE BL15A1
Synchrotron site	NSRRC
Beamline	BL15A1
Temperature [K]	100
Detector technology	CCD
Collection date	2019-10-10
Detector	RAYONIX MX-300
Wavelength(s)	0.9998
Spacegroup name	F 2 3
Unit cell lengths	206.468, 206.468, 206.468
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	24.330 - 2.500
R-factor	0.197
Rwork	0.195
R-free	0.22000
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1ezf
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHASER
Refinement software	PHENIX (1.19.2_4158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	25.000	2.590
High resolution limit [Å]	2.500	2.500
Number of reflections	25222	2508
<I/σ(I)>	31.05	2.18
Completeness [%]	100.0	100
Redundancy	6.9	6.9
CC(1/2)	0.913	0.626

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	298	1.1 M NaH2PO4, 0.5 M K2HPO4