9UFC

Structural of a glutamate cysteine ligase StGSH1 in Solanum tuberosum

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U1
Synchrotron site	SSRF
Beamline	BL17U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-07-09
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.9789
Spacegroup name	C 2 2 21
Unit cell lengths	118.652, 179.086, 193.223
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.690 - 2.530
R-factor	0.1923
Rwork	0.191
R-free	0.24070
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond angle	5.299
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX ((1.20.1_4487: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	46.690	2.620
High resolution limit [Å]	2.530	2.530
Rmeas	0.119	0.119
Number of reflections	67371	67337
<I/σ(I)>	14.32
Completeness [%]	98.3
Redundancy	5.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		289	22% PEG3350, 0.1M Bis-Tris pH 5.5