7YTL

Structure of a oxidoreductase in complex with quinone

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U1
Synchrotron site	SSRF
Beamline	BL17U1
Temperature [K]	100
Detector technology	CCD
Collection date	2019-11-21
Detector	MAR CCD 165 mm
Wavelength(s)	0.9791
Spacegroup name	P 65 2 2
Unit cell lengths	113.714, 113.714, 125.662
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	27.730 - 2.620
R-factor	0.2096
Rwork	0.207
R-free	0.25820
Structure solution method	SAD
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	RESOLVE
Refinement software	PHENIX (1.18.2_3874)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	27.730	2.830
High resolution limit [Å]	2.620	2.620
Number of reflections	14898	2990
<I/σ(I)>	23.8
Completeness [%]	99.9
Redundancy	36
CC(1/2)	0.990	0.945

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.2	294	14% w/v PEG8000, 0.1 M MES pH 6.2, 160 mM Calcium acetate, 20% v/v glycerol