5XTN

Crystal structure of baculoviral sulfhydryl oxidase P33 (C155A, C158A mutant)

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	2015-10-03
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.9793
Spacegroup name	P 1 21 1
Unit cell lengths	58.664, 153.499, 75.553
Unit cell angles	90.00, 110.29, 90.00

Refinement procedure

Resolution	37.600 - 2.540
R-factor	0.218
Rwork	0.216
R-free	0.25400
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3qzy
Data reduction software	HKL-2000 (V0.97.644)
Data scaling software	HKL-2000 (V0.97.644)
Phasing software	PHENIX (1.11.1_2575)
Refinement software	PHENIX

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	60.000	2.630
High resolution limit [Å]	2.540	2.540
Rmerge	0.098	0.401
Total number of observations	149523
Number of reflections	40775	4034
<I/σ(I)>	6.7
Completeness [%]	98.7	98
Redundancy	3.7	3.7
CC(1/2)		0.996

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	4.4	293	PEG3350