4MM0

Crystal Structure Analysis of the Putative Thioether Synthase SgvP Involved in the Tailoring Step of Griseoviridin

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U
Synchrotron site	SSRF
Beamline	BL17U
Temperature [K]	77.15
Detector technology	CCD
Collection date	2012-05-02
Detector	ADSC QUANTUM 315
Wavelength(s)	0.979228
Spacegroup name	P 41 21 2
Unit cell lengths	184.050, 184.050, 80.320
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	29.856 - 2.600
R-factor	0.1727
Rwork	0.171
R-free	0.21380
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2y46
RMSD bond length	0.008
RMSD bond angle	1.127
Data reduction software	XDS
Data scaling software	SCALA
Phasing software	SOLVE
Refinement software	PHENIX ((phenix.refine: 1.8.1_1168))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	29.856	2.670
High resolution limit [Å]	2.600	2.600
Number of reflections	42958
Completeness [%]	99.9	98.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.2	277.15	20%(w/v) Polyethylene glycol 3350, 0.2M Potassium sodium tartrate tetrahydrate, 3.0%(v/v) Dimethyl sulfoxide, pH 8.2, VAPOR DIFFUSION, SITTING DROP, temperature 277.15K