4LDP

Spinosyn Forosaminyltransferase SpnP

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 5.0.2
Synchrotron site	ALS
Beamline	5.0.2
Temperature [K]	100
Detector technology	CCD
Collection date	2012-06-23
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.98
Spacegroup name	P 43 21 2
Unit cell lengths	162.421, 162.421, 81.228
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.930 - 2.500
R-factor	0.20324
Rwork	0.200
R-free	0.25743
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.016
RMSD bond angle	1.956
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER (MR)
Refinement software	REFMAC (5.7.0029)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	46.930	2.562
High resolution limit [Å]	2.500	2.500
Number of reflections	36239
Completeness [%]	99.7	97.31

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	4.24	298.15	7 mM PSA, 46% (w/v) PEG 200, 0.6-3.0% (w/v) dextran sulfate MR 5,000, 0.2 M sodium chloride, 0.1 M phosphate citrate buffer, pH 4.24, VAPOR DIFFUSION, SITTING DROP, temperature 298.15K