4LEI

Spinosyn Forosaminyltransferase SpnP

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 5.0.3
Synchrotron site	ALS
Beamline	5.0.3
Temperature [K]	100
Detector technology	CCD
Collection date	2013-01-27
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.98
Spacegroup name	P 43 21 2
Unit cell lengths	162.369, 162.369, 81.279
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	114.810 - 3.150
R-factor	0.21403
Rwork	0.209
R-free	0.31368
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.012
RMSD bond angle	1.814
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER (MR)
Refinement software	REFMAC (5.6.0117)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	114.810	3.231
High resolution limit [Å]	3.150	3.150
Number of reflections	18175
Completeness [%]	99.0	95.25

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