5EKP

Structure of the polyisoprenyl-phosphate glycosyltransferase GtrB (WT)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X4C
Synchrotron site	NSLS
Beamline	X4C
Temperature [K]	100
Detector technology	CCD
Collection date	2013-03-05
Detector	MAR CCD 165 mm
Wavelength(s)	0.979
Spacegroup name	C 1 2 1
Unit cell lengths	157.331, 137.518, 101.448
Unit cell angles	90.00, 98.50, 90.00

Refinement procedure

Resolution	19.988 - 3.194
R-factor	0.2501
Rwork	0.248
R-free	0.29100
RMSD bond length	0.010
RMSD bond angle	0.517
Data reduction software	iMOSFLM
Data scaling software	Aimless (0.5.17)
Refinement software	PHENIX (dev_2210)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	19.988	48.320	3.240
High resolution limit [Å]	3.100	10.750	3.100
Rmerge	0.052	0.031	1.246
Rpim	0.040	0.026	0.935
Total number of observations	97120	2142	11763
Number of reflections	36869
<I/σ(I)>	12.8	51.2	0.8
Completeness [%]	96.9	91.2	96.9
Redundancy	2.6	2.5	2.6
CC(1/2)	0.997	0.994	0.416

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	9	295	16-18% PEG600 (v/v), 0.12 M Tris/HCl, pH 9.0, 0.1 M NaCl and 1 mM TCEP