1Y6F

alpha-glucosyltransferase in complex with UDP-glucose and DNA containing an abasic site

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID14-2
Synchrotron site	ESRF
Beamline	ID14-2
Temperature [K]	100
Detector technology	CCD
Collection date	2004-04-15
Detector	MARRESEARCH
Wavelength(s)	0.934
Spacegroup name	P 1 21 1
Unit cell lengths	47.363, 123.964, 86.628
Unit cell angles	90.00, 101.83, 90.00

Refinement procedure

Resolution	20.000 - 2.400
Rwork	0.197
R-free	0.27400
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	a model at 2.7 A from a SAD experiment (selenomethionines)
RMSD bond length	1.310
RMSD bond angle	0.007
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	AMoRE
Refinement software	CNS (1.0)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	20.000	2.490
High resolution limit [Å]	2.400	2.400
Number of reflections	37879
<I/σ(I)>	12.9
Completeness [%]	99.2	98.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8.5	298	PEG 4000, pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K

Crystallization Reagents

ID	crystal ID	solution ID	reagent name	concentration	details
1	1	1	PEG 4000
2	1	1	H2O
3	1	2	PEG 4000
4	1	2	H2O