5AYS

Crystal structure of SAUGI/HSV UDG complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSRRC BEAMLINE BL13B1
Synchrotron site	NSRRC
Beamline	BL13B1
Temperature [K]	100
Detector technology	CCD
Collection date	2015-03-19
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.0000
Spacegroup name	P 1
Unit cell lengths	53.298, 63.010, 65.512
Unit cell angles	65.10, 89.58, 88.38

Refinement procedure

Resolution	20.000 - 2.090
R-factor	0.19629
Rwork	0.195
R-free	0.22253
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1lau 3wdg
RMSD bond length	0.010
RMSD bond angle	1.472
Data reduction software	Blu-Ice
Data scaling software	HKL-2000
Phasing software	MOLREP
Refinement software	REFMAC (5.5.0109)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	20.000	2.280
High resolution limit [Å]	2.090	2.200
Number of reflections	41236
<I/σ(I)>	12.2	4.3
Completeness [%]	95.6	95.6
Redundancy	2.1	2.1

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	0.2 M ammonium acetate, 0.1 M sodium citrate tribasic dihydrate pH 5.6, 30% PEG 4000