1ADI

STRUCTURE OF ADENYLOSUCCINATE SYNTHETASE AT PH 6.5 AND 25 DEGREES CELSIUS

Experimental procedure

Detector technology	AREA DETECTOR
Detector	SIEMENS-NICOLET X100
Spacegroup name	P 21 21 21
Unit cell lengths	73.420, 93.630, 119.470
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	5.000 - 2.500
R-factor	0.206
Rwork	0.206
RMSD bond length	0.015
RMSD bond angle	24.800 *
Data reduction software	XENGEN
Refinement software	X-PLOR

Data quality characteristics

	Overall
Low resolution limit [Å]	15.000
High resolution limit [Å]	2.500
Rmerge	0.060
Total number of observations	104085 *
Number of reflections	32170 *
Completeness [%]	99.0
Redundancy	3.24

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	Vapor diffusion, hanging drop *	6.5 *

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	reservoir	PEG3350	25 (%(w/w))
2	1	reservoir	acetic-acid/sodium acetate	100 (mM)
3	1	reservoir	ammonium acetate	200 (mM)