1O59

Crystal structure of Allantoicase (yir029w) from Saccharomyces cerevisiae at 2.40 A resolution

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL11-1
Synchrotron site	SSRL
Beamline	BL11-1
Temperature [K]	100
Detector technology	CCD
Collection date	2003-04-17
Detector	ADSC QUANTUM 315
Spacegroup name	P 63 2 2
Unit cell lengths	107.209, 107.209, 134.918
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	41.970 - 2.400
R-factor	0.17765
Rwork	0.175
R-free	0.22200 *
Structure solution method	MAD
RMSD bond length	0.017
RMSD bond angle	1.510 *
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	SOLVE
Refinement software	REFMAC (5.1.9999)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	41.970 *	2.460
High resolution limit [Å]	2.400	2.400
Rmerge	0.099	0.707
Total number of observations	94513 *
Number of reflections	18532
<I/σ(I)>	13	1.8
Completeness [%]	99.8	98.8
Redundancy	5.1	2.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	Vapor diffusion *	7.8 *	293	30% Ethylene Glycol , VAPOR DIFFUSION,SITTING DROP,NANODROP, temperature 293K
1	Vapor diffusion *	7.8 *	293	30% Ethylene Glycol , VAPOR DIFFUSION,SITTING DROP,NANODROP, temperature 293K
1	Vapor diffusion *	7.8 *	293	30% Ethylene Glycol , VAPOR DIFFUSION,SITTING DROP,NANODROP, temperature 293K

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	reservoir	Tris	10 (mM)	pH7.8
2	1	reservoir		150 (mM)
3	1	drop	protein	8 (mg/ml)