3MUC

MUCONATE CYCLOISOMERASE VARIANT I54V

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU RU200
Temperature [K]	298
Detector technology	IMAGE PLATE
Detector	RIGAKU RAXIS IIC
Spacegroup name	I 4
Unit cell lengths	139.600, 139.600, 84.200
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	8.000 - 2.300
R-factor	0.176
Rwork	0.176
R-free	0.22300
Structure solution method	OTHER
RMSD bond length	0.009
RMSD bond angle	1.500
Data reduction software	DENZO
Data scaling software	SCALEPACK
Refinement software	X-PLOR (3.851)

Data quality characteristics

	Overall
Low resolution limit [Å]	8.000 *
High resolution limit [Å]	2.300
Rmerge	0.121
Total number of observations	132958 *
Number of reflections	30586 *
Completeness [%]	80.2
Redundancy	4.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	double dialysis *	6.5		pH 6.5

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	1	MES	20 (mM)
2	1	1		2 (mM)
3	1	1		50 (mM)
4	1	1		0.02 (%(w/v))
5	1	1	beta-mercaptoethanol	7 (mM)
6	1	1	protein	8 (mg/ml)