5ACN

STRUCTURE OF ACTIVATED ACONITASE. FORMATION OF THE (4FE-4S) CLUSTER IN THE CRYSTAL

Experimental procedure

Spacegroup name	P 21 21 2
Unit cell lengths	173.600, 72.000, 72.700
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	5.000 - 2.100
Rwork	0.215
RMSD bond length	0.018
RMSD bond angle	3.500
Refinement software	X-PLOR

Data quality characteristics

	Overall
High resolution limit [Å]	2.100 *
Rmerge	0.106 *
Total number of observations	350360 *
Number of reflections	47583 *

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	ammonium sulfate	3.7 (M)
2	1	drop	Tris-HCl	0.5 (M)
3	1	reservoir	ammonium sulfate	2.2 (M)
4	1	reservoir	Tris-HCl	0.5 (M)