1EED

X-ray crystallographic analysis of inhibition of endothiapepsin by cyclohexyl renin inhibitors

Experimental procedure

Spacegroup name	P 1 21 1
Unit cell lengths	43.100, 75.700, 42.900
Unit cell angles	90.00, 96.90, 90.00

Refinement procedure

Resolution	20.000 * - 2.000
R-factor	0.152 *
Rwork	0.152
RMSD bond length	0.024
RMSD bond angle	0.029
Refinement software	RESTRAIN

Data quality characteristics

	Overall
High resolution limit [Å]	2.000 *
Rmerge	0.095 *
Total number of observations	88024 *
Number of reflections	18024 *
Completeness [%]	99.0 *

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	unknown *			Moews, P., (1970) J. Mol. Biol., 54, 395. *

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	1	ammonium sulfate	2.2 (M)
2	1	1	acetate		can be replaced with phosphate
3	1	1	sodium dihydrogen	0.1 (M)