2TLD

CRYSTAL STRUCTURE OF AN ENGINEERED SUBTILISIN INHIBITOR COMPLEXED WITH BOVINE TRYPSIN

Experimental procedure

Spacegroup name	I 2 2 2
Unit cell lengths	110.900, 116.800, 64.300
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	8.000 - 2.600
R-factor	0.173 *
Rwork	0.173
RMSD bond length	0.020
RMSD bond angle	4.300
Refinement software	X-PLOR

Data quality characteristics

	Overall
High resolution limit [Å]	2.600 *
Rmerge	0.063 *
Total number of observations	23106 *
Number of reflections	7579 *

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	Vapor diffusion, hanging drop *	7 *

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	Tris-HCl	0.05 (M)
2	1	drop		40 (%sat)
3	1	reservoir	Tris-HCl	0.05 (M)
4	1	reservoir		80 (%sat)