4EST

CRYSTAL STRUCTURE OF THE COVALENT COMPLEX FORMED BY A PEPTIDYL ALPHA,ALPHA-DIFLUORO-BETA-KETO AMIDE WITH PORCINE PANCREATIC ELASTASE AT 1.78-ANGSTROMS RESOLUTION

Experimental procedure

Spacegroup name	P 21 21 21
Unit cell lengths	51.240, 58.170, 75.540
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	7.000 - 1.780
Rwork	0.160
RMSD bond length	0.012
RMSD bond angle	2.280
Refinement software	EREF

Data quality characteristics

	Overall
High resolution limit [Å]	1.780 *
Rmerge	0.087 *
Total number of observations	36367 *
Number of reflections	16151 *
Completeness [%]	71.0 *

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	Vapor diffusion *	5 *