1BTX

Episelection: Novel Ki ~Nanomolar Inhibitors of Serine Proteases Selected by Binding or Chemistry on an Enzyme Surface

Experimental procedure

Spacegroup name	P 21 21 21
Unit cell lengths	54.840, 58.610, 67.470
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	8.000 - 1.700
R-factor	0.14
Rwork	0.140
RMSD bond length	0.013
RMSD bond angle	3.000
Data reduction software	XDS
Data scaling software	XDS
Phasing software	X-PLOR
Refinement software	X-PLOR

Data quality characteristics

	Overall
Low resolution limit [Å]	8.000 *
High resolution limit [Å]	1.700 *
Rmerge	0.080 *
Total number of observations	15280 *
Number of reflections	10174
Completeness [%]	40.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	Vapor diffusion, hanging drop *	8.15 *		used seeding *