2WPO

HCMV protease inhibitor complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Temperature [K]	100
Spacegroup name	P 21 2 21
Unit cell lengths	107.800, 53.400, 212.400
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	6.000 - 2.700
R-factor	0.226
Rwork	0.226
R-free	0.33200
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1wpo
RMSD bond length	0.011
RMSD bond angle	1.600
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	REPLACE
Refinement software	X-PLOR

Data quality characteristics

	Overall
Low resolution limit [Å]	20.000
High resolution limit [Å]	2.700
Rmerge	0.078
Total number of observations	275527 *
Number of reflections	33502
Completeness [%]	93.0
Redundancy	4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	Vapor diffusion, hanging drop *	7.5		pH 7.5

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	protein	7 (mg/ml)
2	1	reservoir	PEG4000	18 (%)
3	1	reservoir	HEPES	0.1 (M)	pH7.5
4	1	reservoir		0.2 (M)
5	1	reservoir	glycerol	10 (%)
6	1	reservoir	spermine	50 (mM)