1W3C

Crystal structure of the Hepatitis C Virus NS3 Protease in complex with a peptidomimetic inhibitor

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID14-3
Synchrotron site	ESRF
Beamline	ID14-3
Temperature [K]	100
Spacegroup name	P 61
Unit cell lengths	92.411, 92.411, 80.007
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	20.000 - 2.300
Rwork	0.177
R-free	0.24000
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1dxp
Data reduction software	DENZO
Data scaling software	SCALA
Phasing software	AMoRE
Refinement software	REFMAC (5.1)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	20.000	2.420
High resolution limit [Å]	2.300	2.300
Rmerge	0.040	0.200
Number of reflections	16243
<I/σ(I)>	15.7	3
Completeness [%]	93.7	95
Redundancy	2.77	2.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1