1MUI

Crystal structure of HIV-1 protease complexed with Lopinavir.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 17-ID
Synchrotron site	APS
Beamline	17-ID
Temperature [K]	100
Detector technology	CCD
Detector	MARRESEARCH
Spacegroup name	P 61
Unit cell lengths	63.264, 63.264, 83.621
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	33.000 - 2.800
R-factor	0.309
Rwork	0.261
R-free	0.32000 *
Structure solution method	FOURIER SYNTHESIS
Starting model (for MR)	pdb code 9HVP
RMSD bond length	0.009
RMSD bond angle	1.500
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	CNX
Refinement software	CNX

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	33.240	2.900
High resolution limit [Å]	2.800	2.800
Number of reflections	4652
<I/σ(I)>	9.2
Completeness [%]	93.2	97.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	unknown *	4.6	295	Fizgerald, P.M.D., (1990) J. Biol. Chem., 265, 14209. *