1W5Y

HIV-1 protease in complex with fluoro substituted diol-based C2- symmetric inhibitor

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	MAX II BEAMLINE I711
Synchrotron site	MAX II
Beamline	I711
Temperature [K]	278
Spacegroup name	P 21 21 2
Unit cell lengths	59.158, 86.954, 47.218
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	30.000 - 1.900
R-factor	0.188
Rwork	0.188
R-free	0.21800
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.006
RMSD bond angle	1.200
Refinement software	CNS (1.1)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.970
High resolution limit [Å]	1.900	1.900
Rmerge	0.110
Number of reflections	16080
Completeness [%]	97.2
Redundancy	2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1