1HSI

CRYSTAL STRUCTURE AT 1.9 ANGSTROMS RESOLUTION OF HUMAN IMMUNODEFICIENCY VIRUS (HIV) II PROTEASE COMPLEXED WITH L-735,524, AN ORALLY BIOAVAILABLE INHIBITOR OF THE HIV PROTEASES

Experimental procedure

Spacegroup name	P 1 21 1
Unit cell lengths	36.760, 58.440, 55.110
Unit cell angles	90.00, 91.20, 90.00

Refinement procedure

Resolution	? - 2.500
R-factor	0.166
Rwork	0.166
RMSD bond length	0.009
RMSD bond angle	1.400
Phasing software	X-PLOR
Refinement software	X-PLOR

Data quality characteristics

	Overall
High resolution limit [Å]	2.500 *
Rmerge	0.047 *
Total number of observations	26671 *
Number of reflections	7188 *
Completeness [%]	94.5 *

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	reservoir	HEPES	0.1 (M)
2	1	reservoir	PEG4000	20 (%)
3	1	reservoir	n-butanol	4 (%)