2YKJ

Tricyclic series of Hsp90 inhibitors

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	NONIUS
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2005-09-06
Detector	MAR scanner 345 mm plate
Spacegroup name	I 2 2 2
Unit cell lengths	66.584, 90.757, 98.818
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	67.420 - 1.460
R-factor	0.252
Rwork	0.252
R-free	0.25200
Structure solution method	OTHER
RMSD bond length	0.005
RMSD bond angle	1.210
Refinement software	CNS (1.0)

Data quality characteristics

	Overall
Low resolution limit [Å]	67.420
High resolution limit [Å]	1.460
Rmerge	0.080
Number of reflections	52242
Completeness [%]	96.2
Redundancy	3.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1		7.5		pH 7.5