4EGH

Hsp90-alpha ATPase domain in complex with (4-Hydroxyphenyl)morpholin-4-yl methanone

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SEALED TUBE
Source details	OTHER
Temperature [K]	100
Detector technology	CCD
Collection date	2011-03-03
Detector	APEX II CCD
Wavelength(s)	1.5418
Spacegroup name	I 2 2 2
Unit cell lengths	65.870, 89.660, 100.120
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	55.030 - 1.600
R-factor	0.17851
Rwork	0.176
R-free	0.22578
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.023
RMSD bond angle	1.886
Data reduction software	PROTEUM2 (suite)
Data scaling software	PROTEUM2 (suite)
Phasing software	PHASER
Refinement software	REFMAC (5.5.0110)

Data quality characteristics

	Overall
Low resolution limit [Å]	55.030
High resolution limit [Å]	1.600
Number of reflections	39464
Redundancy	13.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.2	273	0.2M MgCl2, 0.1M HEPES, 20%w/v PEG2000, pH 7.2, VAPOR DIFFUSION, HANGING DROP, temperature 273K