4LWI

Crystal Structure of the human Hsp90-alpha N-domain bound to the hsp90 inhibitor FJ6

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U
Synchrotron site	SSRF
Beamline	BL17U
Temperature [K]	100
Detector technology	CCD
Detector	ADSC QUANTUM 315r
Spacegroup name	I 2 2 2
Unit cell lengths	65.666, 89.256, 99.715
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	34.615 - 1.700
R-factor	0.1922
Rwork	0.191
R-free	0.21330
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3t0z
RMSD bond length	0.006
RMSD bond angle	1.113
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX ((phenix.refine: 1.8.1_1168))

Data quality characteristics

	Overall
Low resolution limit [Å]	34.615
High resolution limit [Å]	1.700
Rmerge	0.076
Number of reflections	32571
<I/σ(I)>	48.273
Completeness [%]	99.9
Redundancy	7.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1