3T2S

HSP90 N-terminal domain bound to AGS

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U
Synchrotron site	SSRF
Beamline	BL17U
Temperature [K]	200
Detector technology	CCD
Detector	ADSC QUANTUM 315r
Spacegroup name	P 1
Unit cell lengths	43.237, 55.939, 60.550
Unit cell angles	93.61, 95.60, 112.61

Refinement procedure

Resolution	41.271 - 1.501
R-factor	0.1858
Rwork	0.185
R-free	0.22590
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1yes
RMSD bond length	0.013
RMSD bond angle	1.470
Refinement software	PHENIX ((phenix.refine: 1.7_650))

Data quality characteristics

	Overall
Low resolution limit [Å]	50.000
High resolution limit [Å]	1.500
Rmerge	0.268
Number of reflections	78308
<I/σ(I)>	6.376
Completeness [%]	94.8
Redundancy	3.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8.5		20~25% PEG 4000, 200mM magnesium chloride, 100mM Tris pH 8.5, VAPOR DIFFUSION, HANGING DROP