2XJJ

Structure of HSP90 with small molecule inhibitor bound

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Temperature [K]	100
Spacegroup name	P 1
Unit cell lengths	39.326, 56.098, 61.607
Unit cell angles	82.59, 84.71, 69.24

Refinement procedure

Resolution	36.600 - 1.900
R-factor	0.1857
Rwork	0.183
R-free	0.23250
Structure solution method	OTHER
Starting model (for MR)	NONE
RMSD bond length	0.013
RMSD bond angle	1.150
Refinement software	BUSTER-TNT (2.9.2)

Data quality characteristics

	Overall
Low resolution limit [Å]	36.600
High resolution limit [Å]	1.900
Rmerge	0.050
Number of reflections	38441
Completeness [%]	91.1
Redundancy	3.34

Crystallization Conditions

crystal ID	method	pH	temperature	details
1