5JLJ

Crystal Structure of KPT8602 in complex with CRM1-Ran-RanBP1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 19-ID
Synchrotron site	APS
Beamline	19-ID
Temperature [K]	93
Detector technology	CCD
Collection date	2014-02-21
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.9795
Spacegroup name	P 43 21 2
Unit cell lengths	105.929, 105.929, 305.135
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	50.000 - 2.500
R-factor	0.1976
Rwork	0.196
R-free	0.23200
Structure solution method	FOURIER SYNTHESIS
Starting model (for MR)	4hb2
RMSD bond length	0.008
RMSD bond angle	0.732
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.10.1_2155)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.540
High resolution limit [Å]	2.500	6.780	2.500
Rmerge	0.085	0.018	0.877
Rmeas	0.093
Rpim	0.036
Total number of observations	388048
Number of reflections	60851
<I/σ(I)>	7.5
Completeness [%]	99.9	99.4	100
Redundancy	6.4	5.8	6.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.6	298	17% PEG3350, 100mM Bis-Tris pH6.6, 200mM Ammounium Nitrate