6N34

Crystal structure of the BTB domain of Human NS1-BP

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	2015-07-16
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.9795
Spacegroup name	P 21 21 21
Unit cell lengths	41.866, 72.599, 92.858
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	38.166 - 2.800
R-factor	0.2321
Rwork	0.225
R-free	0.29740
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3i3n
RMSD bond length	0.009
RMSD bond angle	0.992
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHENIX
Refinement software	PHENIX

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.850
High resolution limit [Å]	2.800	7.590	2.800
Rmerge	0.127	0.099	0.743
Rmeas	0.139	0.109	0.899
Rpim	0.057	0.044	0.496
Number of reflections	7423	439	333
<I/σ(I)>	10.1
Completeness [%]	98.9	98.9	96.2
Redundancy	5.4	5.4	2.7
CC(1/2)		0.997	0.553

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.5	293.15	0.2 M Ammonium sulfate, 0.1 M Tris pH 8.5, 25% w/v Polyethylene glycol 3,350