4DVI

Crystal structure of Tankyrase 1 with IWR2

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 5.0.2
Synchrotron site	ALS
Beamline	5.0.2
Temperature [K]	100
Detector technology	CCD
Collection date	2001-11-18
Detector	ADSC QUANTUM 315
Wavelength(s)	0.97740
Spacegroup name	P 21 21 21
Unit cell lengths	41.470, 77.940, 146.540
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	50.000 - 1.900
Rwork	0.248
R-free	0.25800
Structure solution method	MOLECULAR REPLACEMENT
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	AMoRE
Refinement software	CNS

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.970
High resolution limit [Å]	1.900	1.900
Rmerge	0.105	0.790
Number of reflections	37889
Completeness [%]	99.9	99.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6	277	100 mM MES pH 6.0, 0.2 or 0.4 M Di-Ammonium Tartrate, 12.5-25% PEG3350, VAPOR DIFFUSION, HANGING DROP, temperature 277K