4N40

Crystal structure of human Epithelial cell-transforming sequence 2 protein

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U
Synchrotron site	SSRF
Beamline	BL17U
Temperature [K]	100
Detector technology	CCD
Collection date	2012-04-20
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.9793
Spacegroup name	H 3
Unit cell lengths	123.700, 123.700, 89.244
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	36.873 - 3.106
R-factor	0.2169
Rwork	0.214
R-free	0.28140
Structure solution method	SAD
RMSD bond length	0.012
RMSD bond angle	1.655
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	PHASES
Refinement software	REFMAC

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	3.150
High resolution limit [Å]	3.100	8.400	3.100
Rmerge	0.098	0.072	0.956
Number of reflections	9161
<I/σ(I)>	8.7
Completeness [%]	99.9	97.8	99.8
Redundancy	4.4	4.3	4.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8	283	100mM MES, 14% MPEG 5000, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 283K
1	VAPOR DIFFUSION, HANGING DROP	8	283	100mM MES, 14% MPEG 5000, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 283K