4M8G

Crystal structure of Se-Met hN33/Tusc3

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06SA
Synchrotron site	SLS
Beamline	X06SA
Temperature [K]	100
Detector technology	PIXEL
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.9787
Spacegroup name	P 1 21 1
Unit cell lengths	39.107, 64.456, 62.467
Unit cell angles	90.00, 92.45, 90.00

Refinement procedure

Resolution	44.836 - 2.000
R-factor	0.229
Rwork	0.229
R-free	0.24840
Structure solution method	SAD
RMSD bond length	0.010
RMSD bond angle	1.475
Refinement software	PHENIX ((phenix.refine: 1.8.2_1309))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	64.450	2.110
High resolution limit [Å]	2.000	2.000
Rmerge	0.072	0.322
Number of reflections	20996
<I/σ(I)>	31.1	11.4
Completeness [%]	100.0	100

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.5		0.2 M KSCN, 10.5% PEG 8K, 10% PEG 1K in 100 mM cacodylic acid-NaOH, pH 6.5, VAPOR DIFFUSION, SITTING DROP