4YTE

N-terminal domain of HmdIII from Methanocaldococcus jannaschii

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X10SA
Synchrotron site	SLS
Beamline	X10SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2014-03-31
Detector	PSI PILATUS 6M
Wavelength(s)	0.971
Spacegroup name	P 32 2 1
Unit cell lengths	53.780, 53.780, 127.270
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	46.575 - 2.150
R-factor	0.2271
Rwork	0.226
R-free	0.25560
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	N-terminal domain of HmdII from M. jannaschii
RMSD bond length	0.002
RMSD bond angle	0.669
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000		2.250
High resolution limit [Å]	2.150	12.000	2.150
Rmerge	0.101	0.037	0.693
Rmeas	0.107	0.040	0.775
Total number of observations	99182
Number of reflections	12012	98	1364
<I/σ(I)>	17.08	47.59	2.5
Completeness [%]	98.4	98	90.6
Redundancy	8.3		4.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	281	20 % (w/v) PEG3350, 0.2M sodium thiocyanate