4TVE

Structure Of the First Two Thioredoxin Domains of Naumovozyma dairenensis Eps1p

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID23-1
Synchrotron site	ESRF
Beamline	ID23-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2013-12-14
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.9763
Spacegroup name	P 21 21 21
Unit cell lengths	42.678, 63.584, 119.207
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	40.181 - 1.800
R-factor	0.1759
Rwork	0.173
R-free	0.21170
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2b5e 3t59
RMSD bond length	0.007
RMSD bond angle	0.979
Data scaling software	HKL-2000 (HKL2000_704)
Refinement software	PHENIX ((phenix.refine: 1.8.4_1496))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.860
High resolution limit [Å]	1.800	1.800
Number of reflections	30298
<I/σ(I)>	9.8	2.9
Completeness [%]	97.8	92.8
Redundancy	8.2	8.1

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6	293	25% w/v PEG 8,000, 0.1 M MES buffer, pH 6.0, 0.2 M calcium acetate