6I1C

Crystal structure of Chlamydomonas reinhardtii thioredoxin f2

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID29
Synchrotron site	ESRF
Beamline	ID29
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-07-17
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.9762
Spacegroup name	I 2 2 2
Unit cell lengths	65.383, 97.475, 139.545
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	42.850 - 2.010
R-factor	0.2282
Rwork	0.226
R-free	0.26280
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	Homology modelling by PHYRE2
RMSD bond length	0.008
RMSD bond angle	0.968
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX ((1.11.1_2575: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	42.850	2.082
High resolution limit [Å]	2.010	2.010
Number of reflections	29702
<I/σ(I)>	6.69
Completeness [%]	98.7
Redundancy	1.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	100 mM HEPES-NaOH, pH 7.5, 2% PEG 400, 2.0 M ammonium sulfate