5XFT

Crystal structure of Chlamydomonas reinhardtii dehydroascorbate reductase

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU FR-E+ SUPERBRIGHT
Temperature [K]	100
Detector technology	AREA DETECTOR
Collection date	2016-10-14
Detector	RIGAKU RAXIS HTC
Wavelength(s)	1.54
Spacegroup name	P 41 21 2
Unit cell lengths	104.598, 104.598, 47.652
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	29.215 - 2.460
R-factor	0.1903
Rwork	0.189
R-free	0.22150
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5d9t
RMSD bond length	0.005
RMSD bond angle	0.744
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MOLREP
Refinement software	PHENIX ((1.10.1_2155))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	2.550
High resolution limit [Å]	2.460	2.460
Rmerge		0.642
Number of reflections	9862
<I/σ(I)>	28.1	2.1
Completeness [%]	97.7
Redundancy	7.8	5.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8	298	0.1 M Tris-HCl, pH 8.0, with 2 M ammonium sulfate