5K1G

Crystal structure of reduced Prx3 from Vibrio vulnificus

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 5C (4A)
Synchrotron site	PAL/PLS
Beamline	5C (4A)
Temperature [K]	100.15
Detector technology	CCD
Collection date	2015-06-08
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.97960
Spacegroup name	P 32 2 1
Unit cell lengths	73.871, 73.871, 62.254
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	31.987 - 1.899
R-factor	0.224
Rwork	0.220
R-free	0.25790
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4f82
RMSD bond length	0.002
RMSD bond angle	0.574
Data reduction software	DENZO
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]	50.000	1.930
High resolution limit [Å]	1.899	1.900
Rmerge	0.058
Number of reflections	15873
<I/σ(I)>	4.57
Completeness [%]	99.3
Redundancy	13.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	287.15	0.8 M sodium acetate, 0.1 M Tris-HCl, 0.2M sodium chloride