8H0M

Crystal structure of VioD

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U1
Synchrotron site	SSRF
Beamline	BL17U1
Temperature [K]	173
Detector technology	CCD
Collection date	2013-05-31
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.979
Spacegroup name	P 64
Unit cell lengths	90.039, 90.039, 94.582
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	19.670 - 1.702
Rwork	0.205
R-free	0.22500
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3c4a
RMSD bond length	0.009
RMSD bond angle	1.070
Data reduction software	XDS
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	PHENIX (v1.16)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	19.670	1.730
High resolution limit [Å]	1.700	1.700
Rpim	0.035	0.464
Number of reflections	47638	2501
<I/σ(I)>	13.5
Completeness [%]	99.9
Redundancy	11
CC(1/2)	0.996	0.597

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		295	Na Formate