6COJ

Crystal structure of Rhodococcus jostii RHA1 IpdAB E105A COCHEA-COA complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	CLSI BEAMLINE 08B1-1
Synchrotron site	CLSI
Beamline	08B1-1
Temperature [K]	100
Detector technology	CCD
Collection date	2016-12-16
Detector	RAYONIX MX300HE
Wavelength(s)	0.97874
Spacegroup name	P 43 21 2
Unit cell lengths	69.172, 69.172, 241.873
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.912 - 1.400
R-factor	0.1535
Rwork	0.152
R-free	0.17350
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6co6
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.13_2998)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.912	1.450
High resolution limit [Å]	1.400	1.400
Rmerge	0.054	1.336
Number of reflections	116084	11331
<I/σ(I)>	20.62
Completeness [%]	100.0
Redundancy	7.1
CC(1/2)	1.000	0.624

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	1.9 M ammonium sulfate, 0.2 M sodium potassium tartrate