5JMV

Crystal structure of mjKae1-pfuPcc1 complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-C
Synchrotron site	APS
Beamline	24-ID-C
Temperature [K]	93.15
Detector technology	PIXEL
Collection date	2014-02-16
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.9792
Spacegroup name	P 43 21 2
Unit cell lengths	121.913, 121.913, 310.613
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.241 - 3.386
R-factor	0.202641779643
Rwork	0.200
R-free	0.24321
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2IVP for chains A-C and 3ENC for chains D-H
RMSD bond length	0.002
RMSD bond angle	0.674
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall
Low resolution limit [Å]	50.000
High resolution limit [Å]	3.400
Number of reflections	33825
<I/σ(I)>	13.6
Completeness [%]	99.9
Redundancy	8.4
CC(1/2)	0.439

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.5	293.15	0.1 M Sodium Cacodylate pH 6.5 and 1.26 M Ammonium Sulfate