6GBF

The Structure of variant R369A of the Mo-insertase domain Cnx1E from Arabidopsis thaliana in complex with AMP

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	BESSY BEAMLINE 14.1
Synchrotron site	BESSY
Beamline	14.1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-06-02
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.91840
Spacegroup name	I 2 2 2
Unit cell lengths	66.030, 123.970, 132.680
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	25.070 - 1.712
R-factor	0.174
Rwork	0.173
R-free	0.19900
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5g2r
RMSD bond length	0.010
RMSD bond angle	1.070
Data reduction software	XDS (Jun 1, 2017)
Data scaling software	STARANISO (1.10.9)
Phasing software	PHASER (2.8.1)
Refinement software	BUSTER (2.10.3)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	66.340	1.849
High resolution limit [Å]	1.712	1.712
Rmerge	0.042	0.770
Rmeas	0.054	1.022
Rpim	0.034	0.665
Number of reflections	42230	2113
<I/σ(I)>	16.9	1.5
Completeness [%]	71.7	17.7
Redundancy	4.4	4.2
CC(1/2)	0.999	0.615

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	0.1 M imidazole, 0.1 M MES pH 6.5; 0.06 M sodium nitrate, 0.06 M sodium phosphate, 0.06 M ammonium sulfate; 20 % (v/v) PEG 500 MME, 10 % PEG 8000