6GBC

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

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06SA
Synchrotron site	SLS
Beamline	X06SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-02-23
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.0
Spacegroup name	I 2 2 2
Unit cell lengths	65.840, 123.900, 131.540
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	65.771 - 1.590
R-factor	0.178
Rwork	0.177
R-free	0.19400
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5g2r
RMSD bond length	0.010
RMSD bond angle	1.180
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]	65.771	1.728
High resolution limit [Å]	1.590	1.590
Rmerge	0.055	1.433
Rmeas	0.060	1.544
Rpim	0.022	0.573
Number of reflections	51433	2572
<I/σ(I)>	21.1
Completeness [%]	70.9	16.2
Redundancy	13.4	14
CC(1/2)	0.999	0.738

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.5	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 % (w/v) PEG 8000; 0.015 M sodium molybdate