5VX6

Structure of Bacillus subtilis Inhibitor of motility (MotI/DgrA)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 4.2.2
Synchrotron site	ALS
Beamline	4.2.2
Temperature [K]	100
Detector technology	CMOS
Collection date	2015-07-18
Detector	RDI CMOS_8M
Wavelength(s)	0.9763
Spacegroup name	P 65 2 2
Unit cell lengths	75.410, 75.410, 402.470
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	46.793 - 3.197
R-factor	0.2402
Rwork	0.236
R-free	0.27740
Structure solution method	SAD
RMSD bond length	0.004
RMSD bond angle	0.861
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	autoSHARP
Refinement software	PHENIX ((1.10_2155: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	3.260
High resolution limit [Å]	3.197	3.197
Rmerge	0.138
Rpim	0.036	0.152
Number of reflections	11077	559
<I/σ(I)>	17	2.4
Completeness [%]	98.9	93.5
Redundancy	15.4	5.9
CC(1/2)		0.925

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	293	23- 24 % PEG3350 0.1M Bis-Tris Propane pH-6.5 0.2M Na-K tartarate