3E4V

Crystal structure of NADH:FMN oxidoreductase like protein in complex with FMN (YP_544701.1) from METHYLOBACILLUS FLAGELLATUS KT at 1.40 A resolution

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL1-5
Synchrotron site	SSRL
Beamline	BL1-5
Temperature [K]	100
Detector technology	CCD
Collection date	2008-06-28
Detector	ADSC QUANTUM 315
Spacegroup name	P 21 21 21
Unit cell lengths	50.010, 64.840, 100.170
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	29.683 - 1.400
R-factor	0.121
Rwork	0.119
R-free	0.15100
Structure solution method	SAD
RMSD bond length	0.014
RMSD bond angle	1.531
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	SHELX
Refinement software	REFMAC (5.4.0069)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	29.683		1.450
High resolution limit [Å]	1.400	3.010	1.400
Rmerge	0.037	0.018	0.453
Number of reflections	64048	12313	10809
<I/σ(I)>	17.74	50.2	1.8
Completeness [%]	97.9	98.4	87.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	4.5	277	0.2M calcium acetate, 30.0% polyethylene glycol 400, 0.1M sodium acetate pH 4.5, VAPOR DIFFUSION,SITTING DROP,NANODROP, temperature 277K, VAPOR DIFFUSION, SITTING DROP