6KIA

NADH bound structure of FabMG, novel type of Enoyl-acyl carrier protein reductase

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 7A (6B, 6C1)
Synchrotron site	PAL/PLS
Beamline	7A (6B, 6C1)
Temperature [K]	100
Detector technology	CCD
Collection date	2015-10-27
Detector	ADSC QUANTUM 270
Wavelength(s)	0.97934
Spacegroup name	P 21 21 21
Unit cell lengths	63.558, 138.219, 157.408
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	29.809 - 1.598
R-factor	0.224383768772
Rwork	0.224
R-free	0.25864
Structure solution method	SAD
RMSD bond length	0.008
RMSD bond angle	1.182
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.660
High resolution limit [Å]	1.590	1.600
Rmerge	0.100	1.718
Number of reflections	183554	18110
<I/σ(I)>	18.5641	0.91
Completeness [%]	99.6
Redundancy	6.8
CC(1/2)	0.998	0.413

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.5	295	0.1M Bis-Tris(pH 6.5) and 23%(w/v) PEG 3350