4M8S

Crystal structure of 3-ketoacyl -(acyl carrier protein) reductase (FabG) from Neisseria meningitidis

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	AUSTRALIAN SYNCHROTRON BEAMLINE MX2
Synchrotron site	Australian Synchrotron
Beamline	MX2
Temperature [K]	100
Detector technology	CCD
Collection date	2013-03-05
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.9537
Spacegroup name	P 21 21 21
Unit cell lengths	66.890, 111.270, 117.100
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	34.540 - 2.000
R-factor	0.17453
Rwork	0.173
R-free	0.19881
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.008
RMSD bond angle	1.189
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	REFMAC (5.7.0032)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	35.360	35.360	2.050
High resolution limit [Å]	2.000	8.940	2.000
Number of reflections	59818
Completeness [%]	100.0	98.5	99.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		296.15	250mM Ammonium phosphate dibasic, 25% PEG 3350, VAPOR DIFFUSION, HANGING DROP, temperature 296.15K