6SM6

AntF (holo): type II PKS acyl-carrier protein

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	2016-06-18
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.0
Spacegroup name	P 41 21 2
Unit cell lengths	59.080, 59.080, 151.230
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	15.000 - 2.400
R-factor	0.1902
Rwork	0.188
R-free	0.22660
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6sm4
RMSD bond length	0.006
RMSD bond angle	1.012
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	REFMAC
Refinement software	REFMAC (5.8.0158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.500
High resolution limit [Å]	2.400	2.400
Rmerge	0.054	0.494
Number of reflections	11070	1236
<I/σ(I)>	18.2	3.6
Completeness [%]	99.0	99.9
Redundancy	5.3
CC(1/2)	0.999	0.943

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	0.1 M citric acid, 3.2 M (NH4)2SO4