5MY0

KS-MAT DI-DOMAIN OF MOUSE FAS WITH MALONYL-COA

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	2015-10-10
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.97852
Spacegroup name	C 2 2 21
Unit cell lengths	147.044, 354.390, 217.463
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	49.560 - 2.940
R-factor	0.18998
Rwork	0.188
R-free	0.22208
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3hhd
RMSD bond length	0.013
RMSD bond angle	1.762
Data reduction software	XDS
Data scaling software	Aimless (0.5.1)
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0158)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	49.500	48.550	2.950
High resolution limit [Å]	2.900	15.880	2.900
Rmerge	0.228	0.032	1.933
Rmeas	0.249	0.035	2.110
Rpim	0.097	0.014	0.821
Number of reflections	120224
<I/σ(I)>	9.5
Completeness [%]	96.4	91	98.8
Redundancy	6.5	6.2	6.6
CC(1/2)	0.978	0.999	0.310

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		295	0.2M Na-K-Tartrate 20 % PEG3350