5FCK

COMPLEMENT FACTOR D IN COMPLEX WITH COMPOUND 5

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU FR-E SUPERBRIGHT
Temperature [K]	100
Detector technology	CCD
Collection date	2011-11-24
Detector	RIGAKU SATURN 92
Wavelength(s)	1.54
Spacegroup name	P 1 21 1
Unit cell lengths	38.266, 48.742, 54.730
Unit cell angles	90.00, 108.82, 90.00

Refinement procedure

Resolution	22.870 - 1.860
R-factor	0.18935
Rwork	0.187
R-free	0.23720
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5fbe
RMSD bond length	0.017
RMSD bond angle	1.914
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0071)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	22.870	1.910
High resolution limit [Å]	1.860	1.860
Rmerge	0.059	0.194
Number of reflections	14490
<I/σ(I)>	11.7
Completeness [%]	89.8	49.8
Redundancy	2.4	1.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	1 uL FD solution (18 mg/mL FD, 10 mM Tris pH 7.0, 100 mM NaCl) was mixed with 1 uL reservoir solution (25% PEG3350, 100 mM TRIS pH 8.0) and equilibrated against 1 mL reservoir solution.