5AYT

Crystal structure of transthyretin in complex with L6

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE AR-NW12A
Synchrotron site	Photon Factory
Beamline	AR-NW12A
Temperature [K]	100
Detector technology	CCD
Collection date	2014-05-18
Detector	ADSC QUANTUM 210
Wavelength(s)	1
Spacegroup name	P 21 21 2
Unit cell lengths	43.578, 84.814, 65.291
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	36.250 - 1.400
R-factor	0.19047
Rwork	0.189
R-free	0.20890
RMSD bond length	0.014
RMSD bond angle	1.667
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	MOLREP
Refinement software	REFMAC (5.7.0029)

Data quality characteristics

	Overall
Low resolution limit [Å]	36.250
High resolution limit [Å]	1.400
Number of reflections	46782
<I/σ(I)>	27.4
Completeness [%]	96.2
Redundancy	4.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	293	18% polyethylene glycol 400, 0.1 M HEPES-NaOH, 0.2 M CaCl2, 1 mM L6