9RY5

Transthyretin bivalent stabiliser complex

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04-1
Synchrotron site	Diamond
Beamline	I04-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-05-01
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.91741
Spacegroup name	P 21 21 2
Unit cell lengths	85.430, 43.660, 64.670
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	42.750 - 1.240
R-factor	0.16744
Rwork	0.165
R-free	0.20503
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.011
RMSD bond angle	1.948
Data reduction software	xia2
Data scaling software	xia2
Phasing software	PHASER
Refinement software	REFMAC (5.8.0425)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	43.660	5.550
High resolution limit [Å]	1.240	1.240
Rmerge	0.059
Rmeas	0.064
Number of reflections	69058	11202
<I/σ(I)>	17.5
Completeness [%]	99.6
Redundancy	12.9
CC(1/2)	0.999	0.553

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.4	293	peg 400, calcium chloride, hepes