2JM0

Solution structure of chicken villin headpiece subdomain containing a fluorinated side chain in the core

Spectrometer

Experimental method: SOLUTION NMR

Spectrometer ID	Spectrometer maker	Spectrometer model	Spectrometer type	Spectrometer field strength
1	Bruker	AVANCE	Bruker Avance	500
2	Bruker	AVANCE	Bruker Avance	600
3	Bruker	AVANCE	Bruker Avance	750
4	Varian	INOVA	Varian INOVA	600
5	Varian	INOVA	Varian INOVA	800
6	Varian	INOVA	Varian INOVA	900

Experiment

experiment id	conditions id	solution id	Experiment type
1	1	1	2D 1H-15N HSQC
10	1	2	2D HNHB
11	1	1	19F-HOESY
2	1	1	2D 1H-13C HSQC
3	1	1	2D COSY
4	1	1	2D TOCSY
5	1	1	2D NOESY
6	1	2	2D 1H-15N HSQC
7	1	2	2D HNCO
8	1	2	2D HNCACB
9	1	2	2D HNHA

NMR Sample

conditions id	NMR sample pH	NMR sample pressure	NMR sample temperature
1	5	ambient	298

Conformers

Conformers Calculated Total Number	100
Conformers Submitted Total Number	20