9IJW

Serine protease inhibitor HCIQ2c1 from Heteractis crispa with TRPA1 mediated antinociceptive activity

Spectrometer

Experimental method: SOLUTION NMR

Spectrometer ID	Spectrometer maker	Spectrometer model	Spectrometer type	Spectrometer field strength
1	Bruker	AVANCE III		600
2	Bruker	AVANCE III		800

Experiment

experiment id	conditions id	solution id	Experiment type
1	2	1	NOESY
2	2	1	2D 1H-1H TOCSY
3	2	2	3D 1H-15N TOCSY
4	2	2	3D 1H-15N TOCSY
5	2	2	2D 1H-15N HSQC
6	2	2	3D HNHA
7	2	2	3D HNHB

NMR Sample

conditions id	NMR sample pH	NMR sample pressure	NMR sample temperature
2	4.5	AMBIENT	303

Conformers

Conformers Calculated Total Number	200
Conformers Submitted Total Number	20