2JTO

Solution Structure of Tick Carboxypeptidase Inhibitor

Spectrometer

Experimental method: SOLUTION NMR

Spectrometer ID	Spectrometer maker	Spectrometer model	Spectrometer type	Spectrometer field strength
1	Bruker	AVANCE	Bruker Avance	600
2	Bruker	AVANCE	Bruker Avance	700

Experiment

experiment id	conditions id	solution id	Experiment type
1	1	1	2D 1H-1H NOESY
10	1	2	3D HNHA
11	1	2	3D HNHB
12	1	3	2D 1H-15N HSQC
13	1	3	2D 1H-13C HSQC
14	1	3	3D HNCO
15	1	3	3D CBCA(CO)NH
16	1	3	3D HNCACB
17	1	3	3D C(CO)NH
2	1	1	2D 1H-1H TOCSY
3	1	1	2D 1H-1H COSY
4	1	2	2D 1H-15N HSQC
5	1	2	3D 1H-15N NOESY
6	1	2	3D 1H-15N TOCSY
7	1	2	2D 1H-1H NOESY
8	1	2	2D 1H-1H TOCSY
9	1	2	2D 1H-15N HSQC

NMR Sample

conditions id	NMR sample pH	NMR sample pressure	NMR sample temperature
1	5.6	ambient	298

Conformers

Conformers Calculated Total Number	20
Conformers Submitted Total Number	20