2MB3

Solution structure of an intramolecular (3+1) human telomeric G-quadruplex bound to a telomestatin derivative

Spectrometer

Experimental method: SOLUTION NMR

Spectrometer ID	Spectrometer maker	Spectrometer model	Spectrometer type	Spectrometer field strength
1	Bruker	AMX	Bruker AMX	600
2	Bruker	AMX	Bruker AMX	700
3	Bruker	AMX	Bruker AMX	400

Experiment

experiment id	conditions id	solution id	Experiment type
1	3	2	2D 1H-1H TOCSY
10	2	5	2D 1H-13C HSQC aliphatic
11	2	4	2D 1H-13C HSQC aliphatic
12	2	4	2D 1H-13C HSQC aromatic
13	2	3	1D JRHMBC
14	3	2	2D 1H-31P HSQC
2	3	1	2D 1H-1H TOCSY
3	3	1	2D 1H-1H NOESY
4	3	2	2D 1H-1H NOESY
5	1	2	2D 1H-1H NOESY
6	2	2	2D 1H-1H NOESY
7	3	2	2D 1H-13C HSQC aromatic
8	2	5	2D 1H-13C HSQC aromatic
9	3	2	2D 1H-13C HSQC aliphatic

NMR Sample

conditions id	NMR sample pH	NMR sample pressure	NMR sample temperature
1	7	ambient	310
2	7		298
3	7		298

Conformers

Conformers Calculated Total Number	100
Conformers Submitted Total Number	10