6OB1

Structure of WHB in complex with Ubiquitin Variant

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		700
3	Bruker	AVANCE III		800

Experiment

experiment id	conditions id	solution id	Experiment type
1	1	1	2D 1H-15N HSQC
10	1	1	3D 1H-13C NOESY aromatic
11	1	1	3D 1H-13C filtered NOESY
12	1	1	3D HBHA(CO)NH
13	2	2	2D 1H-15N HSQC
14	2	2	2D 1H-13C HSQC aliphatic
15	2	2	2D 1H-13C HSQC aromatic
16	2	2	3D HNCACB
17	2	2	3D HNCA
18	2	2	3D HBHA(CO)NH
19	2	2	3D 1H-15N NOESY
2	1	1	2D 1H-13C HSQC aliphatic
20	2	2	3D 1H-13C NOESY aliphatic
21	2	2	3D 1H-13C NOESY aromatic
22	2	2	3D H(CCO)NH
23	2	2	3D 1H-13C filtered NOESY
3	1	1	2D 1H-13C HSQC aromatic
4	1	1	3D CBCA(CO)NH
5	1	1	3D HNCACB
6	1	1	3D HCCH-TOCSY
7	1	1	3D HNCA
8	1	1	3D 1H-15N NOESY
9	1	1	3D 1H-13C NOESY aliphatic

NMR Sample

conditions id	NMR sample pH	NMR sample pressure	NMR sample temperature
1	7	atmospheric	308

Conformers

Conformers Calculated Total Number	400
Conformers Submitted Total Number	20