8X1G

Human adenylate kinase 1 (hAK1) mutant-R97W

Spectrometer

Experimental method: SOLUTION NMR

Spectrometer ID	Spectrometer maker	Spectrometer model	Spectrometer type	Spectrometer field strength
1	Bruker	AVANCE III		850

Experiment

experiment id	conditions id	solution id	Experiment type
1	1	1	2D 1H-15N HSQC
10	1	2	3D HN(CA)CO
11	1	2	3D HNCO
12	1	2	3D HN(CO)CA
13	1	3	(HB)CB(CGCD)HD
14	1	3	3D 13C-edited NOESY-HSQC
15	1	2	3D 15N-edited NOESY-HSQC
16	1	3	3D CCH-TOCSY
17	1	3	(HB)CB(CGCDCE)HE
2	1	3	2D 1H-13C HSQC
3	1	2	3D HNCACB
4	1	2	3D CBCA(CO)NH
5	1	2	3D HNCA
6	1	3	3D HCCH-TOCSY
7	1	2	3D HBHA(CO)NH
8	1	2	3D CC(CO)NH
9	1	2	3D H(CCO)NH

NMR Sample

conditions id	NMR sample pH	NMR sample pressure	NMR sample temperature
1	6.2	1	298

Conformers

Conformers Calculated Total Number	300
Conformers Submitted Total Number	20