8UOZ

EmrE structure in the TPP-bound state (WT/E14Q heterodimer)

Spectrometer

Experimental method: SOLID-STATE NMR, SOLUTION NMR

Spectrometer ID	Spectrometer maker	Spectrometer model	Spectrometer type	Spectrometer field strength
1	Bruker	AVANCE III		600
2	Bruker	AVANCE III		700
3	Agilent	Direct Drive		600

Experiment

experiment id	conditions id	solution id	Experiment type
1	1	1	2D 1H-13C HSQC
10	1	5	2D 1H-15N TROSY
11	1	6	2D 1H-13C HSQC
12	1	6	2D 1H-15N TROSY
13	1	7	2D 1H-13C HSQC
14	1	7	2D 1H-15N TROSY
15	1	8	2D 1H-13C HSQC
16	1	8	2D 1H-15N TROSY
17	1	9	2D 1H-13C HSQC
18	1	9	2D 1H-15N TROSY
19	1	10	2D 1H-13C HSQC
2	1	1	2D 1H-15N TROSY
20	1	10	2D 1H-15N TROSY
21	1	11	2D 1H-13C HSQC
22	1	11	2D 1H-15N TROSY
23	1	12	2D 1H-13C HSQC
24	1	12	2D 1H-15N TROSY
25	1	13	2D 1H-13C HSQC
26	1	13	2D 1H-15N TROSY
27	1	16	2D 1H-13C HSQC
28	1	16	2D 1H-15N TROSY
29	1	15	3D HNCA
3	1	2	2D 1H-13C HSQC
30	1	17	3D HNCA
31	1	15	3D HNCO
32	1	17	3D HNCO
33	1	15	3D HN(CO)CA
34	1	17	3D HN(CO)CA
35	1	25	3D 1H-13C NOESY
36	1	24	3D 1H-13C NOESY
37	2	18	3D NCACX
38	2	19	3D NCACX
39	2	18	3D NCOCX
4	1	2	2D 1H-15N TROSY
40	2	19	3D NCOCX
41	2	18	3D CANCOCX
42	2	19	3D CANCOCX
43	2	18	3D CANCO
44	2	19	3D CANCO
45	2	18	2D 13C/13C DARR
46	2	19	2D 13C/13C DARR
47	2	20	2D 13C/13C PDSD
48	2	21	2D 13C/13C PDSD
49	2	22	2D 13C/13C PDSD
5	1	3	2D 1H-13C HSQC
50	2	23	2D 13C/13C PDSD
51	3	26	2D 1H/15N PISEMA
6	1	3	2D 1H-15N TROSY
7	1	4	2D 1H-13C HSQC
8	1	4	2D 1H-15N TROSY
9	1	5	2D 1H-13C HSQC

NMR Sample

conditions id	NMR sample pH	NMR sample pressure	NMR sample temperature
1	5.6	1	310
2	5.6	1	273
3	6	1	310

Conformers

Conformers Calculated Total Number	100000
Conformers Submitted Total Number	10