2JZV

Solution structure of S. aureus PrsA-PPIase

Spectrometer

Experimental method: SOLUTION NMR

Spectrometer ID	Spectrometer maker	Spectrometer model	Spectrometer type	Spectrometer field strength
1	Varian	INOVA	Varian INOVA	800
2	Varian	INOVA	Varian INOVA	600
3	Varian	INOVA	Varian INOVA	500
4	Bruker	DRX	Bruker DRX	500

Experiment

experiment id	conditions id	solution id	Experiment type
1	1	2	2D 1H-15N HSQC
10	1	2	3D HCCH-COSY
11	1	2	3D 1H-15N NOESY
12	1	2	3D 1H-13C NOESY
13	1	2	3D iHNCA
14	1	2	3D 1H-13C NOESY (AROM)
15	1	2	(H )C (C C )H
16	1	2	(H )C (C C C )H
17	1	2	J(CN) intensity modulated constant time 13C-HSQC
18	1	1	3D R1 resolved 1H-15N-HSQC
19	1	1	3D R2 resolved 1H-15N-HSQC
2	1	2	2D 1H-13C HSQC
20	1	1	exchange rate resolved 1H-15N-HSQC
3	1	2	3D CBCA(CO)NH
4	1	2	3D C(CO)NH
5	1	2	3D HNCO
6	1	2	3D HNCACB
7	1	2	3D HN(CO)CA
8	1	2	3D H(CCO)NH
9	1	2	3D HCCH-TOCSY

NMR Sample

conditions id	NMR sample pH	NMR sample pressure	NMR sample temperature
1	6.8	ambient	298

Conformers

Conformers Calculated Total Number	400
Conformers Submitted Total Number	25