2K6Y

Solution structures of apo form PCuA (cis conformation of the peptide bond involving the nitrogen of P14)

Spectrometer

Experimental method: SOLUTION NMR

Spectrometer ID	Spectrometer maker	Spectrometer model	Spectrometer type	Spectrometer field strength
1	Bruker	AVANCE	Bruker Avance	900
2	Bruker	AVANCE	Bruker Avance	500
3	Bruker	AVANCE	Bruker Avance	400

Experiment

experiment id	conditions id	solution id	Experiment type
1	1	1	2D 1H-15N HSQC
10	1	2	3D 1H-13C NOESY
11	1	1	2D 1H-1H NOESY
12	1	1	15N R2
13	1	1	15N R1
14	1	1	1H-15N NOE
2	1	2	2D 1H-13C HSQC
3	1	2	3D CBCA(CO)NH
4	1	2	3D HNCO
5	1	2	3D HNCA
6	1	2	3D HNCACB
7	1	2	3D HCCH-TOCSY
8	1	2	3D HBHA(CO)NH
9	1	1	3D 1H-15N NOESY

NMR Sample

conditions id	NMR sample pH	NMR sample pressure	NMR sample temperature
1	7.2	ambient	298

Conformers

Conformers Calculated Total Number	31
Conformers Submitted Total Number	31