ISDA: 1OR5

SOLUTION NMR

NMR Experiment

Experiment	Type	Sample Contents	Ionic Strength	Solvent	pH	Pressure	Temprature (K)
1	HNCACB	0.7 TO 1.2 MM 15N,13C 30 MM SODIUM PHOSPHATE PH 5.5; 2 MM DTT; 0.5% NAN3	30 mM PHOSPHATE	?	5.5	AMBIENT	288.00
2	CCONH	0.7 TO 1.2 MM 15N,13C 30 MM SODIUM PHOSPHATE PH 5.5; 2 MM DTT; 0.5% NAN3	30 mM PHOSPHATE	?	5.5	AMBIENT	288.00
3	HCCONH	0.7 TO 1.2 MM 15N,13C 30 MM SODIUM PHOSPHATE PH 5.5; 2 MM DTT; 0.5% NAN3	30 mM PHOSPHATE	?	5.5	AMBIENT	288.00
4	HCCH-TOCSY	0.7 TO 1.2 MM 15N,13C 30 MM SODIUM PHOSPHATE PH 5.5; 2 MM DTT; 0.5% NAN3	30 mM PHOSPHATE	?	5.5	AMBIENT	288.00
5	HCCH-COSY	0.7 TO 1.2 MM 15N,13C 30 MM SODIUM PHOSPHATE PH 5.5; 2 MM DTT; 0.5% NAN3	30 mM PHOSPHATE	?	5.5	AMBIENT	288.00
6	HNHA	0.7 TO 1.2 MM 15N,13C 30 MM SODIUM PHOSPHATE PH 5.5; 2 MM DTT; 0.5% NAN3	30 mM PHOSPHATE	?	5.5	AMBIENT	288.00
7	13C/15N-HSQC-NOESY	0.7 TO 1.2 MM 15N,13C 30 MM SODIUM PHOSPHATE PH 5.5; 2 MM DTT; 0.5% NAN3	30 mM PHOSPHATE	?	5.5	AMBIENT	288.00
8	15N-HSQC-NOESY	0.7 TO 1.2 MM 15N,13C 30 MM SODIUM PHOSPHATE PH 5.5; 2 MM DTT; 0.5% NAN3	30 mM PHOSPHATE	?	5.5	AMBIENT	288.00

NMR Spectrometer Information

Spectrometer	Manufacturer	Model	Field Strength

NMR Refinement

Method	Details	Software
TORSION ANGLE DYNAMICS SIMULATED ANNEALING	?	1

NMR Ensemble Information

Conformer Selection Criteria	?
Conformers Calculated Total Number	?
Conformers Submitted Total Number	1
Representative Model	()

Computation: NMR Software

#	Classification	Version	Software Name	Author
1	refinement	1.5	DYANA	?
2	structure solution	?	NMRPipe	?
3	structure solution	?	Sparky	?