1AM0

AMP RNA APTAMER COMPLEX, NMR, 8 STRUCTURES

SOLUTION NMR

NMR Experiment
Experiment	Type	Sample Contents	Solvent	Ionic Strength	pH	Pressure	Temperature (K)	Spectrometer
1	IN D2O - NOESY				6.7		288
2	COSY				6.7		288
3	TOCSY				6.7		288
4	2D (1)H-(31)P COSY				6.7		288
5	2D(1)H-(13)C CT HSQC				6.7		288
6	3D (1)H-(13)C-(1)H NOESY-HMQC				6.7		288
7	HCCH-TOCSY				6.7		288
8	HCCH-COSY. DISTANCE RESTRAINTS FROM 120 MS NOESY				6.7		288
9	120 MS 3D NOESY-HMQC.				6.7		288

NMR Spectrometer Information
Spectrometer	Manufacturer	Model	Field Strength
1	Varian	UNITYPLUS	600
2	Varian	UNITYPLUS	500

NMR Refinement
Method	Details	Software
DISTANCE GEOMETRY AND RESTRAINED MOLECULAR DYNAMICS		X-PLOR 3.1F

NMR Ensemble Information
Conformer Selection Criteria	LEAST RESTRAINT VIOLATION
Conformers Calculated Total Number	8
Conformers Submitted Total Number	8

Computation: NMR Software
#	Classification	Version	Software Name	Author
1	refinement	X-PLOR 3.1F	3.1F	BRUNGER

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM133198.