SOLUTION NMR
| NMR Experiment | ||||||||
|---|---|---|---|---|---|---|---|---|
| Experiment | Type | Sample Contents | Solvent | Ionic Strength | pH | Pressure | Temperature (K) | Spectrometer |
| 1 | SEE PUBLICATION | 90% WATER/10% D2O | 50 mM | 6.8 | 1.0 atm | 298.0 | ||
| NMR Spectrometer Information | |||
|---|---|---|---|
| Spectrometer | Manufacturer | Model | Field Strength |
| 1 | Bruker | AVANCE | 400 |
| 2 | Bruker | AVANCE | 700 |
| 3 | Bruker | AVANCE | 800 |
| 4 | Bruker | DRX | 600 |
| NMR Refinement | ||
|---|---|---|
| Method | Details | Software |
| MANUAL | REFINEMENT DETAILS CAN BE FOUND IN JRNL CITATION ABOVE | Xplor-NIH |
| NMR Ensemble Information | |
|---|---|
| Conformer Selection Criteria | LEAST RESTRAINT VIOLATION |
| Conformers Calculated Total Number | 90 |
| Conformers Submitted Total Number | 19 |
| Additional NMR Experimental Information | |
|---|---|
| Details | THE STRUCTURE WAS DETERMINED USING TRIPLE-RESONANCE NMR SPECTROSCOPY ON 13C,15N LABELED GP-NUSA(339-495) |
| Computation: NMR Software | ||||
|---|---|---|---|---|
| # | Classification | Version | Software Name | Author |
| 1 | refinement | Xplor-NIH | 1.2.1 | SCHWIETERS, KUSZEWSKI, TJ |
| 2 | structure solution | NMRView | ||
