6NUG
hGRNA4-28_3s
SOLUTION NMR
| NMR Experiment | ||||||||
|---|---|---|---|---|---|---|---|---|
| Experiment | Type | Sample Contents | Solvent | Ionic Strength | pH | Pressure | Temperature (K) | Spectrometer |
| 1 | 2D 1H-1H TOCSY | 0.5 mM hGRNA4-28_3s | 90% H2O/10% D2O | 5 | 1 atm | 290 | Bruker AVANCE 600 | |
| 2 | 2D 1H-1H NOESY | 0.5 mM hGRNA4-28_3s | 90% H2O/10% D2O | 5 | 1 atm | 290 | Bruker AVANCE 600 | |
| NMR Spectrometer Information | |||
|---|---|---|---|
| Spectrometer | Manufacturer | Model | Field Strength |
| 1 | Bruker | AVANCE | 600 |
| NMR Refinement | ||
|---|---|---|
| Method | Details | Software |
| torsion angle dynamics | CYANA | |
| NMR Ensemble Information | |
|---|---|
| Conformer Selection Criteria | target function |
| Conformers Calculated Total Number | 100 |
| Conformers Submitted Total Number | 20 |
| Representative Model | 1 (target function) |
| Computation: NMR Software | ||||
|---|---|---|---|---|
| # | Classification | Version | Software Name | Author |
| 1 | collection | TopSpin | 3.5PL6 | Bruker Biospin |
| 2 | refinement | CYANA | 3.97 | Guntert, Mumenthaler and Wuthrich |
| 3 | chemical shift assignment | CcpNMR | CCPN | |
| 4 | data analysis | CcpNMR | CCPN | |
| 5 | data analysis | TALOS | Cornilescu, Delaglio and Bax | |
| 6 | structure calculation | CYANA | 3.97 | Guntert, Mumenthaler and Wuthrich |
