THE SOLUTION STRUCTURE OF A 30 RESIDUE AMINO-TERMINAL DOMAIN OF THE CARP GRANULIN-1 PROTEIN.
SOLUTION NMR
| NMR Experiment | ||||||||
|---|---|---|---|---|---|---|---|---|
| Experiment | Type | Sample Contents | Solvent | Ionic Strength | pH | Pressure | Temperature (K) | Spectrometer |
| 1 | TOCSY | 90% H2O/10% D2O, OR 100% D2O | 4.5 | 1 atm | 288 | |||
| 2 | COSY | 90% H2O/10% D2O, OR 100% D2O | 4.5 | 1 atm | 288 | |||
| 3 | NOESY | 90% H2O/10% D2O, OR 100% D2O | 4.5 | 1 atm | 288 | |||
| NMR Spectrometer Information | |||
|---|---|---|---|
| Spectrometer | Manufacturer | Model | Field Strength |
| 1 | Bruker | AVANCE500 | 500 |
| 2 | Bruker | DRX-500 AVANCE800 | 800 |
| NMR Refinement | ||
|---|---|---|
| Method | Details | Software |
| DISTANCE GEOMETRY AND SIMULATED ANNEALING | USING THE STANDARD SOFT REFINEMENT PROTOCOL OF X-PLOR. | X-PLOR |
| NMR Ensemble Information | |
|---|---|
| Conformer Selection Criteria | LOWEST VIOLATED RESTRAINT ENERGY |
| Conformers Calculated Total Number | 100 |
| Conformers Submitted Total Number | 15 |
| Computation: NMR Software | ||||
|---|---|---|---|---|
| # | Classification | Version | Software Name | Author |
| 1 | refinement | X-PLOR | 3.1 | BRUNGER |
| 2 | structure solution | X-PLOR | ||
