1PC2
Solution structure of human mitochondria fission protein Fis1
SOLUTION NMR
| NMR Experiment | ||||||||
|---|---|---|---|---|---|---|---|---|
| Experiment | Type | Sample Contents | Solvent | Ionic Strength | pH | Pressure | Temperature (K) | Spectrometer |
| 1 | 3D_15N-separated_NOESY | 1mM Protein U-15N | 90% H2O/10% D2O | 10mM Tris Acetate | 5.5 | AMBIENT | 305 | |
| 2 | 4D_13C/15N-separated_NOESY | 1mM Protein U-15N,13C | 90% H2O/10% D2O | 10mM Tris Acetate | 5.5 | AMBIENT | 305 | |
| 3 | 4D_13C-separated_NOESY | 1mM Protein U-15N,13C | 100% D2O | 10mM Tris Acetate | 5.5 | AMBIENT | 305 | |
| NMR Spectrometer Information | |||
|---|---|---|---|
| Spectrometer | Manufacturer | Model | Field Strength |
| 1 | Bruker | DRX | 600 |
| 2 | Bruker | DRX | 800 |
| NMR Refinement | ||
|---|---|---|
| Method | Details | Software |
| Distance geometry, Simulated annealing, Molecular dynamics | XwinNMR | |
| NMR Ensemble Information | |
|---|---|
| Conformer Selection Criteria | structures with the lowest energy |
| Conformers Calculated Total Number | 200 |
| Conformers Submitted Total Number | 20 |
| Representative Model | 1 (lowest energy) |
| Computation: NMR Software | ||||
|---|---|---|---|---|
| # | Classification | Version | Software Name | Author |
| 1 | collection | XwinNMR | 2.5 | |
| 2 | processing | NMRPipe | 2.1 | |
| 3 | data analysis | PIPP | 4.2.8 | |
| 4 | refinement | XPLOR-NIH | 2.0.6 | C.D.Schwieters,J.J.Kuszewski,N.Tjandra,G.M.Clore |
| 5 | structure solution | XPLOR-NIH | 2.0.6 | |
