1DG4
NMR STRUCTURE OF THE SUBSTRATE BINDING DOMAIN OF DNAK IN THE APO FORM
SOLUTION NMR
| NMR Experiment | ||||||||
|---|---|---|---|---|---|---|---|---|
| Experiment | Type | Sample Contents | Solvent | Ionic Strength | pH | Pressure | Temperature (K) | Spectrometer |
| 1 | 3D_15N-SEPARATED_NOESY | 1MM U15N; 10MM PHOSPHATE BUFFER NA | 10mM NA PHOSPHATE | 6.8 | AMBIENT | 303 | ||
| 2 | 3D_13C-SEPARATED_NOESY | 1MM U15N,13C; 10MM PHOSPHATE BUFFER NA | 10mM NA PHOSPHATE | 6.8 | AMBIENT | 303 | ||
| 3 | 3D_HNCA, 3D_HN(CA)HA | 1MM U15N,13C; 10MM PHOSPHATE BUFFER NA | 10mM NA PHOSPHATE | 6.8 | AMBIENT | 303 | ||
| 4 | H(C)CH_TOCSY, (H)CCH_TOCSY | 1MM U15N,13C; 10MM PHOSPHATE BUFFER NA | 10mM NA PHOSPHATE | 6.8 | AMBIENT | 303 | ||
| 5 | 13C,1H_HSQC | 1MM 10% 13C; 10MM PHOSPHATE BUFFER NA | 10mM NA PHOSPHATE | 6.8 | AMBIENT | 303 | ||
| NMR Spectrometer Information | |||
|---|---|---|---|
| Spectrometer | Manufacturer | Model | Field Strength |
| 1 | Bruker | INOVA | 800 |
| 2 | Bruker | AMX | 500 |
| NMR Refinement | ||
|---|---|---|
| Method | Details | Software |
| torsion angle dynamics | VNMR | |
| NMR Ensemble Information | |
|---|---|
| Conformer Selection Criteria | STRUCTURES WITH THE LEAST RESTRAINT VIOLATIONS,TARGET FUNCTION |
| Conformers Calculated Total Number | 50 |
| Conformers Submitted Total Number | 20 |
| Representative Model | 1 (closest to the average,fewest violations) |
| Additional NMR Experimental Information | |
|---|---|
| Details | THE STRUCTURE WAS DETERMINED USING TRIPLE-RESONANCE NMR SPECTROSCOPY. |
| Computation: NMR Software | ||||
|---|---|---|---|---|
| # | Classification | Version | Software Name | Author |
| 1 | collection | VNMR | 2.6 | VARIAN |
| 2 | processing | PROSA | 3.7 | GUENTERT,P. |
| 3 | structure solution | DYANA | 1.5 | GUENTERT,P. |
| 4 | refinement | FANTOM | 1.0 | BRAUN |
| 5 | data analysis | XEASY | 2.6 | BARTELS, C. |
