5FZW
High resolution solution NMR structure of the spider venom peptide U3- scytotoxin-Sth1h
Spectrometer
Experimental method: SOLUTION NMR
| Spectrometer ID | Spectrometer maker | Spectrometer model | Spectrometer type | Spectrometer field strength |
| 1 | Bruker | AVANCE | 600 | |
| 2 | Bruker | AVANCE | 600 |
Experiment
| experiment id | conditions id | solution id | Experiment type |
| 1 | 1 | 1 | 13C ARO HSQC NOESY |
| 10 | 1 | 1 | 1H TOCSY |
| 11 | 1 | 1 | HCCH TOCSY |
| 12 | 1 | 1 | HNCACB |
| 13 | 1 | 1 | HNCACO |
| 14 | 1 | 1 | HNCO |
| 15 | 1 | 1 | HNCOCACB |
| 16 | 2 | 2 | 15N HSQC (15N SAMPLE) |
| 17 | 2 | 2 | 1H TOCSY (15N SAMPLE) |
| 18 | 2 | 2 | NOESY 120MS (15N SAMPLE) |
| 19 | 2 | 2 | NOESY 200MS (15N SAMPLE) |
| 2 | 1 | 1 | 13C AROMATIC HSQC |
| 3 | 1 | 1 | 13C CT-HSQC |
| 4 | 1 | 1 | 13C HSQC |
| 5 | 1 | 1 | 13C HSQC NOESY |
| 6 | 1 | 1 | 15N HMQC |
| 7 | 1 | 1 | 15N HMQC 2 |
| 8 | 1 | 1 | 15N HSQC NOESY |
| 9 | 1 | 1 | 1H NOESY (120MS) |
NMR Sample
| conditions id | NMR sample pH | NMR sample pressure | NMR sample temperature |
| 1 | 6.5 | 1.0 | 298 |
| 2 | 6.5 | 1.0 | 298 |
Conformers
| Conformers Calculated Total Number | 100 |
| Conformers Submitted Total Number | 20 |
