4B2U
S67, A spider venom toxin peptide from Sicarius dolichocephalus
Spectrometer
Experimental method: SOLUTION NMR
| Spectrometer ID | Spectrometer maker | Spectrometer model | Spectrometer type | Spectrometer field strength |
| 1 | Bruker | DMX | 600 | |
| 2 | Bruker | AVANCE | 750 |
Experiment
| experiment id | conditions id | solution id | Experiment type |
| 1 | 1 | 1 | 13C CT-HSQC |
| 10 | 1 | 1 | CCCONH |
| 11 | 1 | 1 | HCCONH |
| 12 | 1 | 1 | 13C ARO NOESY (150MS) |
| 13 | 1 | 1 | 13C NOESY (150MS) |
| 14 | 1 | 1 | 15N NOESY (150MS) |
| 15 | 1 | 1 | 13C NOESY (120MS |
| 16 | 1 | 1 | D2O) |
| 17 | 1 | 1 | HCCH TOCSY |
| 18 | 1 | 1 | HACACO |
| 19 | 1 | 1 | 13C CT- HSQC (D2O) |
| 2 | 1 | 1 | 13C CT-HSQC AROMATIC |
| 20 | 1 | 1 | 13C HSQC (D2O) |
| 21 | 1 | 1 | 21 MIN AFTER REHYDRATING IN D2O |
| 22 | 1 | 1 | 15N HMQC |
| 23 | 1 | 1 | 37 MIN AFTER REHYDRATING IN D2O |
| 24 | 1 | 1 | 15N HMQC |
| 25 | 1 | 1 | 54 MIN AFTER REHYDRATING IN D2O |
| 26 | 1 | 1 | 15N HMQC |
| 27 | 1 | 1 | 70 MIN AFTER REHYDRATING IN D2O |
| 28 | 1 | 1 | 15N HMQC |
| 29 | 1 | 1 | 93 MIN AFTER REHYDRATING IN D2O |
| 3 | 1 | 1 | HNCACB |
| 30 | 1 | 1 | 15N HMQC |
| 31 | 1 | 1 | 117 MIN AFTER REHYDRATING IN D2O |
| 32 | 1 | 1 | 15N HMQC |
| 33 | 1 | 1 | 155 MIN AFTER REHYDRATING IN D2O |
| 34 | 1 | 1 | 15N HMQC |
| 35 | 1 | 1 | 194 MIN AFTER REHYDRATING IN D2O |
| 36 | 1 | 1 | 15N HMQC |
| 37 | 1 | 1 | 330 MIN AFTER REHYDRATING IN D2O |
| 38 | 1 | 1 | 15N HMQC |
| 39 | 1 | 1 | 507 MIN AFTER REHYDRATING IN D2O |
| 4 | 1 | 1 | HNCO |
| 40 | 1 | 1 | 15N HMQC |
| 41 | 1 | 1 | 12 MIN AFTER REHYDRATING IN D2O |
| 42 | 1 | 1 | 15N HMQC |
| 5 | 1 | 1 | HNCACO |
| 6 | 1 | 1 | HNCOCACB |
| 7 | 1 | 1 | 15N HMQC |
| 8 | 1 | 1 | 1H NOESY (120MS) |
| 9 | 1 | 1 | 1H TOCSY (120MS) |
NMR Sample
| conditions id | NMR sample pH | NMR sample pressure | NMR sample temperature |
| 1 | 6 | 1.0 | 310 |
Conformers
| Conformers Calculated Total Number | 100 |
| Conformers Submitted Total Number | 20 |
