7SA5
Two-state solution NMR structure of Apo Pin1
Spectrometer
Experimental method: SOLUTION NMR
| Spectrometer ID | Spectrometer maker | Spectrometer model | Spectrometer type | Spectrometer field strength |
| 1 | Agilent | Direct Drive | 900 | |
| 2 | Bruker | AVANCE | 600 |
Experiment
| experiment id | conditions id | solution id | Experiment type |
| 1 | 1 | 1 | 2D 1H-15N HSQC |
| 10 | 1 | 1 | J (N-Cg) |
| 2 | 1 | 1 | 2D 1H-13C HSQC aliphatic |
| 3 | 1 | 1 | 2D 1H-13C HSQC aromatic |
| 4 | 1 | 1 | 3D HCCH-TOCSY |
| 5 | 1 | 1 | 3D HNCACB |
| 6 | 1 | 1 | J (HN-Ha) |
| 7 | 1 | 1 | J (Ha-Hb) |
| 8 | 1 | 1 | 3D NOESY (simultaneous 15N and 13C) |
| 9 | 1 | 1 | 3D CBCA(CO)NH |
NMR Sample
| conditions id | NMR sample pH | NMR sample pressure | NMR sample temperature |
| 1 | 6.5 | ambient | 298 |
Conformers
| Conformers Calculated Total Number | 400 |
| Conformers Submitted Total Number | 20 |
