3ZG4
NMR structure of the catalytic domain from E. faecium L,D- transpeptidase
Spectrometer
Experimental method: SOLUTION NMR
| Spectrometer ID | Spectrometer maker | Spectrometer model | Spectrometer type | Spectrometer field strength |
| 1 | Varian | Direct Drive | 800 | |
| 2 | Varian | 600 | ||
| 3 | Varian | 600 | ||
| 4 | Varian | 600 | ||
| 5 | Varian | 600 | ||
| 6 | Varian | 950 | ||
| 7 | Bruker | 800 |
Experiment
| experiment id | conditions id | solution id | Experiment type |
| 1 | 1 | 1 | 1H-15N-HSQC |
| 10 | 1 | 1 | 3D- 13C-NOESY-HSQC CENTERED ON AROMATICS |
| 2 | 1 | 1 | 1H-13C-HSQC CENTERED ON ALIPHATICS |
| 3 | 1 | 1 | 1H-15N-HMQC DETECTING 2J |
| 4 | 1 | 1 | 3J COUPLINGS IN HISTIDINES IMIDAZOLE RING |
| 5 | 1 | 1 | 1H-15N-HSQC DETECTING 1J COUPLING IN HISTIDINES IMIDAZOLE RING |
| 6 | 1 | 1 | 3D-15N- NOESY-HSQC |
| 7 | 1 | 1 | HNCO |
| 8 | 1 | 1 | 3D-13C- NOESY-HSQC CENTERED ON ALIPHATICS |
| 9 | 1 | 1 | 1H-13C-HSQC CENTERED ON AROMATICS |
NMR Sample
| conditions id | NMR sample pH | NMR sample pressure | NMR sample temperature |
| 1 | 6.4 | 1.0 | 298 |
Conformers
| Conformers Calculated Total Number | 1700 |
| Conformers Submitted Total Number | 20 |
