4A52
NMR structure of the imipenem-acylated L,D-transpeptidase from Bacillus subtilis
Spectrometer
Experimental method: SOLUTION NMR
| Spectrometer ID | Spectrometer maker | Spectrometer model | Spectrometer type | Spectrometer field strength |
| 1 | Bruker | AVANCE | 900 | |
| 2 | Bruker | AVANCE | 800 | |
| 3 | Varian | INOVA | 600 |
Experiment
| experiment id | conditions id | solution id | Experiment type |
| 1 | 1 | 1 | 13C-HSQC-NOESY |
| 10 | 10 | 1 | 13C-HSQC-NOESY CENTERED ON AROMATICS |
| 2 | 2 | 1 | 1H-15N- HSQC |
| 3 | 3 | 1 | 1H -13C-HSQC |
| 4 | 4 | 1 | 13C- HSQC-NOESY METHYL SELECTIVE |
| 5 | 5 | 1 | 15N-HSQC-NOESY |
| 6 | 6 | 1 | 1H-15N- HMQC OPTIMIZED FOR IMIDAZOLE RING OF HISTIDINES |
| 7 | 7 | 1 | HNCO |
| 8 | 8 | 1 | HNCACB |
| 9 | 9 | 1 | 1H- 13C-HSQC CENTERED ON AROMATICS |
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 |
| 3 | 6.5 | 1.0 | 298 |
| 4 | 6.5 | 1.0 | 298 |
Conformers
| Conformers Calculated Total Number | 20 |
| Conformers Submitted Total Number | 20 |
