BMRB Entry 18378
Click here to enlarge.
PDB ID:
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR18378
MolProbity Validation Chart
NMR-STAR file interactive viewer.
NMR-STAR v3 text file.
NMR-STAR v2.1 text file (deprecated)
XML gzip file.
RDF gzip file.
All files associated with the entry
Title: Liraglutide
Deposition date: 2012-04-03 Original release date: 2013-07-08
Authors: Ludvigsen, Svend; Steensgaard, D.; Thomsen, J.; Strauss, H.; Normann, M.
Citation: Steensgaard, D.; Thomsen, J.; Strauss, H.; Normann, M.; Ludvigsen, Svend. "unknown at present" unknown at present ., .-..
Assembly members:
LIRAGLUTIDE, polymer, 31 residues, 3751.20 Da.
N-hexadecanoyl-L-glutamic acid, non-polymer, 385.538 Da.
Natural source: Common Name: baker Taxonomy ID: 4932 Superkingdom: not available Kingdom: not available Genus/species: Eukaryota Fungi
Experimental source: Production method: chemical synthesis
Entity Sequences (FASTA):
LIRAGLUTIDE: HAEGTFTSDVSSYLEGQAAK
EFIAWLVRGRG
- assigned_chemical_shifts
| Data type | Count |
| 1H chemical shifts | 196 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | LIRAGLUTIDE | 1 |
| 2 | N-HEXADECANOYL-L-GLUTAMIC ACID | 2 |
Entities:
Entity 1, LIRAGLUTIDE 31 residues - 3751.20 Da.
| 1 | HIS | ALA | GLU | GLY | THR | PHE | THR | SER | ASP | VAL | ||||
| 2 | SER | SER | TYR | LEU | GLU | GLY | GLN | ALA | ALA | LYS | ||||
| 3 | GLU | PHE | ILE | ALA | TRP | LEU | VAL | ARG | GLY | ARG | ||||
| 4 | GLY |
Entity 2, N-HEXADECANOYL-L-GLUTAMIC ACID - C21 H39 N O5 - 385.538 Da.
| 1 | D6M |
Samples:
sample_1: LIRAGLUTIDE, [U-13C; U-15N], 1.6 mM
sample_conditions_1: ionic strength: 0.0 mM; pH: 7.900; pressure: 1.000 atm; temperature: 300.000 K
Experiments:
| Name | Sample | Sample state | Sample conditions |
|---|---|---|---|
| NOESY | sample_1 | solution | sample_conditions_1 |
| TOCSY | sample_1 | solution | sample_conditions_1 |
Software:
AutoDep v4.3, AutoDep - collection
CNX vany, CNX - chemical shift assignment
PRONTO vany, Kjur, Andersen and Poulsen - chemical shift assignment
X-PLOR vany, Brunger - chemical shift assignment
NMR spectrometers:
- Bruker AMX 600 MHz
Related Database Links:
| PDB |