BMRB Entry 26538

Name: Short hydrophobic peptides with cyclic constraints are po-tent GLP-1R agonists.
Published: 2015-04-13

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PDB ID: 2n0i
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_full, SPARTA
BMRB Entry DOI: doi:10.13018/BMR26538
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Bioinformatics (2015) 31 (8): 1322-1324 doi:10.1093/bioinformatics/btu829

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Title: Short hydrophobic peptides with cyclic constraints are po-tent GLP-1R agonists. PubMed: 25839426

Deposition date: 2015-03-10 Original release date: 2015-04-13

Authors: Hoang, Huy

Citation: Hoang, Huy; Song, Kun; Hill, Timothy; Derksen, David; Edmonds, David; Kok, W. Mei; Limberakis, Chris; Liras, Spiros; Loria, Paula; Mascitti, Vincent; Mathiowetz, Alan; Mitchell, Justin; Piotrowski, David; Price, David; Stanton, Robert; Suen, Jacky; Withka, Jane; Griffith, David; Fairlie, David. "Short hydrophobic peptides with cyclic constraints are potent glucagon-like peptide-1 receptor (GLP-1R) agonists" J. Med. Chem. 58, 4080-4085 (2015).

Assembly members:
entity, polymer, 12 residues, Formula weight is not available

Natural source: Common Name: Human Taxonomy ID: 9606 Superkingdom: Eukaryota Kingdom: Metazoa Genus/species: Homo sapiens

Experimental source: Production method: chemical synthesis

Entity Sequences (FASTA):
entity: HXEGXFTSDFXX

Data sets:

assigned_chemical_shifts
- assigned_chem_shift_list_1

Data type	Count
1H chemical shifts	21

Additional metadata:

Assembly
Samples and Experiments
Software
Spectrometers
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Assembly:

Entity Assembly ID	Entity Name	Entity ID
1	entity	1

Entities:

Entity 1, entity 12 residues - Formula weight is not available

1

HIS

KCY

GLU

GLY

HCS

PHE

THR

SER

ASP

PHE

2

PH8

NH2

Samples:

sample_1: entity 1 mM

sample_conditions_1: ionic strength: 0 M; pH: 7; pressure: 1 atm; temperature: 298 K

Experiments:

Name	Sample	Sample state	Sample conditions
2D 1H-1H NOESY	sample_1	isotropic	sample_conditions_1

Software:

X-PLOR_NIH, Schwieters, Kuszewski, Tjandra and Clore - structure solution

NMR spectrometers:

Bruker Avance 600 MHz