BMRB Entry 15145

Name: 1H, Chemical Shift Assignments for neurotensin in HFIP:H20 (80:20), TFE:D20(80:20), and DPC micelles
Published: 2007-06-05

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PDB ID: 2oyv
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR15145
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Nicholas Rego and David Koes
3Dmol.js: molecular visualization with WebGL
Bioinformatics (2015) 31 (8): 1322-1324 doi:10.1093/bioinformatics/btu829

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Title:

1H, Chemical Shift Assignments for neurotensin in HFIP:H20 (80:20), TFE:D20(80:20), and DPC micelles

Deposition date:

2007-02-26

Original release date:

2007-06-05

Authors:

Monti, Jean-Pierre; Coutant, Jerome; Curmi, Patrick

Citation:

Citation: Coutant, Jerome; Curmi, Patrick; Toma, Flavio; Monti, Jean-Pierre. "NMR Solution Structure of Neurotensin in Membrane-Mimetic Environments: Molecular Basis for Neurotensin Receptor Recognition" Biochemistry 46, 5656-5663 (2007).
PubMed: 17441729

Assembly members:

Assembly members:
neurotensin, polymer, 13 residues, 129.114 Da.

Natural source:

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

Experimental source:

Experimental source: Production method: obtained from a vendor

Entity Sequences (FASTA):

Entity Sequences (FASTA):
neurotensin: XLYENKPRRPYIL

Data sets:

assigned_chemical_shifts

Data type	Count
1H chemical shifts	326

Additional metadata:

Assembly
Samples and Experiments
Software
Spectrometers
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Assembly:

Entity Assembly ID	Entity Name	Entity ID
1	neurotensin	1

Entities:

Entity 1, neurotensin 13 residues - 129.114 Da.

1

PCA

LEU

TYR

GLU

ASN

LYS

PRO

ARG

PRO

2

TYR

ILE

LEU

Samples:

sample_1: neurotensin 5 mM; HFIP 80%; D2O, [U-2H], 20%

sample_2: neurotensin 5 mM; TFE 80%; D2O, [U-2H], 20%

sample_3: neurotensin 5 mM; DPC mM

sample_conditions_1: pressure: 1 atm; temperature: 293 K

sample_conditions_2: pH: 6.4; pressure: 1 atm; temperature: 283 K

Experiments:

Name	Sample	Sample state	Sample conditions
2D 1H-1H NOESY	sample_1	isotropic	sample_conditions_1
2D 1H-1H NOESY	sample_2	isotropic	sample_conditions_1
2D 1H-1H NOESY	sample_3	isotropic	sample_conditions_2
2D 1H-1H TOCSY	sample_1	isotropic	sample_conditions_1
2D 1H-1H TOCSY	sample_2	isotropic	sample_conditions_1
2D 1H-1H TOCSY	sample_3	isotropic	sample_conditions_2

Software:

SPARKY, Goddard - chemical shift assignment

NMR spectrometers:

Bruker Avance 600 MHz