BMRB Entry 25948

Name: Ex-4[1-16]/pl14a
Published: 2016-05-23

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PDB ID: 2nav
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_full, SPARTA
BMRB Entry DOI: doi:10.13018/BMR25948
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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:

Ex-4[1-16]/pl14a

Deposition date:

2016-01-11

Original release date:

2016-05-23

Authors:

Schroeder, Christina; Swedberg, Joakim; Craik, David

Citation:

Citation: Schroeder, Christina; Swedberg, Joakim; Mitchell, Justin; Fairlie, David; Price, David; Liras, Spiros; Craik, David. "GLP-1 and exendin-4 alpha-conotoxin pl14a chimeras as potent GLP1-R agonists" .

Assembly members:

Assembly members:
entity, polymer, 29 residues, 3163.514 Da.

Natural source:

Natural source: Common Name: not available Taxonomy ID: not available Superkingdom: not available Kingdom: not available Genus/species: not available not available

Experimental source:

Experimental source: Production method: chemical synthesis

Entity Sequences (FASTA):

Entity Sequences (FASTA):
entity: HGEGTFTSDCSKQCEEGIGH KYPFCHCRX

Data sets:

assigned_chemical_shifts
- assigned_chem_shift_list_1

Data type	Count
1H chemical shifts	161

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 29 residues - 3163.514 Da.

1

HIS

GLY

GLU

GLY

THR

PHE

THR

SER

ASP

CYS

2

SER

LYS

GLN

CYS

GLU

GLY

ILE

GLY

HIS

3

LYS

TYR

PRO

PHE

CYS

HIS

CYS

ARG

NH2

Samples:

sample_1: entity 0.2 mM; H2O 90%; D2O 10%

sample_conditions_1: pH: 3.6; pressure: 1 atm; temperature: 298 K

Experiments:

Name	Sample	Sample state	Sample conditions
2D 1H-1H TOCSY	sample_1	isotropic	sample_conditions_1
2D 1H-1H NOESY	sample_1	isotropic	sample_conditions_1
2D 1H-1H COSY	sample_1	isotropic	sample_conditions_1
2D 1H-15N HSQC	sample_1	isotropic	sample_conditions_1
2D 1H-13C HSQC	sample_1	isotropic	sample_conditions_1

Software:

CNS, Brunger, Adams, Clore, Gros, Nilges and Read - refinement

CYANA, Guntert, Mumenthaler and Wuthrich - structure solution

Molmol, Koradi, Billeter and Wuthrich - data analysis

TOPSPIN, Bruker Biospin - collection, processing

XEASY, Brunger - chemical shift assignment, chemical shift calculation, peak picking

NMR spectrometers:

Bruker Avance 600 MHz