BMRB Entry 25949

Name: Ex-4[1-27]/pl14a
Published: 2016-05-23

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PDB ID: 2naw
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_full, SPARTA
BMRB Entry DOI: doi:10.13018/BMR25949
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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[1-27]/pl14a

Deposition date:

2016-01-12

Original release date:

2016-05-23

Authors:

Schroeder, Christina; Swedberg, Joakim; Craik, David

Citation:

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

Assembly members:

Assembly members:
entity, polymer, 39 residues, 4496.178 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: HGEGTFTSDLSKQMEEEAVR CFIECLKGIGHKYPFCHCR

Data sets:

assigned_chemical_shifts
- assigned_chem_shift_list_1

Data type	Count
1H chemical shifts	242

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 39 residues - 4496.178 Da.

1

HIS

GLY

GLU

GLY

THR

PHE

THR

SER

ASP

LEU

2

SER

LYS

GLN

MET

GLU

ALA

VAL

ARG

3

CYS

PHE

ILE

GLU

CYS

LEU

LYS

GLY

ILE

GLY

4

HIS

LYS

TYR

PRO

PHE

CYS

HIS

CYS

ARG

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-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

XEASY, Bartels et al. - chemical shift assignment, chemical shift calculation, peak picking

NMR spectrometers:

Bruker Avance 600 MHz