BMRB Entry 50609

Name: chemical shifts of the nAchR loop C fragment 202-214 stabilized by disulfides
Published: 2021-05-28

Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR50609

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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:

chemical shifts of the nAchR loop C fragment 202-214 stabilized by disulfides

Deposition date:

2020-12-01

Original release date:

2021-05-28

Authors:

Mineev, Konstantin; Utkin, Yuri

Citation:

Citation: Mineev, Konstantin; Kryukova, Elena; Kasheverov, Igor; Egorova, Natalia; Zhmak, Maxim; Ivanov, Igor; Senko, Dmitry; Feofanov, Alexey; Ignatova, Anastasia; Arseniev, Alexander; Utkin, Yuri; Tsetlin, Victor. "Spatial Structure and Activity of Synthetic Fragments of Lynx1 and of Nicotinic Receptor Loop C Models." Biomolecules 11, 1-1 (2020).
PubMed: 33374963

Assembly members:

Assembly members:
entity_1, polymer, 15 residues, Formula weight is not available

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_1: CSVTYSSSPEAYEDC

Data sets:

assigned_chemical_shifts
- assigned_chemical_shifts_1

Data type	Count
13C chemical shifts	63
15N chemical shifts	12
1H chemical shifts	81

Additional metadata:

Assembly
Samples and Experiments
Software
Spectrometers
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Assembly:

Entity Assembly ID	Entity Name	Entity ID
1	mLs202-214	1

Entities:

Entity 1, mLs202-214 15 residues - Formula weight is not available

1

CYS

SER

VAL

THR

TYR

SER

PRO

GLU

2

ALA

TYR

GLU

ASP

CYS

Samples:

sample_1: mLs202-214 40 ± 1 mg/mL; potassium phosphate 50 ± 1 mM

sample_conditions_1: ionic strength: 50 mM; pH: 5.5; pressure: 1 atm; temperature: 303 K

Experiments:

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

Software:

CARA v1.9 - chemical shift assignment

NMR spectrometers:

Bruker Avance 700 MHz

Download HSQC peak lists in one of the following formats:
CSV: Backbone or all simulated peaks
SPARKY: Backbone or all simulated peaks