BMRB Entry 7341

Name: CYCLIC MRIA: AN EXCEPTIONALLY STABLE AND POTENT CYCLIC CONOTOXIN WITH A NOVEL TOPOLOGICAL FOLD THAT TARGETS THE NOREPINEPHRINE TRANSPORTER.
Published: 2007-10-16

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PDB ID: 2j15
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR7341
MolProbity Validation Chart

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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: CYCLIC MRIA: AN EXCEPTIONALLY STABLE AND POTENT CYCLIC CONOTOXIN WITH A NOVEL TOPOLOGICAL FOLD THAT TARGETS THE NOREPINEPHRINE TRANSPORTER. PubMed: 17064074

Deposition date: 2006-11-30 Original release date: 2007-10-16

Authors: Lovelace, E.; Armishaw, C.; Colgrave, M.; Wahlstrom, M.; Alewood, P.; Daly, N.; Craik, D.

Citation: Lovelace, E.; Armishaw, C.; Colgrave, M.; Wahlstrom, M.; Alewood, P.; Daly, N.; Craik, D.. "Cyclic Mria: A Stable and Potent Cyclic Conotoxin with a Novel Topological Fold that Targets the Norepinephrine Transporter" J. Med. Chem. 49, 6561-6568 (2006).

Assembly members:
CYCLIC_MRIA, polymer, 15 residues, 131.130 Da.

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

Experimental source: Production method: recombinant technology

Entity Sequences (FASTA):
CYCLIC_MRIA: NGVCCGYKLCHXCAG

Data sets:

assigned_chemical_shifts
- assigned_chem_shift_list_1

Data type	Count
1H chemical shifts	83

Additional metadata:

Assembly
Samples and Experiments
Software
Spectrometers
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Assembly:

Entity Assembly ID	Entity Name	Entity ID
1	CYCLIC MRIA	1

Entities:

Entity 1, CYCLIC MRIA 15 residues - 131.130 Da.

1

ASN

GLY

VAL

CYS

GLY

TYR

LYS

LEU

CYS

2

HIS

HYP

CYS

ALA

GLY

Samples:

sample: CYCLIC_MRIA 1 mM

sample_conditions_1: pH: 3.5; temperature: 280.0 K

Experiments:

Name	Sample	Sample state	Sample conditions
TOCSY	sample	isotropic	sample_conditions_1
NOESY	sample	isotropic	sample_conditions_1
COSY	sample	isotropic	sample_conditions_1
ECOSY	sample	isotropic	sample_conditions_1

Software:

CNS, BRUNGER,ADAMS,CLORE,DELANO,GROS, GROSSE-KUNSTLEVE,JIANG,KUSZEWSKI,NILGES, PANNU,READ,RICE,SIMONSON,WARREN - refinement, structure solution

NMR spectrometers:

BRUKER OTHER 600 MHz