BMRB Entry 5915

Name: NMR structure of Methionine-Enkephalin in fast tumbling DMPC/DHPC bicelles
Published: 2004-03-07

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PDB ID: 1plw
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR5915
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Nicholas Rego and David Koes
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Bioinformatics (2015) 31 (8): 1322-1324 doi:10.1093/bioinformatics/btu829

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Title:

NMR structure of Methionine-Enkephalin in fast tumbling DMPC/DHPC bicelles

Deposition date:

2003-08-20

Original release date:

2004-03-07

Authors:

Marcotte, I.; Separovic, F.; Auger, M.; Gagne, S.

Citation:

Citation: Marcotte, I.; Separovic, F.; Auger, M.; Gagne, S.. "A Multidimensional 1H NMR Investigation of the Conformation of Methionine-enkephalin in Fast-tumbling Bicelles Conformation" Biophys. J. 86, 1587-1600 (2004).
PubMed: 14990485

Assembly members:

Assembly members:
Met-enkephalin 1, polymer, 5 residues, Formula weight is not available
PX4, non-polymer, 678.940 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: chemically synthesized

Entity Sequences (FASTA):

Entity Sequences (FASTA):
Met-enkephalin 1: YGGFM

Data sets:

assigned_chemical_shifts
- chemical_shift_set_1

Data type	Count
1H chemical shifts	27

Additional metadata:

Assembly
Samples and Experiments
Software
Spectrometers
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Assembly:

Entity Assembly ID	Entity Name	Entity ID
1	SH2-SH3 adapter protein drk	1
2	DMPC	2

Entities:

Entity 1, SH2-SH3 adapter protein drk 5 residues - Formula weight is not available

1

TYR

GLY

PHE

MET

Entity 2, DMPC - C36 H73 N O8 P - 678.940 Da.

1

PX4

Samples:

sample_1: Met-enkephalin 1 5.4 uM; Menk DMPC/DHPC 0.5:1 Lipid/peptide: 25:1 10 % w/v; H2O 90%; D2O 10%

sample_cond_1: ionic strength: 9 mM; pH: 4.5; pressure: 1 atm; temperature: 295 K

Experiments:

Name	Sample	Sample state	Sample conditions
2D NOESY	sample_1	not available	sample_cond_1
g-COSY	sample_1	not available	sample_cond_1

Software:

VNMR v6.1C - collection

NMRPipe v2.0 Rev 2001.117.12.48 - processing

NMRView v5.0.4 - data analysis

CNS v1.1 - refinement, structure solution

NMR spectrometers:

Varian INOVA 600 MHz