BMRB Entry 15041

Name: DPC micelle-bound NMR structures of Tritrp3
Published: 2007-10-30

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PDB ID: 2i1f
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR15041
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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: DPC micelle-bound NMR structures of Tritrp3 PubMed: 16997878

Deposition date: 2006-11-20 Original release date: 2007-10-30

Authors: Schibli, D.; Nguyen, L.

Citation: Schibli, D.; Nguyen, L.; Kernaghan, S.; Rekdal, O.; Vogel, H.. "Structure-function analysis of tritrpticin analogs: potential relationships between antimicrobial activities, model membrane interactions and their micelle-bound NMR structures" Biophys. J. 91, 4413-4426 (2006).

Assembly members:
13-mer_analogue_of_Prophenin-1_containing_WWW, polymer, 14 residues, Formula weight is not available

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: chemical synthesis

Entity Sequences (FASTA):
13-mer_analogue_of_Prophenin-1_containing_WWW: VRRFAWWWAFLRRX

Data sets:

assigned_chemical_shifts
- assigned_chem_shift_list_1

Data type	Count
1H chemical shifts	93

Additional metadata:

Assembly
Samples and Experiments
Software
Spectrometers
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Assembly:

Entity Assembly ID	Entity Name	Entity ID
1	13-mer_analogue_of_Prophenin-1_containing_WWW	1

Entities:

Entity 1, 13-mer_analogue_of_Prophenin-1_containing_WWW 14 residues - Formula weight is not available

1

VAL

ARG

PHE

ALA

TRP

ALA

PHE

2

LEU

ARG

NH2

Samples:

sample: Tritrp31 – 2 mM; DPC-d38 132 mM; H2O 90%; D2O 10%

sample_conditions_1: pH: 4.7; temperature: 310 K

Experiments:

Name	Sample	Sample state	Sample conditions
1H NOESY	sample	isotropic	sample_conditions_1
1H TOCSY	sample	isotropic	sample_conditions_1
1H COSY	sample	isotropic	sample_conditions_1

Software:

ARIA, J Linge, S O, . - structure solution

NMR spectrometers:

Bruker Avance 700 MHz