BMRB Entry 5410

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PDB ID: 1mpz
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR5410
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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:

Solution structure of novel non-RGD containing short disintegrin by high resolution NMR

Deposition date:

2002-07-03

Original release date:

2003-02-18

Authors:

Moreno-Murciano, Paz; Monleon, Daniel; Calvete, Juan J.; Celda, Bernardo

Citation:

Citation: Moreno-Murciano, Paz; Monleon, Daniel; Calvete, Juan J.; Celda, Bernardo; Marcinkiewicz, C.. "Amino Acid Sequence and Homology Modeling of Obtustatin, a Novel non-RGD-containing short Disintegrin isolated from the Venom of Vipera lebetina obtusa" Protein Sci. 12, 366-371 (2003).
PubMed: 12538900

Assembly members:

Assembly members:
obtustatin, polymer, 41 residues, Formula weight is not available

Natural source:

Natural source: Common Name: lebetina obtusa Taxonomy ID: 8703 Superkingdom: Eukaryota Kingdom: Metazoa Genus/species: Vipera lebetina obtusa

Experimental source:

Experimental source: Production method: purified from the natural source

Entity Sequences (FASTA):

Entity Sequences (FASTA):
obtustatin: CTTGPCCRQCKLKPAGTTCW KTSLTSHYCTGKSCDCPLYP G

Data sets:

assigned_chemical_shifts
- chemical_shifts

Data type	Count
1H chemical shifts	220

Additional metadata:

Assembly
Samples and Experiments
Software
Spectrometers
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Assembly:

Entity Assembly ID	Entity Name	Entity ID
1	obtustatin	1

Entities:

Entity 1, obtustatin 41 residues - Formula weight is not available

1

CYS

THR

GLY

PRO

CYS

ARG

GLN

CYS

2

LYS

LEU

LYS

PRO

ALA

GLY

THR

CYS

TRP

3

LYS

THR

SER

LEU

THR

SER

HIS

TYR

CYS

THR

4

GLY

LYS

SER

CYS

ASP

CYS

PRO

LEU

TYR

PRO

5

GLY

Samples:

Sample_1: obtustatin 1.1 mM

Cond_1: pH*: 2.5; temperature: 298 K

Experiments:

Name	Sample	Sample state	Sample conditions
mixing time TOCSYs 15,50 and 80 ms	Sample_1	not available	Cond_1
mixing time NOESYs 50, 100 and 200 ms	Sample_1	not available	Cond_1

Software:

xwinnmr v3.1 - spectral processing

SPARKY v3.96 - spectral analysis

NMR spectrometers:

Bruker AVANCEDMX 500 MHz
Bruker AVANCEDMX 600 MHz
Bruker AVANCEDMX 800 MHz

PDB	1MPZ
SWISS-PROT	P83469