BMRB Entry 19847

Name: solution structure of alpha amylase inhibitor peptide aS1 from Allatide scholaris
Published: 2014-11-13

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PDB ID: 2mm6
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_anomalous, AVS_full, SPARTA
BMRB Entry DOI: doi:10.13018/BMR19847
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:

solution structure of alpha amylase inhibitor peptide aS1 from Allatide scholaris

Deposition date:

2014-03-10

Original release date:

2014-11-13

Authors:

Wang, Shujing; Nguyen, Quoc Thuc Phuong; Tam, James P.

Citation:

Citation: Wang, Shujing; Nguyen, Quoc Thuc Phuong; Tam, James P.. "solution structure of alpha-amylase inhibitor peptide aS1 from Allatide scholaris" .

Assembly members:

Assembly members:
entity, polymer, 30 residues, 3376.976 Da.

Natural source:

Natural source: Common Name: Milky Pine Taxonomy ID: 52822 Superkingdom: Eukaryota Kingdom: Metazoa Genus/species: Alstonia scholaris

Experimental source:

Experimental source: Production method: purified from the natural source

Entity Sequences (FASTA):

Entity Sequences (FASTA):
entity: CRPYGYRCDGVINQCCDPYH CTPPLIGICL

Data sets:

assigned_chemical_shifts
- assigned_chem_shift_list_1

Data type	Count
1H chemical shifts	187

Additional metadata:

Assembly
Samples and Experiments
Software
Spectrometers
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Assembly:

Entity Assembly ID	Entity Name	Entity ID
1	entity	1

Entities:

Entity 1, entity 30 residues - 3376.976 Da.

1	CYS	ARG	PRO	TYR	GLY	TYR	ARG	CYS	ASP	GLY
2	VAL	ILE	ASN	GLN	CYS	CYS	ASP	PRO	TYR	HIS
3	CYS	THR	PRO	PRO	LEU	ILE	GLY	ILE	CYS	LEU

Name	Sample	Sample state	Sample conditions
2D 1H-1H TOCSY	sample_1	isotropic	sample_conditions_1
2D 1H-1H NOESY	sample_1	isotropic	sample_conditions_1

BMRB Entry 19847

Additional metadata:

Assembly:

Entities:

Samples:

Experiments:

Software:

NMR spectrometers:

1	CYS	ARG	PRO	TYR	GLY	TYR	ARG	CYS	ASP	GLY
2	VAL	ILE	ASN	GLN	CYS	CYS	ASP	PRO	TYR	HIS
3	CYS	THR	PRO	PRO	LEU	ILE	GLY	ILE	CYS	LEU

1	CYS	ARG	PRO	TYR	GLY	TYR	ARG	CYS	ASP	GLY
2	VAL	ILE	ASN	GLN	CYS	CYS	ASP	PRO	TYR	HIS
3	CYS	THR	PRO	PRO	LEU	ILE	GLY	ILE	CYS	LEU

1	CYS	ARG	PRO	TYR	GLY	TYR	ARG	CYS	ASP	GLY
2	VAL	ILE	ASN	GLN	CYS	CYS	ASP	PRO	TYR	HIS
3	CYS	THR	PRO	PRO	LEU	ILE	GLY	ILE	CYS	LEU