BMRB Entry 15687

Name: Automated NMR Structure of the TA0895 by FAPSY
Published: 2012-08-14

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PDB ID: 2k22
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_full, LACS
BMRB Entry DOI: doi:10.13018/BMR15687
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Bioinformatics (2015) 31 (8): 1322-1324 doi:10.1093/bioinformatics/btu829

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Title: Automated NMR Structure of the TA0895 by FAPSY

Deposition date: 2008-03-21 Original release date: 2012-08-14

Authors: Lee, Woonghee; Jung, Jin-Won; Lee, Weontae

Citation: Lee, Woonghee; Jung, Jin-Won; Lee, Weontae. "The Automated Suite for Protein Structure Determination by NMR Spectroscopy" . ., .-..

Assembly members:
TA0895, polymer, 90 residues, 10231.843 Da.

Natural source: Common Name: THERMOPLASMA ACIDOPHILUM Taxonomy ID: 2303 Superkingdom: Archaea Kingdom: not available Genus/species: THERMOPLASMA ACIDOPHILUM

Experimental source: Production method: recombinant technology Host organism: ESCHERICHIA COLI

Entity Sequences (FASTA):
TA0895: MVTVRYYATLRPITKKKEET FNGISKISELLERLKVEYGS EFTKQMYDGNNLFKNVIILV NGNNITSMKGLDTEIKDDDK IDLFPPVAGG

Data sets:

assigned_chemical_shifts
- assigned_chem_shift_list_1

Data type	Count
13C chemical shifts	273
15N chemical shifts	83
1H chemical shifts	530

Additional metadata:

Assembly
Samples and Experiments
Software
Spectrometers
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1	MET	VAL	THR	VAL	ARG	TYR	TYR	ALA	THR	LEU
2	ARG	PRO	ILE	THR	LYS	LYS	LYS	GLU	GLU	THR
3	PHE	ASN	GLY	ILE	SER	LYS	ILE	SER	GLU	LEU
4	LEU	GLU	ARG	LEU	LYS	VAL	GLU	TYR	GLY	SER
5	GLU	PHE	THR	LYS	GLN	MET	TYR	ASP	GLY	ASN
6	ASN	LEU	PHE	LYS	ASN	VAL	ILE	ILE	LEU	VAL
7	ASN	GLY	ASN	ASN	ILE	THR	SER	MET	LYS	GLY
8	LEU	ASP	THR	GLU	ILE	LYS	ASP	ASP	ASP	LYS
9	ILE	ASP	LEU	PHE	PRO	PRO	VAL	ALA	GLY	GLY

Name	Sample	Sample state	Sample conditions
2D 1H-15N HSQC	sample_1	isotropic	sample_conditions_1
3D CBCA(CO)NH	sample_1	isotropic	sample_conditions_1
3D HNCA	sample_1	isotropic	sample_conditions_1
3D HNCACB	sample_1	isotropic	sample_conditions_1
3D HBHA(CO)NH	sample_1	isotropic	sample_conditions_1
3D 1H-13C NOESY	sample_1	isotropic	sample_conditions_1
3D HCCH-TOCSY	sample_1	isotropic	sample_conditions_1
3D 1H-15N NOESY	sample_1	isotropic	sample_conditions_1
3D HNHA	sample_1	isotropic	sample_conditions_1
3D H(CCO)NH	sample_1	isotropic	sample_conditions_1
3D C(CO)NH	sample_1	isotropic	sample_conditions_1

PDB	2G1E 2K22
EMBL	CAC12024
REF	WP_010901305

Biological Magnetic Resonance Data Bank

BMRB Entry 15687

Title: Automated NMR Structure of the TA0895 by FAPSY

Additional metadata:

Assembly:

Entities:

Samples:

Experiments:

Software:

NMR spectrometers:

Related Database Links:

1	MET	VAL	THR	VAL	ARG	TYR	TYR	ALA	THR	LEU
2	ARG	PRO	ILE	THR	LYS	LYS	LYS	GLU	GLU	THR
3	PHE	ASN	GLY	ILE	SER	LYS	ILE	SER	GLU	LEU
4	LEU	GLU	ARG	LEU	LYS	VAL	GLU	TYR	GLY	SER
5	GLU	PHE	THR	LYS	GLN	MET	TYR	ASP	GLY	ASN
6	ASN	LEU	PHE	LYS	ASN	VAL	ILE	ILE	LEU	VAL
7	ASN	GLY	ASN	ASN	ILE	THR	SER	MET	LYS	GLY
8	LEU	ASP	THR	GLU	ILE	LYS	ASP	ASP	ASP	LYS
9	ILE	ASP	LEU	PHE	PRO	PRO	VAL	ALA	GLY	GLY

1	MET	VAL	THR	VAL	ARG	TYR	TYR	ALA	THR	LEU
2	ARG	PRO	ILE	THR	LYS	LYS	LYS	GLU	GLU	THR
3	PHE	ASN	GLY	ILE	SER	LYS	ILE	SER	GLU	LEU
4	LEU	GLU	ARG	LEU	LYS	VAL	GLU	TYR	GLY	SER
5	GLU	PHE	THR	LYS	GLN	MET	TYR	ASP	GLY	ASN
6	ASN	LEU	PHE	LYS	ASN	VAL	ILE	ILE	LEU	VAL
7	ASN	GLY	ASN	ASN	ILE	THR	SER	MET	LYS	GLY
8	LEU	ASP	THR	GLU	ILE	LYS	ASP	ASP	ASP	LYS
9	ILE	ASP	LEU	PHE	PRO	PRO	VAL	ALA	GLY	GLY

1	MET	VAL	THR	VAL	ARG	TYR	TYR	ALA	THR	LEU
2	ARG	PRO	ILE	THR	LYS	LYS	LYS	GLU	GLU	THR
3	PHE	ASN	GLY	ILE	SER	LYS	ILE	SER	GLU	LEU
4	LEU	GLU	ARG	LEU	LYS	VAL	GLU	TYR	GLY	SER
5	GLU	PHE	THR	LYS	GLN	MET	TYR	ASP	GLY	ASN
6	ASN	LEU	PHE	LYS	ASN	VAL	ILE	ILE	LEU	VAL
7	ASN	GLY	ASN	ASN	ILE	THR	SER	MET	LYS	GLY
8	LEU	ASP	THR	GLU	ILE	LYS	ASP	ASP	ASP	LYS
9	ILE	ASP	LEU	PHE	PRO	PRO	VAL	ALA	GLY	GLY