BMRB Entry 4367

Chem Shift validation: AVS_full, LACS
BMRB Entry DOI: doi:10.13018/BMR4367

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Bioinformatics (2015) 31 (8): 1322-1324 doi:10.1093/bioinformatics/btu829

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Title: Backbone assignments of a Borrelia OspA mutant containing an extended single-layer beta-sheet PubMed: 10667801

Deposition date: 1999-07-14 Original release date: 2000-03-23

Authors: Huang, Xiaolin; Link, Karl; Koide, Akiko; Koide, Shohei

Citation: Koide, Shohei; Huang, Xiaolin; Link, Karl; Koide, Akiko; Bu, Zimei; Engelman, Donald. "Design of single-layer beta-sheets without a hydrophobic core" Nature 403, 456-460 (2000).

Assembly members:
OspA mutant, polymer, 280 residues, 30260 Da.

Natural source: Common Name: Lyme disease spirochete Taxonomy ID: 139 Superkingdom: not available Kingdom: not available Genus/species: Borrelia burgdorferi

Experimental source: Production method: recombinant technology

Entity Sequences (FASTA):
OspA mutant: AKQNVSSLDEKNSVSVDLPG EMKVLVSKEKNKDGKYDLIA TVDKLELKGTSDKNNGSGVL EGVKADKSKVKLTISDDLGQ TTLEVFKEDGKTLVSKKVTS KDKSSTEEKFNEKGELSEKK ITRADKSSTEEKFNEKGEVS EKIITRADGTRLEYTGIKSD GSGKAKEVLKGYVLEGTLTA EKTTLVVKEGTVTLSKNISK SGEVSVELNDTDSSAATKKT AAWNSGTSTLTITVNSKKTK DLVFTKENTITVQQYDSNGT KLEGSAVEITKLDEIKNALK

Data sets:

assigned_chemical_shifts
- assigned_chemical_shifts_label

Data type	Count
13C chemical shifts	813
15N chemical shifts	277
1H chemical shifts	277

Additional metadata:

Assembly
Samples and Experiments
Software
Spectrometers
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Entity Assembly ID	Entity Name	Entity ID
1	OspA+1bh	1

Name	Sample	Sample state	Sample conditions
not available	not available	not available	not available

Download simulated HSQC data in one of the following formats:
CSV: Backbone or all simulated shifts
SPARKY: Backbone or all simulated shifts

1	ALA	LYS	GLN	ASN	VAL	SER	SER	LEU	ASP	GLU
2	LYS	ASN	SER	VAL	SER	VAL	ASP	LEU	PRO	GLY
3	GLU	MET	LYS	VAL	LEU	VAL	SER	LYS	GLU	LYS
4	ASN	LYS	ASP	GLY	LYS	TYR	ASP	LEU	ILE	ALA
5	THR	VAL	ASP	LYS	LEU	GLU	LEU	LYS	GLY	THR
6	SER	ASP	LYS	ASN	ASN	GLY	SER	GLY	VAL	LEU
7	GLU	GLY	VAL	LYS	ALA	ASP	LYS	SER	LYS	VAL
8	LYS	LEU	THR	ILE	SER	ASP	ASP	LEU	GLY	GLN
9	THR	THR	LEU	GLU	VAL	PHE	LYS	GLU	ASP	GLY
10	LYS	THR	LEU	VAL	SER	LYS	LYS	VAL	THR	SER
11	LYS	ASP	LYS	SER	SER	THR	GLU	GLU	LYS	PHE
12	ASN	GLU	LYS	GLY	GLU	LEU	SER	GLU	LYS	LYS
13	ILE	THR	ARG	ALA	ASP	LYS	SER	SER	THR	GLU
14	GLU	LYS	PHE	ASN	GLU	LYS	GLY	GLU	VAL	SER
15	GLU	LYS	ILE	ILE	THR	ARG	ALA	ASP	GLY	THR
16	ARG	LEU	GLU	TYR	THR	GLY	ILE	LYS	SER	ASP
17	GLY	SER	GLY	LYS	ALA	LYS	GLU	VAL	LEU	LYS
18	GLY	TYR	VAL	LEU	GLU	GLY	THR	LEU	THR	ALA
19	GLU	LYS	THR	THR	LEU	VAL	VAL	LYS	GLU	GLY
20	THR	VAL	THR	LEU	SER	LYS	ASN	ILE	SER	LYS
21	SER	GLY	GLU	VAL	SER	VAL	GLU	LEU	ASN	ASP
22	THR	ASP	SER	SER	ALA	ALA	THR	LYS	LYS	THR
23	ALA	ALA	TRP	ASN	SER	GLY	THR	SER	THR	LEU
24	THR	ILE	THR	VAL	ASN	SER	LYS	LYS	THR	LYS
25	ASP	LEU	VAL	PHE	THR	LYS	GLU	ASN	THR	ILE
26	THR	VAL	GLN	GLN	TYR	ASP	SER	ASN	GLY	THR
27	LYS	LEU	GLU	GLY	SER	ALA	VAL	GLU	ILE	THR
28	LYS	LEU	ASP	GLU	ILE	LYS	ASN	ALA	LEU	LYS

Biological Magnetic Resonance Data Bank

BMRB Entry 4367

Title: Backbone assignments of a Borrelia OspA mutant containing an extended single-layer beta-sheet PubMed: 10667801

Additional metadata:

Assembly:

Entities:

Samples:

Experiments:

Software:

NMR spectrometers:

1	ALA	LYS	GLN	ASN	VAL	SER	SER	LEU	ASP	GLU
2	LYS	ASN	SER	VAL	SER	VAL	ASP	LEU	PRO	GLY
3	GLU	MET	LYS	VAL	LEU	VAL	SER	LYS	GLU	LYS
4	ASN	LYS	ASP	GLY	LYS	TYR	ASP	LEU	ILE	ALA
5	THR	VAL	ASP	LYS	LEU	GLU	LEU	LYS	GLY	THR
6	SER	ASP	LYS	ASN	ASN	GLY	SER	GLY	VAL	LEU
7	GLU	GLY	VAL	LYS	ALA	ASP	LYS	SER	LYS	VAL
8	LYS	LEU	THR	ILE	SER	ASP	ASP	LEU	GLY	GLN
9	THR	THR	LEU	GLU	VAL	PHE	LYS	GLU	ASP	GLY
10	LYS	THR	LEU	VAL	SER	LYS	LYS	VAL	THR	SER
11	LYS	ASP	LYS	SER	SER	THR	GLU	GLU	LYS	PHE
12	ASN	GLU	LYS	GLY	GLU	LEU	SER	GLU	LYS	LYS
13	ILE	THR	ARG	ALA	ASP	LYS	SER	SER	THR	GLU
14	GLU	LYS	PHE	ASN	GLU	LYS	GLY	GLU	VAL	SER
15	GLU	LYS	ILE	ILE	THR	ARG	ALA	ASP	GLY	THR
16	ARG	LEU	GLU	TYR	THR	GLY	ILE	LYS	SER	ASP
17	GLY	SER	GLY	LYS	ALA	LYS	GLU	VAL	LEU	LYS
18	GLY	TYR	VAL	LEU	GLU	GLY	THR	LEU	THR	ALA
19	GLU	LYS	THR	THR	LEU	VAL	VAL	LYS	GLU	GLY
20	THR	VAL	THR	LEU	SER	LYS	ASN	ILE	SER	LYS
21	SER	GLY	GLU	VAL	SER	VAL	GLU	LEU	ASN	ASP
22	THR	ASP	SER	SER	ALA	ALA	THR	LYS	LYS	THR
23	ALA	ALA	TRP	ASN	SER	GLY	THR	SER	THR	LEU
24	THR	ILE	THR	VAL	ASN	SER	LYS	LYS	THR	LYS
25	ASP	LEU	VAL	PHE	THR	LYS	GLU	ASN	THR	ILE
26	THR	VAL	GLN	GLN	TYR	ASP	SER	ASN	GLY	THR
27	LYS	LEU	GLU	GLY	SER	ALA	VAL	GLU	ILE	THR
28	LYS	LEU	ASP	GLU	ILE	LYS	ASN	ALA	LEU	LYS

1	ALA	LYS	GLN	ASN	VAL	SER	SER	LEU	ASP	GLU
2	LYS	ASN	SER	VAL	SER	VAL	ASP	LEU	PRO	GLY
3	GLU	MET	LYS	VAL	LEU	VAL	SER	LYS	GLU	LYS
4	ASN	LYS	ASP	GLY	LYS	TYR	ASP	LEU	ILE	ALA
5	THR	VAL	ASP	LYS	LEU	GLU	LEU	LYS	GLY	THR
6	SER	ASP	LYS	ASN	ASN	GLY	SER	GLY	VAL	LEU
7	GLU	GLY	VAL	LYS	ALA	ASP	LYS	SER	LYS	VAL
8	LYS	LEU	THR	ILE	SER	ASP	ASP	LEU	GLY	GLN
9	THR	THR	LEU	GLU	VAL	PHE	LYS	GLU	ASP	GLY
10	LYS	THR	LEU	VAL	SER	LYS	LYS	VAL	THR	SER
11	LYS	ASP	LYS	SER	SER	THR	GLU	GLU	LYS	PHE
12	ASN	GLU	LYS	GLY	GLU	LEU	SER	GLU	LYS	LYS
13	ILE	THR	ARG	ALA	ASP	LYS	SER	SER	THR	GLU
14	GLU	LYS	PHE	ASN	GLU	LYS	GLY	GLU	VAL	SER
15	GLU	LYS	ILE	ILE	THR	ARG	ALA	ASP	GLY	THR
16	ARG	LEU	GLU	TYR	THR	GLY	ILE	LYS	SER	ASP
17	GLY	SER	GLY	LYS	ALA	LYS	GLU	VAL	LEU	LYS
18	GLY	TYR	VAL	LEU	GLU	GLY	THR	LEU	THR	ALA
19	GLU	LYS	THR	THR	LEU	VAL	VAL	LYS	GLU	GLY
20	THR	VAL	THR	LEU	SER	LYS	ASN	ILE	SER	LYS
21	SER	GLY	GLU	VAL	SER	VAL	GLU	LEU	ASN	ASP
22	THR	ASP	SER	SER	ALA	ALA	THR	LYS	LYS	THR
23	ALA	ALA	TRP	ASN	SER	GLY	THR	SER	THR	LEU
24	THR	ILE	THR	VAL	ASN	SER	LYS	LYS	THR	LYS
25	ASP	LEU	VAL	PHE	THR	LYS	GLU	ASN	THR	ILE
26	THR	VAL	GLN	GLN	TYR	ASP	SER	ASN	GLY	THR
27	LYS	LEU	GLU	GLY	SER	ALA	VAL	GLU	ILE	THR
28	LYS	LEU	ASP	GLU	ILE	LYS	ASN	ALA	LEU	LYS

1	ALA	LYS	GLN	ASN	VAL	SER	SER	LEU	ASP	GLU
2	LYS	ASN	SER	VAL	SER	VAL	ASP	LEU	PRO	GLY
3	GLU	MET	LYS	VAL	LEU	VAL	SER	LYS	GLU	LYS
4	ASN	LYS	ASP	GLY	LYS	TYR	ASP	LEU	ILE	ALA
5	THR	VAL	ASP	LYS	LEU	GLU	LEU	LYS	GLY	THR
6	SER	ASP	LYS	ASN	ASN	GLY	SER	GLY	VAL	LEU
7	GLU	GLY	VAL	LYS	ALA	ASP	LYS	SER	LYS	VAL
8	LYS	LEU	THR	ILE	SER	ASP	ASP	LEU	GLY	GLN
9	THR	THR	LEU	GLU	VAL	PHE	LYS	GLU	ASP	GLY
10	LYS	THR	LEU	VAL	SER	LYS	LYS	VAL	THR	SER
11	LYS	ASP	LYS	SER	SER	THR	GLU	GLU	LYS	PHE
12	ASN	GLU	LYS	GLY	GLU	LEU	SER	GLU	LYS	LYS
13	ILE	THR	ARG	ALA	ASP	LYS	SER	SER	THR	GLU
14	GLU	LYS	PHE	ASN	GLU	LYS	GLY	GLU	VAL	SER
15	GLU	LYS	ILE	ILE	THR	ARG	ALA	ASP	GLY	THR
16	ARG	LEU	GLU	TYR	THR	GLY	ILE	LYS	SER	ASP
17	GLY	SER	GLY	LYS	ALA	LYS	GLU	VAL	LEU	LYS
18	GLY	TYR	VAL	LEU	GLU	GLY	THR	LEU	THR	ALA
19	GLU	LYS	THR	THR	LEU	VAL	VAL	LYS	GLU	GLY
20	THR	VAL	THR	LEU	SER	LYS	ASN	ILE	SER	LYS
21	SER	GLY	GLU	VAL	SER	VAL	GLU	LEU	ASN	ASP
22	THR	ASP	SER	SER	ALA	ALA	THR	LYS	LYS	THR
23	ALA	ALA	TRP	ASN	SER	GLY	THR	SER	THR	LEU
24	THR	ILE	THR	VAL	ASN	SER	LYS	LYS	THR	LYS
25	ASP	LEU	VAL	PHE	THR	LYS	GLU	ASN	THR	ILE
26	THR	VAL	GLN	GLN	TYR	ASP	SER	ASN	GLY	THR
27	LYS	LEU	GLU	GLY	SER	ALA	VAL	GLU	ILE	THR
28	LYS	LEU	ASP	GLU	ILE	LYS	ASN	ALA	LEU	LYS