BMRB Entry 6227

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PDB ID: 1bta
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_full, LACS
BMRB Entry DOI: doi:10.13018/BMR6227
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Bioinformatics (2015) 31 (8): 1322-1324 doi:10.1093/bioinformatics/btu829

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Title: Native and non-native conformational preferences in the urea-unfolded state of barstar PubMed: 15537753

Deposition date: 2004-06-09 Original release date: 2004-12-15

Authors: Bhavesh, Neel; Juneja, Juhi; Udgaonkar, Jayant; Hosur, Ramakrishna

Citation: Bhavesh, Neel; Juneja, Juhi; Udgaonkar, Jayant; Hosur, Ramakrishna. "Native and non-native conformational preferences in the urea-unfolded state of barstar " Protein Sci. 13, 3085-3091 (2004).

Assembly members:
Barstar, polymer, 90 residues, Formula weight is not available

Natural source: Common Name: Bacillus amyloliquefaciens Taxonomy ID: 1390 Superkingdom: Eubacteria Kingdom: not available Genus/species: Bacillus amyloliquefaciens

Experimental source: Production method: recombinant technology Host organism: Escherichia coli

Entity Sequences (FASTA):
Barstar: MKKAVINGEQIRSISDLHQT LKKELALPEYYGENLDALWD CLTGWVEYPLVLEWRQFEQS KQLTENGAESVLQVFREAKA EGCDITIILS

Data sets:

assigned_chemical_shifts
- shift_set_1

Data type	Count
1H chemical shifts	87
13C chemical shifts	261
15N chemical shifts	87

Additional metadata:

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

BMRB	5293 7126
PDB	1A19 1AB7 1AY7 1B27 1B2S 1B2U 1B3S 1BGS 1BRS 1BTA 1BTB 1X1U 3DA7
EMBL	CAA33551 CBI41926 CCG48789 CCP20814 CDG25099
GB	AAM10782 AAO92245 AAP41138 AAP41140 ABS73233
REF	WP_007408543 WP_007610138 WP_013351425 WP_014720882 WP_015239422
SP	P11540

Biological Magnetic Resonance Data Bank

BMRB Entry 6227

Title: Native and non-native conformational preferences in the urea-unfolded state of barstar PubMed: 15537753

Additional metadata:

Assembly:

Entities:

Samples:

Experiments:

Software:

NMR spectrometers:

Related Database Links:

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

Name	Sample	Sample state	Sample conditions
1H-15N HSQC	not available	not available	not available
HNN	not available	not available	not available
HN(C)N	not available	not available	not available
HNCO	not available	not available	not available
CBCANH	not available	not available	not available
CBCA(CO)NH	not available	not available	not available

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

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