BMRB Entry 6114

Name: 1H, 13C and 15N resonance assignment of the C-terminal BRCT domain from human BRCA1
Published: 2005-02-28

Chem Shift validation: AVS_full, LACS
BMRB Entry DOI: doi:10.13018/BMR6114

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

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Title: 1H, 13C and 15N resonance assignment of the C-terminal BRCT domain from human BRCA1 PubMed: 15557806

Deposition date: 2004-02-25 Original release date: 2005-02-28

Authors: Gaiser, Olaf; Oschkinat, Hartmut; Heinemann, Udo; Ball, Linda

Citation: Gaiser, Olaf; Oschkinat, Hartmut; Heinemann, Udo; Ball, Linda. "1H, 13C and 15N resonance assignment of the C-terminal BRCT domain from human BRCA1" J. Biomol. NMR 30, 221-222 (2004).

Assembly members:
C-terminal BRCT domain from human BRCA1, polymer, 110 residues, 12500 Da.

Natural source: Common Name: Human Taxonomy ID: 9606 Superkingdom: Eukaryota Kingdom: Metazoa Genus/species: Homo sapiens

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

Entity Sequences (FASTA):
C-terminal BRCT domain from human BRCA1: GSQDRKIFRGLEICCYGPFT NMPTDQLEWMVQLCGASVVK ELSSFTLGTGVHPIVVVQPD AWTEDNGFHAIGQMCEAPVV TREWVLDSVALYQCQELDTY LIPQIPHSHY

Data sets:

assigned_chemical_shifts
- chemShifts_1

Data type	Count
1H chemical shifts	736
13C chemical shifts	470
15N chemical shifts	111

Additional metadata:

Assembly
Samples and Experiments
Software
Spectrometers
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Assembly:

Entity Assembly ID	Entity Name	Entity ID
1	BRCTc	1

Entities:

Entity 1, BRCTc 110 residues - 12500 Da.

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

Samples:

BRCTc_15N: C-terminal BRCT domain from human BRCA1, [U-15N], 1.3 mM

BRCTc_13C_15N: C-terminal BRCT domain from human BRCA1, [U-13C; U-15N], 0.7 mM

condition_Set_1: pH: 6.8; temperature: 296 K

Experiments:

Name	Sample	Sample state	Sample conditions
Spectrometers were in standard configuration, with triple resonance probes	not available	not available	condition_Set_1
equipped with self-shielded gradient coils.	not available	not available	condition_Set_1

Software:

XWIN-NMR v1.3 - acquisition, processing of spectra

AZARA v2.1 - processing, viewing of spectra

ANSIG v3.3 - assignment, creation of NOE restraints lists

NMR spectrometers:

Bruker DRX 600 MHz
Bruker DMX 750 MHz

PDB	1JNX 1N5O 1OQA 1T15 1T29 1T2U 1T2V 1Y98 2ING 3COJ 3K0H 3K0K 3K15 3K16 3PXA 3PXB 3PXC 3PXD 3PXE 4IFI 4IGK 4JLU
DBJ	BAG10985 BAG57181
GB	AAA73985 AAB08105 AAB61673 AAC00049 AAC37594
REF	NP_001038958 NP_001108421 NP_001288295 NP_001288687 NP_001289032
SP	P38398 Q6J6I8 Q6J6I9 Q6J6J0 Q9GKK8

Biological Magnetic Resonance Data Bank