BMRB Entry 15156

Chem Shift validation: AVS_anomalous, AVS_full
BMRB Entry DOI: doi:10.13018/BMR15156

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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:

Solid-State Protein Structure Determination with Proton-Detected Triple Resonance 3D Magic-Angle Spinning NMR Spectroscopy: Beta-1 Immunoglobulin Binding Domain of Protein G (GB1)

Deposition date:

2007-03-01

Original release date:

2007-03-29

Authors:

Zhou, Donghua; Shea, John; Nieuwkoop, Andrew; Franks, W. Trent; Wylie, Benjamin; Mullen, Charles; Sandoz, Dennis; Rienstra, Chad

Citation:

Citation: Zhou, Donghua; Shea, John; Nieuwkoop, Andrew; Franks, W. Trent; Wylie, Benjamin; Mullen, Charles; Sandoz, Dennis; Rienstra, Chad. "Solid-State Protein Structure Determination with Proton-Detected Triple Resonance 3D Magic-Angle Spinning NMR Spectroscopy" Angew. Chem. Int. Ed. ., .-..

Assembly members:

Assembly members:
GB1, polymer, 56 residues, 6228.870 Da.

Natural source:

Natural source: Common Name: Micrococcus pyogenes Taxonomy ID: 1280 Superkingdom: Bacteria Kingdom: not available Genus/species: Staphylococcus aureus

Experimental source:

Experimental source: Production method: recombinant technology Host organism: Escherichia coli Vector: n/a

Entity Sequences (FASTA):

Entity Sequences (FASTA):
GB1: MQYKLILNGKTLKGETTTEA VDAATAEKVFKQYANDNGVD GEWTYDDATKTFTVTE

Data sets:

assigned_chemical_shifts
- assigned_chem_shift_list_1
- assigned_chem_shift_list_2

Data type	Count
13C chemical shifts	333
15N chemical shifts	128
1H chemical shifts	66

Additional metadata:

Assembly
Samples and Experiments
Software
Spectrometers
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Assembly:

Entity Assembly ID	Entity Name	Entity ID
1	monomer	1

Entities:

Entity 1, monomer 56 residues - 6228.870 Da.

1

MET

GLN

TYR

LYS

LEU

ILE

LEU

ASN

GLY

LYS

2

THR

LEU

LYS

GLY

GLU

THR

GLU

ALA

3

VAL

ASP

ALA

THR

ALA

GLU

LYS

VAL

PHE

4

LYS

GLN

TYR

ALA

ASN

ASP

ASN

GLY

VAL

ASP

5

GLY

GLU

TRP

THR

TYR

ASP

ALA

THR

LYS

6

THR

PHE

THR

VAL

THR

GLU

Name	Sample	Sample state	Sample conditions
2D CC DARR mixing	sample_1	solid	sample_conditions_1
2D N(CA)CX	sample_1	solid	sample_conditions_1
2D N(CO)CX	sample_1	solid	sample_conditions_1
3D NCACX	sample_1	solid	sample_conditions_1
3D NCOCX	sample_1	solid	sample_conditions_1
3D CAN(COCX)	sample_1	solid	sample_conditions_1
2D CC SPC5 DQ mixing	sample_1	solid	sample_conditions_1
2D NH	sample_2	solid	sample_conditions_2
3D CON(H)H	sample_2	solid	sample_conditions_2
3D HN(H)H	sample_2	solid	sample_conditions_2
2D N(H)H	sample_2	solid	sample_conditions_2

BMRB	15380 16444 16627 16755 16873 16882 16958 17810 18397 19394 26630
PDB	1GB1 1IBX 1PGA 1PGB 1PN5 2CWB 2DEN 2GB1 2GI9 2I2Y 2I38 2JSV 2JU6 2K0P 2KBT 2KHU 2KHW 2KLK 2KN4 2KQ4 2KWD 2LGI 2MBB 2PLP 2QMT 2RMM 3GB1 3MP9 3UI3 4Q0C
EMBL	CAA37410
GB	AAY41168

BMRB Entry 15156

Additional metadata:

Assembly:

Entities:

Samples:

Experiments:

Software:

NMR spectrometers:

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