BMRB Entry 6969

Name: Chemical Shift Assignment for SARS-CoV S2-HR2
Published: 2006-04-27

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PDB ID: 2fxp
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR6969
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Bioinformatics (2015) 31 (8): 1322-1324 doi:10.1093/bioinformatics/btu829

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Title:

Chemical Shift Assignment for SARS-CoV S2-HR2

Deposition date:

2006-02-06

Original release date:

2006-04-27

Authors:

Hakansson-McReynolds, Susanna; Caffrey, Michael; Jiang, Shaokai

Citation:

Citation: Hakansson-McReynolds, Susanna; Jiang, Shaokai; Rong, Lijun; Caffrey, Michael. "Solution structure of the SARS-coronavirus HR2 domain in the prefusion state" J. Biol. Chem. 281, 11965-11971 (2006).
PubMed: 16507566

Assembly members:

Assembly members:
S2-Hr2, polymer, 55 residues, Formula weight is not available

Natural source:

Natural source: Common Name: SARS coronavirus Taxonomy ID: 227859 Superkingdom: Viruses Kingdom: not available Genus/species: Coronavirus SARS coronavirus

Experimental source:

Experimental source: Production method: recombinant technology

Entity Sequences (FASTA):

Entity Sequences (FASTA):
S2-Hr2: GSHTSPDVDLGDISGINASV VNIQKEIDRLNEVAKNLNES LIDLQELGKYEQYIK

Data sets:

assigned_chemical_shifts
- chem_shift_list_1

Data type	Count
13C chemical shifts	213
15N chemical shifts	58
1H chemical shifts	333

Additional metadata:

Assembly
Samples and Experiments
Software
Spectrometers
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Assembly:

Entity Assembly ID	Entity Name	Entity ID
1	S2-HR2, chain 1	1
2	S2-HR2, chain 2	1
3	S2-HR2, chain 3	1

Entities:

Entity 1, S2-HR2, chain 1 55 residues - Formula weight is not available

1

GLY

SER

HIS

THR

SER

PRO

ASP

VAL

ASP

LEU

2

GLY

ASP

ILE

SER

GLY

ILE

ASN

ALA

SER

VAL

3

VAL

ASN

ILE

GLN

LYS

GLU

ILE

ASP

ARG

LEU

4

ASN

GLU

VAL

ALA

LYS

ASN

LEU

ASN

GLU

SER

5

LEU

ILE

ASP

LEU

GLN

GLU

LEU

GLY

LYS

TYR

6

GLU

GLN

TYR

ILE

LYS

Samples:

sample_1: S2-Hr2, [U-95% 13C; U-95% 15N], 1 ± 0.1 mM; TFE 30%

conditions_1: pH: 7; temperature: 298 K

Experiments:

Name	Sample	Sample state	Sample conditions
1H15N HSQC	sample_1	not available	conditions_1
HNC0	sample_1	not available	conditions_1
CBCA(CO)NH	sample_1	not available	conditions_1
CBCANH	sample_1	not available	conditions_1
15N-edited TOCSY-HSQC	sample_1	not available	conditions_1
HCC(CO)NH	sample_1	not available	conditions_1
CC(CO)NH	sample_1	not available	conditions_1
1H15N NOESY-HSQC	sample_1	not available	conditions_1

Software:

No software information available

NMR spectrometers:

Bruker AVANCE 800 MHz

PDB	1WNC 1ZV7 1ZV8 1ZVA 2BEQ 2BEZ 2FXP
DBJ	BAC81348 BAC81362 BAC81376 BAC81390 BAC81404
GB	AAP13441 AAP13567 AAP30030 AAP30713 AAP37017
REF	NP_828851
SP	P59594 Q0Q475 Q3I5J5 Q3LZX1
AlphaFold	P59594 Q0Q475 Q3I5J5 Q3LZX1