BMRB Entry 15462

Name: Solution NMR Structure of HI0947 from Haemophilus influenzae, Northeast Structural Genomics Consortium Target IR123
Published: 2007-10-16

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PDB ID: 2juz
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR15462
MolProbity Validation Chart

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Nicholas Rego and David Koes
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Bioinformatics (2015) 31 (8): 1322-1324 doi:10.1093/bioinformatics/btu829

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Title:

Solution NMR Structure of HI0947 from Haemophilus influenzae, Northeast Structural Genomics Consortium Target IR123

Deposition date:

2007-09-09

Original release date:

2007-10-16

Authors:

Ding, Keyang; Ramelot, Theresa; Cort, John; Wang, Dongyan; Nwosu, Chioma; Owens, Leah; Xiao, Rong; Liu, Jinfeng; Baran, Michael; Swapna, Gurla; Acton, Thomas; Rost, Burkhard; Montelione, Gaetano; Kennedy, Michael

Citation:

Citation: Ding, Keyang; Ramelot, Theresa; Cort, John; Wang, Dongyan; Nwosu, Chioma; Owens, Leah; Xiao, Rong; Liu, Jinfeng; Baran, Michael; Swapna, Gurla; Acton, Thomas; Rost, Burkhard; Montelione, Gaetano; Kennedy, Michael. "Solution NMR Structure of HI0947 from Haemophilus influenzae." .

Assembly members:

Assembly members:
HI0947, polymer, 160 residues, 17510.121 Da.

Natural source:

Natural source: Common Name: Haemophilus influenzae Taxonomy ID: 727 Superkingdom: Bacteria Kingdom: not available Genus/species: Haemophilus influenzae

Experimental source:

Experimental source: Production method: recombinant technology Host organism: Escherichia coli Vector: pET21

Entity Sequences (FASTA):

Entity Sequences (FASTA):
HI0947: MAQHSKYSDAQLSAIVNDMI AVLEKHKAPVDLSLIALGNM ASNLLTTSVPQTQCEALAQA FSNSLINAVKTRLEHHHHHH MAQHSKYSDAQLSAIVNDMI AVLEKHKAPVDLSLIALGNM ASNLLTTSVPQTQCEALAQA FSNSLINAVKTRLEHHHHHH

Data sets:

assigned_chemical_shifts
- assigned_chem_shift_list_1

Data type	Count
13C chemical shifts	330
15N chemical shifts	86
1H chemical shifts	547

Time Domain Data

Additional metadata:

Assembly
Samples and Experiments
Software
Spectrometers
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Assembly:

Entity Assembly ID	Entity Name	Entity ID
1	entity_1	1
2	entity_2	1

Entities:

Entity 1, entity_1 160 residues - 17510.121 Da.

The full sequence is cloned with his-tag LEHHHHHH added at the C terminal.

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

Name	Sample	Sample state	Sample conditions
2D 1H-15N HSQC	sample_1	isotropic	sample_conditions_1
2D 1H-13C HSQC	sample_1	isotropic	sample_conditions_1
2D 1H-13C Arom HSQC	sample_1	isotropic	sample_conditions_1
3D HNCO	sample_1	isotropic	sample_conditions_1
3D CBCA(CO)NH	sample_1	isotropic	sample_conditions_1
3D HNCACB	sample_1	isotropic	sample_conditions_1
3D HBHA(CO)NH	sample_1	isotropic	sample_conditions_1
3D HNHA	sample_1	isotropic	sample_conditions_1
3D HCCH-TOCSY	sample_1	isotropic	sample_conditions_1
3D 1H-15N NOESY	sample_1	isotropic	sample_conditions_1
3D 1H-13C NOESY	sample_1	isotropic	sample_conditions_1
3D 1H-13C Arom NOESY	sample_1	isotropic	sample_conditions_1
4D 1H-13C NOESY	sample_2	isotropic	sample_conditions_1

BMRB Entry 15462

Additional metadata:

Assembly:

Entities:

Samples:

Experiments:

Software:

NMR spectrometers:

Related Database Links:

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

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

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