BMRB Entry 17226

Name: 1H, 15N, and 13C chemical shift assignments, and 15N dynamics for trHbN-cyanomet from M. tuberculosis
Published: 2011-10-28

Chem Shift validation: AVS_anomalous, AVS_full, LACS
BMRB Entry DOI: doi:10.13018/BMR17226

NMR-STAR file interactive viewer.
NMR-STAR v3 text file.
NMR-STAR v2.1 text file (deprecated)
XML gzip file.
RDF gzip file.
All files associated with the entry

Nicholas Rego and David Koes
3Dmol.js: molecular visualization with WebGL
Bioinformatics (2015) 31 (8): 1322-1324 doi:10.1093/bioinformatics/btu829

Select model:

I am color blind

Download raw data. Direct link to this display. Help

Title: 1H, 15N, and 13C chemical shift assignments, and 15N dynamics for trHbN-cyanomet from M. tuberculosis PubMed: 21999759

Deposition date: 2010-09-30 Original release date: 2011-10-28

Authors: Savard, Pierre-Yves; Morin, Sebastien; Sebilo, Anne; Meindre, Fanny; Guertin, Michel; Gagne, Stephane

Citation: Savard, Pierre-Yves; Daigle, Richard; Morin, Sebastien; Sebilo, Anne; Meindre, Fanny; Lague, Patrick; Guertin, Michel; Gagne, Stephane. "Structure and dynamics of Mycobacterium tuberculosis truncated hemoglobin N: insights from NMR spectroscopy and molecular dynamics simulations." Biochemistry 50, 11121-11130 (2011).

Assembly members:
trHbN, polymer, 136 residues, 14317.3 Da.
FE, non-polymer, 55.845 Da.
CYN, non-polymer, 26.017 Da.

Natural source: Common Name: Mycobacterium tuberculosis Taxonomy ID: 1773 Superkingdom: Bacteria Kingdom: not available Genus/species: Mycobacterium tuberculosis

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

Entity Sequences (FASTA):
trHbN: MGLLSRLRKREPISIYDKIG GHEAIEVVVEDFYVRVLADD QLSAFFSGTNMSRLKGKQVE FFAAALGGPEPYTGAPMKQV HQGRGITMHHFSLVAGHLAD ALTAAGVPSETITEILGVIA PLAVDVTSGESTTAPV

Data sets:

assigned_chemical_shifts
- assignments_hbn
heteronucl_NOEs
heteronucl_T1_relaxation
heteronucl_T2_relaxation
- heteronuclear_R2_list_1
- heteronuclear_R2_list_2
order_parameters
- order_parameter_list_1

Data type	Count
13C chemical shifts	446
15N chemical shifts	123
1H chemical shifts	555
heteronuclear NOE values	303
order parameters	101
T1 relaxation values	303
T2 relaxation values	201

Additional metadata:

Assembly
Samples and Experiments
Software
Spectrometers
Hide all

Entity Assembly ID	Entity Name	Entity ID
1	trHbN	1
2	iron ion	2
3	cyanide ion	3

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

PDB	1IDR 1RTE 1S56 1S61 2GKM 2GKN 2GL3 2GLN 5AB8
DBJ	BAH25857 BAL65514 BAQ05541 GAA45289
EMBL	CAB56291 CAL71581 CCC26641 CCC43897 CCC64155
GB	AAD28758 AAK45860 ABQ73299 ABR05918 ACT25509
REF	NP_216058 NP_855221 WP_003407730 WP_003911564 WP_015289952
SP	P0A593 P0A594 P9WN24 P9WN25

Biological Magnetic Resonance Data Bank

BMRB Entry 17226

Title: 1H, 15N, and 13C chemical shift assignments, and 15N dynamics for trHbN-cyanomet from M. tuberculosis PubMed: 21999759

Additional metadata:

Assembly:

Entities:

Samples:

Experiments:

Software:

NMR spectrometers:

Related Database Links: