BMRB Entry 4840

Chem Shift validation: AVS_full, LACS
BMRB Entry DOI: doi:10.13018/BMR4840

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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:

1H, 13C and 15N resonance assignment and secondary structure of Mycobacterium tuberculosis adenylate kinase

Deposition date:

2000-09-26

Original release date:

2001-02-14

Authors:

Miron, Simona; Munier-Lehmann, Helene; Craescu, Constantin

Citation:

Citation: Miron, Simona; Munier-Lehmann, Helene; Craescu, Constantin. "Letter to the Editor: 1H, 13C and 15N resonance assignment and secondary structure of Mycobacterium tuberculosis adenylate kinase" J. Biomol. NMR 19, 89-90 (2001).

Assembly members:

Assembly members:
Adenylate kinase from M. tuberculosis, polymer, 181 residues, Formula weight is not available

Natural source:

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

Experimental source:

Experimental source: Production method: recombinant technology Host organism: Escherichia coli Vector: pHL20

Entity Sequences (FASTA):

Entity Sequences (FASTA):
Adenylate kinase from M. tuberculosis: MRVLLLGPPGAGKGTQAVKL AEKLGIPQISTGELFRRNIE EGTKLGVEAKRYLDAGDLVP SDLTNELVDDRLNNPDAANG FILDGYPRSVEQAKALHEML ERRGTDIDAVLEFRVSEEVL LERLKGRGRADDTDDVILNR MKVYRDETAPLLEYYRDQLK TVDAVGTMDEVFARALRALG K

Data sets:

assigned_chemical_shifts
- chemical_shift_assignment_AKmt

Data type	Count
1H chemical shifts	848
13C chemical shifts	333
15N chemical shifts	178

Additional metadata:

Assembly
Samples and Experiments
Software
Spectrometers
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Assembly:

Entity Assembly ID	Entity Name	Entity ID
1	AK	1

Entities:

Entity 1, AK 181 residues - Formula weight is not available

1

MET

ARG

VAL

LEU

GLY

PRO

GLY

2

ALA

GLY

LYS

GLY

THR

GLN

ALA

VAL

LYS

LEU

3

ALA

GLU

LYS

LEU

GLY

ILE

PRO

GLN

ILE

SER

4

THR

GLY

GLU

LEU

PHE

ARG

ASN

ILE

GLU

5

GLU

GLY

THR

LYS

LEU

GLY

VAL

GLU

ALA

LYS

6

ARG

TYR

LEU

ASP

ALA

GLY

ASP

LEU

VAL

PRO

7

SER

ASP

LEU

THR

ASN

GLU

LEU

VAL

ASP

8

ARG

LEU

ASN

PRO

ASP

ALA

ASN

GLY

9

PHE

ILE

LEU

ASP

GLY

TYR

PRO

ARG

SER

VAL

10

GLU

GLN

ALA

LYS

ALA

LEU

HIS

GLU

MET

LEU

11

GLU

ARG

GLY

THR

ASP

ILE

ASP

ALA

VAL

12

LEU

GLU

PHE

ARG

VAL

SER

GLU

VAL

LEU

13

LEU

GLU

ARG

LEU

LYS

GLY

ARG

GLY

ARG

ALA

14

ASP

THR

ASP

VAL

ILE

LEU

ASN

ARG

15

MET

LYS

VAL

TYR

ARG

ASP

GLU

THR

ALA

PRO

16

LEU

GLU

TYR

ARG

ASP

GLN

LEU

LYS

17

THR

VAL

ASP

ALA

VAL

GLY

THR

MET

ASP

GLU

18

VAL

PHE

ALA

ARG

ALA

LEU

ARG

ALA

LEU

GLY

19

LYS

Samples:

sample_one: Adenylate kinase from M. tuberculosis 1.0 mM; H2O 95%; D2O 5%

sample_two: Adenylate kinase from M. tuberculosis, [U-15N], 1.0 mM; H2O 95%; D2O 5%

sample_three: Adenylate kinase from M. tuberculosis, [U-15N; U-13C], 1.2 mM; H2O 95%; D2O 5%

sample_conditions_one: pH: 7.1; temperature: 308 K

Experiments:

Name	Sample	Sample state	Sample conditions

Software:

No software information available

NMR spectrometers:

Varian Unity 500 MHz
Varian Inova 750 MHz

PDB	1P4S 2CDN
DBJ	BAH25046 BAL64618 BAQ04633 GAA44509
EMBL	CAD93616 CAL70769 CCC25815 CCC43078 CCC63341
GB	AAD09879 AAK44991 ABQ72469 ABR05090 ACT23783
REF	NP_215247 NP_335177 NP_854412 WP_003403726 WP_003911271
SP	A1KGL4 A5U0B9 C1AL67 P69439 P9WKF4
AlphaFold	A1KGL4 A5U0B9 C1AL67 P69439 P9WKF4