BMRB

Biological Magnetic Resonance Data Bank


A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
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BMRB Entry 27762

Title: Resonance Assignment of the 128 kDa Enzyme I dimer from Thermoanaerobacter tengcongenesis   PubMed: 31025174

Deposition date: 2019-01-22 Original release date: 2019-05-23

Authors: Dotas, Rochelle; Venditti, Vincenzo

Citation: Dotas, Rochelle; Venditti, Vincenzo. "Resonance assignment of the 128 kDa enzyme I dimer from Thermoanaerobacter tengcongensis"  Biomol. NMR Assignments 13, 287-293 (2019).

Assembly members:
thermophilic_Enzyme_I_(tEI), polymer, 573 residues, Formula weight is not available

Natural source:   Common Name: Thermus thermophilus   Taxonomy ID: 274   Superkingdom: Bacteria   Kingdom: not available   Genus/species: Thermus thermophilus

Experimental source:   Production method: recombinant technology   Host organism: Escherichia coli   Vector: pet21A

Entity Sequences (FASTA):
thermophilic_Enzyme_I_(tEI): MLKGVAASPGIAIGKAFLYT KEKVTINVEKIEESKVEEEI AKFRKALEVTQEEIEKIKEK ALKEFGKEKAEIFEAHLMLA SDPELIEGVENMIKTELVTA DNAVNKVIEQNASVMESLND EYLKERAVDLRDVGNRIIEN LLGVKSVNLSDLEEEVVVIA RDLTPSDTATMKKEMVLGFA TDVGGRTSHTAIMARSLEIP AVVGLGNVTSQVKAGDLVIV DGLEGIVIVNPDEKTVEDYK SKKESYEKKVEGLKQLKDLP AETPDGKKVMLAANIGTPKD VASALANGAEGVGLFRTEFL YMDRNSLPSEEEQFEAYKEV VEKMGGRPVTIRTLDIGGDK ELPYLDMPKEMNPFLGYRAI RLCLDRPDIFKTQLRAILRA SAYGNVQIMYPMISSVEEVR KANSILEEVKAELDREGVKY DKEIKVGIMVEIPSAAVTAD ILAKEVDFFSIGTNDLTQYT LAVDRMNEHVKEYYQPFHPA ILRLVKMVIDAAHKEGKFAA MCGEMAGDPLAAVILLGLGL DEFSMSATSIPEIKNIIRNV EYEKAKEIAEKALNMSEARE IEKMMKDVIKDIG

Data sets:
Data typeCount
13C chemical shifts424
15N chemical shifts439
1H chemical shifts439

Additional metadata:

  • Assembly
  • Samples and Experiments
  • Software
  • Spectrometers
  • Hide all

Assembly:

Entity Assembly IDEntity NameEntity ID
1thermophilic Enzyme I (tEI)1

Entities:

Entity 1, thermophilic Enzyme I (tEI) 573 residues - Formula weight is not available

1   METLEULYSGLYVALALAALASERPROGLY
2   ILEALAILEGLYLYSALAPHELEUTYRTHR
3   LYSGLULYSVALTHRILEASNVALGLULYS
4   ILEGLUGLUSERLYSVALGLUGLUGLUILE
5   ALALYSPHEARGLYSALALEUGLUVALTHR
6   GLNGLUGLUILEGLULYSILELYSGLULYS
7   ALALEULYSGLUPHEGLYLYSGLULYSALA
8   GLUILEPHEGLUALAHISLEUMETLEUALA
9   SERASPPROGLULEUILEGLUGLYVALGLU
10   ASNMETILELYSTHRGLULEUVALTHRALA
11   ASPASNALAVALASNLYSVALILEGLUGLN
12   ASNALASERVALMETGLUSERLEUASNASP
13   GLUTYRLEULYSGLUARGALAVALASPLEU
14   ARGASPVALGLYASNARGILEILEGLUASN
15   LEULEUGLYVALLYSSERVALASNLEUSER
16   ASPLEUGLUGLUGLUVALVALVALILEALA
17   ARGASPLEUTHRPROSERASPTHRALATHR
18   METLYSLYSGLUMETVALLEUGLYPHEALA
19   THRASPVALGLYGLYARGTHRSERHISTHR
20   ALAILEMETALAARGSERLEUGLUILEPRO
21   ALAVALVALGLYLEUGLYASNVALTHRSER
22   GLNVALLYSALAGLYASPLEUVALILEVAL
23   ASPGLYLEUGLUGLYILEVALILEVALASN
24   PROASPGLULYSTHRVALGLUASPTYRLYS
25   SERLYSLYSGLUSERTYRGLULYSLYSVAL
26   GLUGLYLEULYSGLNLEULYSASPLEUPRO
27   ALAGLUTHRPROASPGLYLYSLYSVALMET
28   LEUALAALAASNILEGLYTHRPROLYSASP
29   VALALASERALALEUALAASNGLYALAGLU
30   GLYVALGLYLEUPHEARGTHRGLUPHELEU
31   TYRMETASPARGASNSERLEUPROSERGLU
32   GLUGLUGLNPHEGLUALATYRLYSGLUVAL
33   VALGLULYSMETGLYGLYARGPROVALTHR
34   ILEARGTHRLEUASPILEGLYGLYASPLYS
35   GLULEUPROTYRLEUASPMETPROLYSGLU
36   METASNPROPHELEUGLYTYRARGALAILE
37   ARGLEUCYSLEUASPARGPROASPILEPHE
38   LYSTHRGLNLEUARGALAILELEUARGALA
39   SERALATYRGLYASNVALGLNILEMETTYR
40   PROMETILESERSERVALGLUGLUVALARG
41   LYSALAASNSERILELEUGLUGLUVALLYS
42   ALAGLULEUASPARGGLUGLYVALLYSTYR
43   ASPLYSGLUILELYSVALGLYILEMETVAL
44   GLUILEPROSERALAALAVALTHRALAASP
45   ILELEUALALYSGLUVALASPPHEPHESER
46   ILEGLYTHRASNASPLEUTHRGLNTYRTHR
47   LEUALAVALASPARGMETASNGLUHISVAL
48   LYSGLUTYRTYRGLNPROPHEHISPROALA
49   ILELEUARGLEUVALLYSMETVALILEASP
50   ALAALAHISLYSGLUGLYLYSPHEALAALA
51   METCYSGLYGLUMETALAGLYASPPROLEU
52   ALAALAVALILELEULEUGLYLEUGLYLEU
53   ASPGLUPHESERMETSERALATHRSERILE
54   PROGLUILELYSASNILEILEARGASNVAL
55   GLUTYRGLULYSALALYSGLUILEALAGLU
56   LYSALALEUASNMETSERGLUALAARGGLU
57   ILEGLULYSMETMETLYSASPVALILELYS
58   ASPILEGLY

Samples:

sample_1: thermophilic Enzyme I (tEI), [U-100% 13C; U-100% 15N], 0.75 mM; TRIS 20 mM; DTT 2 mM; EDTA 1 mM; sodium chloride 100 mM; MgCl2 4 mM

sample_conditions_1: pH: 7.4; pressure: 1 atm; temperature: 273 K

Experiments:

NameSampleSample stateSample conditions
2D 1H-15N HSQCsample_1isotropicsample_conditions_1
3D HNCOsample_1isotropicsample_conditions_1

Software:

SPARKY, Goddard - chemical shift assignment, data analysis

NMRPipe, Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax - processing

TOPSPIN, Bruker Biospin - collection

NMR spectrometers:

  • Bruker Avance 800 MHz

Download simulated HSQC data in one of the following formats:
CSV: Backbone or all simulated shifts
SPARKY: Backbone or all simulated shifts