BMRB Entry 28080

Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR28080

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Title:
etEIC backbone and I/L/V methyl resonance assignment
Deposition date:
2020-02-10
Original release date:
2021-07-16
Authors:
Dotas, Rochelle; Veditti, Vincenzo
Citation:

Citation: Dotas, Rochelle; Nguyen, Trang; Stewart, Charles; Ghirlando, Rodolfo; Potoyan, Davit; Venditti, Vincenzo. "Hybrid Thermophilic/Mesophilic Enzymes Reveal a Role for Conformational Disorder in Regulation of Bacterial Enzyme I"  J. Mol. Biol. 432, 4481-4498 (2020).
PubMed: 32504625

Assembly members:

Assembly members:
etEIC, polymer, 314 residues, Formula weight is not available

Natural source:

Natural source:   Common Name: E. coli   Taxonomy ID: 562   Superkingdom: Bacteria   Kingdom: not available   Genus/species: Escherichia coli

Experimental source:

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

Entity Sequences (FASTA):

Entity Sequences (FASTA):
etEIC: MAETPDGKKVMLAANIGTVR DVASALANGAEGVGLFRTEF LFMDRDALPTEEEQFEAYKE VVEKMGGRPVTIRTMDIGGD KELPYMNFPKEENPFLGWRA IRLCLDRPDIFKTQLRAILR ASAYGNVQIMYPMISSVEEV RKANSILEEVKAELDREGVK YDKEIKVGIMVEIPSAAVTA DILAKEVDFFSIGTNDLTQY TLAVDRGNDMISHLYQPMSP AILRLVKMVIDAAHKEGKFA AMCGEMAGDPLAAVILLGLG LDEFSMSATSIPEIKNIIRN VEYEKAKEIAEKALNMSEAR EIEKMMKDVIKDIG

Data sets:
Data typeCount
13C chemical shifts958
15N chemical shifts278
1H chemical shifts569

Additional metadata:

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

Assembly:

Entity Assembly IDEntity NameEntity ID
1etEIC1

Entities:

Entity 1, etEIC 314 residues - Formula weight is not available

1   METALAGLUTHRPROASPGLYLYSLYSVAL
2   METLEUALAALAASNILEGLYTHRVALARG
3   ASPVALALASERALALEUALAASNGLYALA
4   GLUGLYVALGLYLEUPHEARGTHRGLUPHE
5   LEUPHEMETASPARGASPALALEUPROTHR
6   GLUGLUGLUGLNPHEGLUALATYRLYSGLU
7   VALVALGLULYSMETGLYGLYARGPROVAL
8   THRILEARGTHRMETASPILEGLYGLYASP
9   LYSGLULEUPROTYRMETASNPHEPROLYS
10   GLUGLUASNPROPHELEUGLYTRPARGALA
11   ILEARGLEUCYSLEUASPARGPROASPILE
12   PHELYSTHRGLNLEUARGALAILELEUARG
13   ALASERALATYRGLYASNVALGLNILEMET
14   TYRPROMETILESERSERVALGLUGLUVAL
15   ARGLYSALAASNSERILELEUGLUGLUVAL
16   LYSALAGLULEUASPARGGLUGLYVALLYS
17   TYRASPLYSGLUILELYSVALGLYILEMET
18   VALGLUILEPROSERALAALAVALTHRALA
19   ASPILELEUALALYSGLUVALASPPHEPHE
20   SERILEGLYTHRASNASPLEUTHRGLNTYR
21   THRLEUALAVALASPARGGLYASNASPMET
22   ILESERHISLEUTYRGLNPROMETSERPRO
23   ALAILELEUARGLEUVALLYSMETVALILE
24   ASPALAALAHISLYSGLUGLYLYSPHEALA
25   ALAMETCYSGLYGLUMETALAGLYASPPRO
26   LEUALAALAVALILELEULEUGLYLEUGLY
27   LEUASPGLUPHESERMETSERALATHRSER
28   ILEPROGLUILELYSASNILEILEARGASN
29   VALGLUTYRGLULYSALALYSGLUILEALA
30   GLULYSALALEUASNMETSERGLUALAARG
31   GLUILEGLULYSMETMETLYSASPVALILE
32   LYSASPILEGLY

Samples:

sample_1: etEIC, [U-13C; U-15N; U-2H], 1 mM; D2O, [U-99% 2H], 10%; DTT 2 mM; sodium chloride 100 mM; TRIS 20 mM; EDTA 1 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
3D HNCAsample_1isotropicsample_conditions_1
3D HNCACBsample_1isotropicsample_conditions_1
3D HN(CO)CAsample_1isotropicsample_conditions_1
3D HNHAsample_1isotropicsample_conditions_1
3D HN(COCA)CBsample_1isotropicsample_conditions_1
2D 1H-13C HSQCsample_1isotropicsample_conditions_1
3D HCCH-TOCSYsample_1isotropicsample_conditions_1

Software:

SPARKY, Goddard - chemical shift assignment, data analysis, peak picking

NMR spectrometers:

  • Varian Avance 700 MHz

Download HSQC peak lists in one of the following formats:
CSV: Backbone or all simulated peaks
SPARKY: Backbone or all simulated peaks