BMRB Entry 50089

Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR50089

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Title:
MBP in the solid state
Deposition date:
2019-11-14
Original release date:
2021-04-16
Authors:
Schubeis, Tobias; Stanek, Jan; Pintacuda, Guido
Citation:

Citation: Schubeis, Tobias; Stanek, Jan; Pintacuda, Guido. "Backbone assignment of crystalline E. coli maltose binding protein"  Biomol. NMR Assignments 15, 317-322 (2021).
PubMed: 33864192

Assembly members:

Assembly members:
entity_1, polymer, . residues, Formula weight is not available
entity_MAL, non-polymer, 342.296 Da.

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):
entity_1: GKIEEGKLVIWINGDKGYNG LAEVGKKFEKDTGIKVTVEH PDKLEEKFPQVAATGDGPDI IFWAHDRFGGYAQSGLLAEI TPDKAFQDKLYPFTWDAVRY NGKLIAYPIAVEALSLIYNK DLLPNPPKTWEEIPALDKEL KAKGKSALMFNLQEPYFTWP LIAADGGYAFKYENGKYDIK DVGVDNAGAKAGLTFLVDLI KNKHMNADTDYSIAEAAFNK GETAMTINGPWAWSNIDTSK VNYGVTVLPTFKGQPSKPFV GVLSAGINAASPNKELAKEF LENYLLTDEGLEAVNKDKPL GAVALKSYEEELAKDPRIAA TMENAQKGEIMPNIPQMSAF WYAVRTAVINAASGRQTVDE ALKDAQTRITK

Data sets:
Data typeCount
13C chemical shifts949
15N chemical shifts326
1H chemical shifts850

Additional metadata:

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

Assembly:

Entity Assembly IDEntity NameEntity ID
1entity_11
2entity_MAL2

Entities:

Entity 1, entity_1 - Formula weight is not available

1   GLYLYSILEGLUGLUGLYLYSLEUVALILE
2   TRPILEASNGLYASPLYSGLYTYRASNGLY
3   LEUALAGLUVALGLYLYSLYSPHEGLULYS
4   ASPTHRGLYILELYSVALTHRVALGLUHIS
5   PROASPLYSLEUGLUGLULYSPHEPROGLN
6   VALALAALATHRGLYASPGLYPROASPILE
7   ILEPHETRPALAHISASPARGPHEGLYGLY
8   TYRALAGLNSERGLYLEULEUALAGLUILE
9   THRPROASPLYSALAPHEGLNASPLYSLEU
10   TYRPROPHETHRTRPASPALAVALARGTYR
11   ASNGLYLYSLEUILEALATYRPROILEALA
12   VALGLUALALEUSERLEUILETYRASNLYS
13   ASPLEULEUPROASNPROPROLYSTHRTRP
14   GLUGLUILEPROALALEUASPLYSGLULEU
15   LYSALALYSGLYLYSSERALALEUMETPHE
16   ASNLEUGLNGLUPROTYRPHETHRTRPPRO
17   LEUILEALAALAASPGLYGLYTYRALAPHE
18   LYSTYRGLUASNGLYLYSTYRASPILELYS
19   ASPVALGLYVALASPASNALAGLYALALYS
20   ALAGLYLEUTHRPHELEUVALASPLEUILE
21   LYSASNLYSHISMETASNALAASPTHRASP
22   TYRSERILEALAGLUALAALAPHEASNLYS
23   GLYGLUTHRALAMETTHRILEASNGLYPRO
24   TRPALATRPSERASNILEASPTHRSERLYS
25   VALASNTYRGLYVALTHRVALLEUPROTHR
26   PHELYSGLYGLNPROSERLYSPROPHEVAL
27   GLYVALLEUSERALAGLYILEASNALAALA
28   SERPROASNLYSGLULEUALALYSGLUPHE
29   LEUGLUASNTYRLEULEUTHRASPGLUGLY
30   LEUGLUALAVALASNLYSASPLYSPROLEU
31   GLYALAVALALALEULYSSERTYRGLUGLU
32   GLULEUALALYSASPPROARGILEALAALA
33   THRMETGLUASNALAGLNLYSGLYGLUILE
34   METPROASNILEPROGLNMETSERALAPHE
35   TRPTYRALAVALARGTHRALAVALILEASN
36   ALAALASERGLYARGGLNTHRVALASPGLU
37   ALALEULYSASPALAGLNTHRARGILETHR
38   LYS

Entity 2, entity_MAL - C12 H22 O11 - 342.296 Da.

1   MAL

Samples:

sample_1: Maltose 1 mM; HEPES 10 mM; ammonium sulfate 3 M; MBP, [U-99% 13C; U-99% 15N], 1 mM

sample_conditions_1: pH: 7.5; pressure: 1 atm; temperature: 290 K

Experiments:

NameSampleSample stateSample conditions
hCANHsample_1isotropicsample_conditions_1
hCAcoNHsample_1isotropicsample_conditions_1
hCONHsample_1isotropicsample_conditions_1
hCOcaNHsample_1isotropicsample_conditions_1
hNCAHsample_1isotropicsample_conditions_1
hNcoCAHsample_1isotropicsample_conditions_1
hNcacoNHsample_1isotropicsample_conditions_1
hCAncoCAHsample_1isotropicsample_conditions_1
hcaCBCAHsample_1isotropicsample_conditions_1
hcaCBcaNHsample_1isotropicsample_conditions_1
HCCH-TOCSYsample_1isotropicsample_conditions_1

Software:

CcpNMR v2.4.2, CCPN - chemical shift assignment, peak picking

NMR spectrometers:

  • Bruker Avance 800 MHz

Related Database Links:

UNP P0AEX9
AlphaFold Q2M6S0

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