BMRB Entry 34716

Title:
Solution structure of thanatin-like derivative 7 in complex with K. pneumoniae LptA
Deposition date:
2022-03-22
Original release date:
2023-05-30
Authors:
Oi, K.; Moehle, K.; Zerbe, O.
Citation:

Citation: Schuster, M.; Brabet, E.; Oi, K.; Desjonqueres, N.; Moehle, K.; Le Poupon, K.; Hell, S.; Gable, S.; Rithie, V.; Dillinger, S.; Zbinden, P.; Luther, A.; Li, C.; Stiegeler, S.; D'Arco, C.; Locher, H.; Remus, T.; DiMaio, S.; Motta, P.; Wach, A.; Jung, F.; Upert, G.; Obrecht, D.; Benghezal, M.; Zerbe, O.. "Peptidomimetic antibiotics disrupt the lipopolysaccharide transport bridge of drug-resistant Enterobacteriaceae."  Sci. Adv. 9, eadg3683-eadg3683 (2023).
PubMed: 37224246

Assembly members:

Assembly members:
entity_1, polymer, 133 residues, 14790.585 Da.
entity_2, polymer, 16 residues, 2007.387 Da.

Natural source:

Natural source:   Common Name: Klebsiella pneumoniae   Taxonomy ID: 573   Superkingdom: Bacteria   Kingdom: not available   Genus/species: Klebsiella pneumoniae

Experimental source:

Experimental source:   Production method: recombinant technology   Host organism: Escherichia coli K-12

Data sets:
Data typeCount
13C chemical shifts552
15N chemical shifts143
1H chemical shifts1018

Additional metadata:

  • Assembly
  • Samples and Experiments
  • Software
  • Spectrometers
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Assembly:

Entity Assembly IDEntity NameEntity ID
1unit_11
2unit_22

Entities:

Entity 1, unit_1 133 residues - 14790.585 Da.

1   GLYLYSTHRGLYASPTHRASPGLNPROILE
2   HISILEGLUSERASPGLNGLNSERLEUASP
3   METGLNGLYASNVALVALTHRPHETHRGLY
4   ASNVALVALVALTHRGLNGLYTHRILELYS
5   ILEASNALAASPLYSVALVALVALTHRARG
6   PROGLYASNGLULYSGLYLYSGLUVALILE
7   GLUGLYPHEGLYASNPROALATHRPHETYR
8   GLNMETGLNASPASNGLYLYSPROVALLYS
9   GLYARGALASERLYSMETARGTYRGLULEU
10   GLNASNASPTYRVALVALLEUTHRGLYASN
11   ALATYRLEUGLUGLNLEUASPSERASNILE
12   LYSGLYASPLYSILETHRTYRLEUVALLYS
13   GLUGLNLYSMETGLNALAPHESERASPLYS
14   GLYARGARG

Entity 2, unit_2 16 residues - 2007.387 Da.

1   EU0HYPILETHRTYRLE1ASNARGDABTHR
2   4FOLYSCYSDABARGTYR

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