BMRB Entry 52100

Title:
Solution NMR structure of Bcl-2-xL bound to compound 35
Deposition date:
2023-08-24
Original release date:
2023-08-28
Authors:
Pan, Yun-Zu; Rizo, Josep
Citation:

Citation: Pan, Yun-Zu; Liang, Qireng; Tomchick, Diana; de Brabander, Jef; Rizo, Josep. "Structural insights for selective disruption of Beclin 1 binding to Bcl-2"  Commun. Biol. 6, 1080-1080 (2023).
PubMed: 37875561

Assembly members:

Assembly members:
entity_1, polymer, 177 residues, Formula weight is not available
entity_2, non-polymer, 505 Da.

Natural source:

Natural source:   Common Name: Human   Taxonomy ID: 9606   Superkingdom: Eukaryota   Kingdom: Metazoa   Genus/species: Homo sapiens

Experimental source:

Experimental source:   Production method: recombinant technology   Host organism: Escherichia coli   Vector: pGEX-4T1

Data sets:
Data typeCount
13C chemical shifts753
15N chemical shifts185
1H chemical shifts1194

Additional metadata:

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

Entity Assembly IDEntity NameEntity ID
1Bcl-2-xL1
2Compound 352

Entities:

Entity 1, Bcl-2-xL 177 residues - Formula weight is not available

1   METALAHISALAGLYARGTHRGLYTYRASP
2   ASNARGGLUILEVALMETLYSTYRILEHIS
3   TYRLYSLEUSERGLNARGGLYTYRGLUTRP
4   ASPALAGLYASPASPVALGLUGLUASNARG
5   THRGLUALAPROGLUGLYTHRGLUSERGLU
6   VALVALHISLEUTHRLEUARGGLNALAGLY
7   ASPASPPHESERARGARGTYRARGARGASP
8   PHEALAGLUMETSERSERGLNLEUHISLEU
9   THRPROPHETHRALAARGGLYARGPHEALA
10   THRVALVALGLUGLULEUPHEARGASPGLY
11   VALASNTRPGLYARGILEVALALAPHEPHE
12   GLUPHEGLYGLYVALMETCYSVALGLUSER
13   VALASNARGGLUMETSERPROLEUVALASP
14   ASNILEALALEUTRPMETTHRGLUTYRLEU
15   ASNARGHISLEUHISTHRTRPILEGLNASP
16   ASNGLYGLYTRPASPALAPHEVALGLULEU
17   TYRGLYPROSERMETARGPROLEUPHEASP
18   PHESERTRPLEUSERLEULYS

Entity 2, Compound 35 - C26 H24 Br N3 O3 - 505 Da.

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