BMRB Entry 25640

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PDB ID: 2n3b
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_anomalous, AVS_full, LACS, SPARTA
BMRB Entry DOI: doi:10.13018/BMR25640
MolProbity Validation Chart

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Title:
STRUCTURE OF OXIDIZED HORSE HEART CYTOCHROME C ENCAPSULATED IN REVERSE MICELLES
Deposition date:
2015-05-27
Original release date:
2015-10-26
Authors:
O'Brien, Evan; Nucci, Nathaniel; Fuglestad, Brian; Tommos, Cecilia; Wand, A. Joshua
Citation:

Citation: O'Brien, Evan; Nucci, Nathaniel; Fuglestad, Brian; Tommos, Cecilia; Wand, A. Joshua. "Defining the Apoptotic Trigger: THE INTERACTION OF CYTOCHROME c AND CARDIOLIPIN"  J. Biol. Chem. 290, 30879-30887 (2015).
PubMed: 26487716

Assembly members:

Assembly members:
entity_1, polymer, 105 residues, 11744.722 Da.
WATER, water, 18.015 Da.

Natural source:

Natural source:   Common Name: odd-toed ungulates   Taxonomy ID: 9796   Superkingdom: Eukaryota   Kingdom: Metazoa   Genus/species: Equus caballus

Experimental source:

Experimental source:   Production method: recombinant technology   Host organism: Escherichia coli   Vector: pJRhrsN2

Entity Sequences (FASTA):

Entity Sequences (FASTA):
entity_1: GDVEKGKKIFVQKCAQCXTV EKGGKHKTGPNLHGLFGRKT GQAPGFTYTDANKNKGITWK EETLMEYLENPKKYIPGTKM IFAGIKKKTEREDLIAYLKK ATNEX

Data sets:
Data typeCount
13C chemical shifts396
15N chemical shifts103
1H chemical shifts697

Additional metadata:

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Assembly:

Entity Assembly IDEntity NameEntity ID
1entity_11
2water2

Entities:

Entity 1, entity_1 105 residues - 11744.722 Da.

Normal histidines are found at residues 26 and 33, while NE2 deprotonated histidine is present at residue 18 in order to coordinate the heme residue (HEC 105). Four waters (residues 200-203) are also present in the structure.

1   GLYASPVALGLULYSGLYLYSLYSILEPHE
2   VALGLNLYSCYSALAGLNCYSHSDTHRVAL
3   GLULYSGLYGLYLYSHISLYSTHRGLYPRO
4   ASNLEUHISGLYLEUPHEGLYARGLYSTHR
5   GLYGLNALAPROGLYPHETHRTYRTHRASP
6   ALAASNLYSASNLYSGLYILETHRTRPLYS
7   GLUGLUTHRLEUMETGLUTYRLEUGLUASN
8   PROLYSLYSTYRILEPROGLYTHRLYSMET
9   ILEPHEALAGLYILELYSLYSLYSTHRGLU
10   ARGGLUASPLEUILEALATYRLEULYSLYS
11   ALATHRASNGLUHEC

Entity 2, water - 18.015 Da.

1   HOH

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