BMRB Entry 16401

Chem Shift validation: AVS_anomalous, AVS_full, LACS
BMRB Entry DOI: doi:10.13018/BMR16401

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Title:
Separation of Inhibitor and Substrate Binding Locations in the Globin Dehaloperoxidase
Deposition date:
2009-07-09
Original release date:
2010-02-17
Authors:
Davis, Michael; Bobay, Benjamin; Franzen, Stefan
Citation:

Citation: Davis, Michael; Bobay, Benjamin; Franzen, Stefan. "Determination of separate inhibitor and substrate binding sites in the dehaloperoxidase-hemoglobin from Amphitrite ornata."  Biochemistry 49, 1199-1206 (2010).
PubMed: 20067301

Assembly members:

Assembly members:
DHPCN, polymer, 145 residues, Formula weight is not available
HEM, non-polymer, 616.487 Da.

Natural source:

Natural source:   Common Name: Segmented worm   Taxonomy ID: 129555   Superkingdom: Eukaryota   Kingdom: Metazoa   Genus/species: Amphitrite ornata

Experimental source:

Experimental source:   Production method: recombinant technology   Host organism: Amphitrite ornata   Vector: pET-16b

Entity Sequences (FASTA):

Entity Sequences (FASTA):
DHPCN: MGHHHHHHGFKQDIATIRGD LRTYAQDIFLAFLNKYPDER RYFKNYVGKSDQELKSMAKF GDHTEKVFNLMMEVADRATD CVPLASDANTLVQMKQHSSL TTGNFEKLFVALVEYMRASG QSFDSQSWDRFGKNLVSALS SAGMK

Data sets:
Data typeCount
13C chemical shifts388
15N chemical shifts128
1H chemical shifts128

Additional metadata:

  • Assembly
  • Samples and Experiments
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  • Spectrometers
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Assembly:

Entity Assembly IDEntity NameEntity ID
1DHPCN1
2Heme2

Entities:

Entity 1, DHPCN 145 residues - Formula weight is not available

1   METGLYHISHISHISHISHISHISGLYPHE
2   LYSGLNASPILEALATHRILEARGGLYASP
3   LEUARGTHRTYRALAGLNASPILEPHELEU
4   ALAPHELEUASNLYSTYRPROASPGLUARG
5   ARGTYRPHELYSASNTYRVALGLYLYSSER
6   ASPGLNGLULEULYSSERMETALALYSPHE
7   GLYASPHISTHRGLULYSVALPHEASNLEU
8   METMETGLUVALALAASPARGALATHRASP
9   CYSVALPROLEUALASERASPALAASNTHR
10   LEUVALGLNMETLYSGLNHISSERSERLEU
11   THRTHRGLYASNPHEGLULYSLEUPHEVAL
12   ALALEUVALGLUTYRMETARGALASERGLY
13   GLNSERPHEASPSERGLNSERTRPASPARG
14   PHEGLYLYSASNLEUVALSERALALEUSER
15   SERALAGLYMETLYS

Entity 2, Heme - C34 H32 Fe N4 O4 - 616.487 Da.

1   HEM

Related Database Links:

PDB 1EW6 1EWA 2QFK 2QFN 3DR9 3K3U 3KUN 3KUO 3LB1 3LB2 3LB3 3LB4 3MOU 3MYM 3MYN 3O7N 3OJ1 3OK5 3ORD 4DWT 4DWU 4FH6 4FH7 4GZG 4HSW 4HSX 4ILZ 4JAC 4JYQ 4KJT 4KMV 4KMW 4KN3
GB AAF97245

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SPARKY: Backbone or all simulated peaks