BMRB Entry 4865

Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR4865

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Title:
Backbone 1H, 13C, 15N Chemical shift Assignment for OMTKY3 bound to bovine Chymotrypsin Aa
Deposition date:
2000-10-17
Original release date:
2001-06-01
Authors:
Song, Jikui; Markley, John
Citation:

Citation: Song, Jikui; Markley, John. "NMR Chemical shift mapping of the binding site of a protein proteinase inhibitor: changes in the 1H, 13C and 15N NMR chemical shifts of turkey ovomucoid third domain upon binding to bovine chymotrypsin Aa"  J. Mol. Recognit. 14, 166-171 (2001).

Assembly members:

Assembly members:
Ovomucoid Third Domain from Turkey, polymer, 56 residues, Formula weight is not available
bovine chymotrypsin Aa, polymer, 241 residues, Formula weight is not available

Natural source:

Natural source:   Common Name: Turkey   Taxonomy ID: 9103   Superkingdom: Eukaryota   Kingdom: Metazoa   Genus/species: Meleagris Gallopavo

Experimental source:

Experimental source:   Production method: recombinant technology

Entity Sequences (FASTA):

Entity Sequences (FASTA):
Ovomucoid Third Domain from Turkey: LAAVSVDCSEYPKPACTLEY RPLCGSDNKTYGNKCNFCNA VVESNGTLTLSHFGKC
bovine chymotrypsin Aa: CGVPAIQPVLSGLIVNGEEA VPGSWPWQVSLQDKTGFHFC GGSLINENWVVTAAHCGVTT SDVVVAGEFDQGSSSEKIQK LKIAKVFKNSKYNSLTINND ITLLKLSTAASFSQTVSAVC LPSASDDFAAGTTCVTTGWG LTRYANTPDRLQQASLPLLS NTNCKKYWGTKIKDAMICAG ASGVSSCMGDSGGPLVCKKN GAWTLVGIVSWGSSTCSTST PGVYARVTALVNWVQQTLAA N

Data sets:
Data typeCount
1H chemical shifts45
13C chemical shifts85
15N chemical shifts46

Additional metadata:

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

Entity Assembly IDEntity NameEntity ID
1OMTKY31
2bovine chymotrypsin Aa2

Entities:

Entity 1, OMTKY3 56 residues - Formula weight is not available

1   LEUALAALAVALSERVALASPCYSSERGLU
2   TYRPROLYSPROALACYSTHRLEUGLUTYR
3   ARGPROLEUCYSGLYSERASPASNLYSTHR
4   TYRGLYASNLYSCYSASNPHECYSASNALA
5   VALVALGLUSERASNGLYTHRLEUTHRLEU
6   SERHISPHEGLYLYSCYS

Entity 2, bovine chymotrypsin Aa 241 residues - Formula weight is not available

1   CYSGLYVALPROALAILEGLNPROVALLEU
2   SERGLYLEUILEVALASNGLYGLUGLUALA
3   VALPROGLYSERTRPPROTRPGLNVALSER
4   LEUGLNASPLYSTHRGLYPHEHISPHECYS
5   GLYGLYSERLEUILEASNGLUASNTRPVAL
6   VALTHRALAALAHISCYSGLYVALTHRTHR
7   SERASPVALVALVALALAGLYGLUPHEASP
8   GLNGLYSERSERSERGLULYSILEGLNLYS
9   LEULYSILEALALYSVALPHELYSASNSER
10   LYSTYRASNSERLEUTHRILEASNASNASP
11   ILETHRLEULEULYSLEUSERTHRALAALA
12   SERPHESERGLNTHRVALSERALAVALCYS
13   LEUPROSERALASERASPASPPHEALAALA
14   GLYTHRTHRCYSVALTHRTHRGLYTRPGLY
15   LEUTHRARGTYRALAASNTHRPROASPARG
16   LEUGLNGLNALASERLEUPROLEULEUSER
17   ASNTHRASNCYSLYSLYSTYRTRPGLYTHR
18   LYSILELYSASPALAMETILECYSALAGLY
19   ALASERGLYVALSERSERCYSMETGLYASP
20   SERGLYGLYPROLEUVALCYSLYSLYSASN
21   GLYALATRPTHRLEUVALGLYILEVALSER
22   TRPGLYSERSERTHRCYSSERTHRSERTHR
23   PROGLYVALTYRALAARGVALTHRALALEU
24   VALASNTRPVALGLNGLNTHRLEUALAALA
25   ASN

Related Database Links:

BMRB 6881 960 961 962 963 964 965 966 967 967 965 963 961 6881
PDB 1AB9 1ACB 1AFQ 1CA0 1CBW 1CGI 1CGJ 1CHG 1CHO 1DLK 1EX3 1GCD 1GCT 1GG6 1GGD 1GHA 1GHB 1GL0 1GL1 1GMC 1GMD 1GMH 1HJA 1K2I 1MTN 1N8O 1OXG 1P2M 1P2N 1P2O 1P2Q 1T7C 1T8L 1T8M 1T8N 1T8O 1VGC 1YPH 2CGA 2CHA 2GCH 2GCT 2GMT 2P8O 2VGC 2Y6T 3BG4 3GCH 3GCT 3RU4 3T62 3VGC 4CHA 4GCH 4Q2K 4VGC 5CHA 5GCH 6CHA 6GCH 7GCH 8GCH
REF XP_003583409 XP_003587247 XP_608091
SP P00766
SWISS-PROT P00766
AlphaFold P00766

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