BMRB Entry 5895

Chem Shift validation: AVS_full, LACS
BMRB Entry DOI: doi:10.13018/BMR5895

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Title:
1H, 13C, and 15N resonance assignments for Zn2+ and Ca2+ bound S100B
Deposition date:
2003-08-01
Original release date:
2003-12-19
Authors:
Wilder, Paul; Baldisseri, Donna; Udan, Ryan; Vallely, Kristen; Weber, David
Citation:

Citation: Wilder, Paul; Baldisseri, Donna; Udan, Ryan; Vallely, Kristen; Weber, David. "Location of the Zn2+ binding site on S100B as determined by NMR spectroscopy and site-directed mutagenesis "  Biochemistry 42, 13410-13421 (2003).
PubMed: 14621986

Assembly members:

Assembly members:
S100B, polymer, 92 residues, 12000 Da.
CA, non-polymer, 40.078 Da.
ZN, non-polymer, 65.409 Da.

Natural source:

Natural source:   Common Name: Rat   Taxonomy ID: 10116   Superkingdom: Eukaryota   Kingdom: Metazoa   Genus/species: Rattus norvegicus

Experimental source:

Experimental source:   Production method: recombinant technology   Host organism: Escherichia coli   Vector: pET11b

Entity Sequences (FASTA):

Entity Sequences (FASTA):
S100B: MSELEKAMVALIDVFHQYSG REGDKHKLKKSELKELINNE LSHFLEEIKEQEVVDKVMET LDEDGDGECDFQEFMAFVSM VTTACHEFFEHE

Data sets:
Data typeCount
1H chemical shifts398
13C chemical shifts251
15N chemical shifts91

Additional metadata:

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

Entity Assembly IDEntity NameEntity ID
1S100B subunit 11
2S100B subunit 21
3CALCIUM (II) ION, 12
4CALCIUM (II) ION, 22
5CALCIUM (II) ION, 32
6CALCIUM (II) ION, 42
7ZINC (II) ION, 13
8ZINC (II) ION, 23

Entities:

Entity 1, S100B subunit 1 92 residues - 12000 Da.

1   METSERGLULEUGLULYSALAMETVALALA
2   LEUILEASPVALPHEHISGLNTYRSERGLY
3   ARGGLUGLYASPLYSHISLYSLEULYSLYS
4   SERGLULEULYSGLULEUILEASNASNGLU
5   LEUSERHISPHELEUGLUGLUILELYSGLU
6   GLNGLUVALVALASPLYSVALMETGLUTHR
7   LEUASPGLUASPGLYASPGLYGLUCYSASP
8   PHEGLNGLUPHEMETALAPHEVALSERMET
9   VALTHRTHRALACYSHISGLUPHEPHEGLU
10   HISGLU

Entity 2, CALCIUM (II) ION, 1 - Ca - 40.078 Da.

1   CA

Entity 3, ZINC (II) ION, 1 - Zn - 65.409 Da.

1   ZN

Related Database Links:

BMRB 15923 18995 4001 4105 5206
PDB 1B4C 1DT7 1MQ1 1MWN 1QLK 1SYM 1UWO 1XYD 2H61 2K7O 2M49 2PRU 3CZT 3D0Y 3D10 3HCM 4N6I
DBJ BAB43945 BAE22214 BAE22413 BAE36647 BAE88979
EMBL CAA25567 CAG46920
GB AAA03075 AAA42096 AAA60367 AAH01766 AAH61178
PRF 2003367B
REF NP_001076199 NP_001233735 NP_001247455 NP_001270589 NP_006263
SP P04271 P04631 P50114 Q6YNR6
AlphaFold P04271 P04631 P50114 Q6YNR6

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