BMRB

Biological Magnetic Resonance Data Bank


A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
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BMRB Entry 4868

Title: Sequential 1H assignments for BPTI-R52 (= BPTI with Met to Arg mutation at position 52)

Authors: van Mierlo, Carlo; Darby, Nigel; Neuhaus, David; Creighton, Thomas

Citation: van Mierlo, Carlo; Darby, Nigel; Neuhaus, David; Creighton, Thomas. "Two-dimensional 1H nuclear magnetic resonance study of the (5-55) single-disulphide folding intermediate of bovine pancreatic trypsin inhibitor"  J. Mol. Biol. 222, 373-390 (1991).

Assembly members:
BPTI-R52, polymer, 58 residues, Formula weight is not available

Natural source:   Common Name: cow   Taxonomy ID: 9913   Superkingdom: Eukaryota   Kingdom: Metazoa   Genus/species: Bos taurus

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

Entity Sequences (FASTA):
BPTI-R52: RPDFCLEPPYTGPCKARIIR YFYNAKAGLCQTFVYGGCRA KRNNFKSAEDCRRTCGGA

Data sets:
  • assigned_chemical_shifts
Data typeCount
1H chemical shifts393

Additional metadata:

  • Assembly
  • Samples and Experiments
  • Software
  • Spectrometers
  • Hide all

Assembly:

Entity Assembly IDEntity NameEntity ID
1BPTI-R521

Entities:

Entity 1, BPTI-R52 58 residues - Formula weight is not available

1   ARGPROASPPHECYSLEUGLUPROPROTYR
2   THRGLYPROCYSLYSALAARGILEILEARG
3   TYRPHETYRASNALALYSALAGLYLEUCYS
4   GLNTHRPHEVALTYRGLYGLYCYSARGALA
5   LYSARGASNASNPHELYSSERALAGLUASP
6   CYSARGARGTHRCYSGLYGLYALA

Samples:

sample_1: BPTI-R522 – 3 mM; H2O 90%; D2O 10%

sample_2: BPTI-R522 – 3 mM; D2O 100%

Ex-cond_1: pH: 4.6; temperature: 283 K

Experiments:

NameSampleSample stateSample conditions
DQ = Double Quantum Coherence experimentnot availablenot availableEx-cond_1

Software:

UXNMR - data acquisition, data processing

NMR spectrometers:

  • Bruker AM 500 MHz
  • Bruker AMX 500 MHz

Related Database Links:

BMRB 1039 1156 1179 236 237 262 263 264 338 411 412 413 414 415 416 419 45 46 48 485 49 4968 5307 5358 5359
PDB
EMBL CAA27062 CAA27063 CAA28371 CAA28886 CAA37967
GenBank AAB25189 AAD13685
PRF 1405218A 1405218D 681071A
SWISS-PROT P00974