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MolNFT v1 · #14567 · protein

High resolution solution NMR structure of mixed disulfide intermediate between mutant human thioredoxin and a 13 residue peptide comprising its target site in human nfkb

1MDI: “High resolution solution NMR structure of mixed disulfide intermediate between mutant human thioredoxin and a…”. Solution nmr. MolNFT v1 #14567 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
1MDI
Type
protein
Length
118 residues
Chains
2
Method
solution nmr
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Thioredoxin; Target site in human nfkb
UniProt
P10599, P19838

Structure

solution nmr · 2 distinct chains · 34% helix, 25% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AThioredoxinprotein10538% helix, 27% strandP10599
BTarget site in human nfkbprotein130% helix, 8% strandP19838

Interfaces

1 interface between chains.

  • A–B · 694 Ų buried · 12 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 1MDI · High resolution solution NMR structure of mixed disulfide intermediate between mutant… · the same entry in another collection · chain A against A, TM-score 1.00
  • P10599 · AlphaFold monomer V2.0 prediction for thioredoxin (P10599) · a predicted model of the same protein · chain A against A, TM-score 0.93
  • P19838 · AlphaFold monomer V2.0 prediction for nuclear factor nf-kappa-B P105 subunit (P19838) · a predicted model of the same protein · chain B against A, TM-score 0.26

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