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Solution structure of a beta-neurotoxin from the new world scorpion centruroides sculpturatus ewing

Analyse Solution structure of a beta-neurotoxin from the new world scorpion… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1B3C
Type
protein
Length
64 residues
Chains
1
Method
solution nmr
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Protein (neurotoxin cse-I)
UniProt
P01491
Pockets
1 · best druggability 0.47

Structure

solution nmr · 1 distinct chain · 11% helix, 20% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AProtein (neurotoxin cse-I)protein6411% helix, 20% strandP01491

Pockets

1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1860.470.8122empty

Modifications

Observed in the structure: 4 disulfide (disulfide).

Compared structures

  • 1B3C · Solution structure of a beta-neurotoxin from the new world scorpion centruroides… · the same entry in another collection · chain A against A, TM-score 1.00
  • P01491 · AlphaFold monomer V2.0 prediction for beta-toxin csei (P01491) · a predicted model of the same protein · chain A against A, TM-score 0.80

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