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Crystal structure of the N-terminal region of alphaii-spectrin tetramerization domain

Analyse Crystal structure of the N-terminal region of alphaii-spectrin tetramerization… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3F31
Type
protein
Length
277 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Spectrin alpha chain, brain
UniProt
Q13813
Pockets
6 · best druggability 0.72

Structure

x-ray diffraction · 2 distinct chains · 81% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ASpectrin alpha chain, brainprotein13782% helix, 0% strandQ13813
BSpectrin alpha chain, brainprotein14081% helix, 0% strandQ13813

Pockets

6 pockets found on a 1 Å grid, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12860.720.8633empty
2530.460.8517empty
31020.460.7920empty
41240.440.7624empty
5960.420.7814empty

Interfaces

1 interface between chains.

  • A–B · 1623 Ų buried · 7 hydrogen bonds · protein-protein

Compared structures

  • 3F31 · Crystal Structure of the N-terminal region of AlphaII-spectrin Tetramerization Domain · the same entry in another collection · chain A against A, TM-score 1.00
  • Q13813 · AlphaFold monomer V2.0 prediction for spectrin alpha chain, non- erythrocytic 1 (Q13813) · a predicted model of the same protein · chain A against A, TM-score 0.83

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