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MolNFT v1 · #44325 · protein

Solution structure of the axh domain of ataxin-1 in complex with ligand peptide from capicua

2M41 · Protein capicua homolog: “Solution structure of the axh domain of ataxin-1 in complex with ligand peptide from capicua”. Solution nmr, 1 pocket (best druggability 0.29). MolNFT v1 #44325 on GenesisL1: 3D structure, binding sites and…

PDB
2M41
Type
protein
Length
138 residues
Chains
2
Method
solution nmr
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Protein capicua homolog; Ataxin-1
UniProt
Q96RK0, P54253
Pockets
1 · best druggability 0.29

Structure

solution nmr · 2 distinct chains · 15% helix, 35% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AProtein capicua homologprotein150% helix, 13% strandQ96RK0
BAtaxin-1protein12317% helix, 37% strandP54253

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1540.290.7513empty

Interfaces

1 interface between chains.

  • A–B · 1066 Ų buried · 7 hydrogen bonds · protein-protein

Compared structures

  • 2M41 · Solution Structure of the AXH domain of Ataxin-1 in complex with ligand peptide from… · the same entry in another collection · chain A against A, TM-score 1.00
  • P54253 · AlphaFold monomer V2.0 prediction for ataxin-1 (P54253) · a predicted model of the same protein · chain B against A, TM-score 0.79
  • Q96RK0 · AlphaFold monomer V2.0 prediction for protein capicua homolog (Q96RK0) · a predicted model of the same protein · chain A against A, TM-score 0.17

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