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Aip tpr domain in complex with human TOMM20 peptide

Analyse Aip tpr domain in complex with human TOMM20 peptide in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4APO
Type
protein
Length
308 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ah receptor-interacting protein; Mitochondrial import receptor subunit TOM20 homolog
UniProt
O00170, Q15388
Ligands
SO4
Pockets
3 · best druggability 0.58

Structure

x-ray diffraction · 3 distinct chains · 82% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AAh receptor-interacting proteinprotein14282% helix, 0% strandO00170
BAh receptor-interacting proteinprotein15484% helix, 0% strandO00170
D, EMitochondrial import receptor subunit TOM20 homologprotein60% helix, 0% strandQ15388

Ligands and binding sites

  • SO4 · Sulfate ion · ion · chains B
  • 12P · Dodecaethylene glycol · additive · chains A, B

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13320.580.763812P
2940.350.7420empty
3520.310.7614empty

Interfaces

3 interfaces between chains.

  • A–B · 503 Ų buried · 12 hydrogen bonds · protein-protein
  • B–D · 499 Ų buried · 11 hydrogen bonds · protein-protein
  • A–E · 478 Ų buried · 10 hydrogen bonds · protein-protein

Compared structures

  • 4APO · AIP TPR domain in complex with human Tomm20 peptide · the same entry in another collection · chain A against A, TM-score 1.00
  • O00170 · AlphaFold monomer V2.0 prediction for ah receptor-interacting protein (O00170) · a predicted model of the same protein · chain A against A, TM-score 0.98
  • Q15388 · AlphaFold monomer V2.0 prediction for mitochondrial import receptor subunit TOM20 homolog… · a predicted model of the same protein · chain D against A, TM-score 0.67

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