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Crystal structure of whirlin PDZ3 in complex with myosin 15A C- terminal PDZ binding motif peptide

Analyse Crystal structure of whirlin PDZ3 in complex with myosin 15A C- terminal PDZ… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6Y38
Type
protein
Length
209 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Whirlin; Chains: C,D
UniProt
Q80VW5
Pockets
1 · best druggability 0.36

Structure

x-ray diffraction · 3 distinct chains · 18% helix, 33% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AWhirlinprotein9119% helix, 33% strandQ80VW5
BWhirlinprotein9220% helix, 33% strandQ80VW5
C, DChains: C,Dprotein130% helix, 31% strand—

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1950.360.7517empty

Interfaces

5 interfaces between chains.

  • A–C · 667 Ų buried · 16 hydrogen bonds · protein-protein
  • B–D · 653 Ų buried · 16 hydrogen bonds · protein-protein
  • A–B · 439 Ų buried · 5 hydrogen bonds · protein-protein
  • A–D · 306 Ų buried · 6 hydrogen bonds · protein-protein
  • B–C · 290 Ų buried · 2 hydrogen bonds · protein-protein

Compared structures

  • 6Y38 · Crystal structure of Whirlin PDZ3 in complex with Myosin 15a C-terminal PDZ binding motif… · the same entry in another collection · chain A against A, TM-score 1.00
  • Q80VW5 · AlphaFold monomer V2.0 prediction for whirlin (Q80VW5) · a predicted model of the same protein · chain B against A, TM-score 0.97

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