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MolNFT v1 · #156801 · protein

Mouse TALIN1 residues 1-138 fused to residues 169-400 in complex with phosphatidylinositol 4,5-bisphosphate (PIP2)

6MFS · Talin-1 fusion: “Mouse TALIN1 residues 1-138 fused to residues 169-400 in complex with phosphatidylinositol 4,5-bisphosphate…”. X-ray diffraction, 2 ligands (PIO, PO4), 3 pockets (best druggability 0.50). MolNFT v1 #156801 on…

PDB
6MFS
Type
protein
Length
370 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Talin-1 fusion
UniProt
P26039
Ligands
PIO, PO4
Pockets
3 · best druggability 0.50

Structure

x-ray diffraction · 1 distinct chain · 32% helix, 27% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ATalin-1 fusionprotein37032% helix, 27% strandP26039

Ligands and binding sites

  • PIO · [(2R)-2-octanoyloxy-3-[oxidanyl-[(1R,2R,3S,4R,5R,6S)-2, 3,6-tris(oxidanyl)-4,5-diphosphonooxy-cyclohexyl]oxy-phosphoryl]oxy-propyl] octanoate · ligand · chains A
  • PO4 · Phosphate ion · ion · 3 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12210.500.7530empty
2750.330.7519PO4
3630.320.7617empty

Compared structures

  • 6MFS · Mouse talin1 residues 1-138 fused to residues 169-400 in complex with… · the same entry in another collection · chain A against A, TM-score 1.00
  • P26039 · AlphaFold monomer V2.0 prediction for talin-1 (P26039) · a predicted model of the same protein · chain A against A, TM-score 0.52

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