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MolNFT v1 · #121993 · protein

Structural analysis of a talin triple domain module, E1794Y, E1797Y, Q1801Y mutant

5IC1 · Talin-1: “Structural analysis of a talin triple domain module, E1794Y, E1797Y, Q1801Y mutant”. X-ray diffraction, 3 pockets (best druggability 0.72). MolNFT v1 #121993 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5IC1
Type
protein
Length
464 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Talin-1
UniProt
P26039
Pockets
3 · best druggability 0.72

Structure

x-ray diffraction · 1 distinct chain · 81% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ATalin-1protein46481% helix, 0% strandP26039

Ligands and binding sites

  • EDO · 1,2-ethanediol · additive · 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, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17030.720.7973EDO
2730.400.7915empty
3800.310.7318empty

Compared structures

  • 5IC1 · Structural analysis of a talin triple domain module, E1794Y, E1797Y, Q1801Y mutant · 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 0.54

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