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MolNFT v1 · #51262 · protein

Myosin VI (md) pre-powerstroke state (MG.ADP.VO4)

2V26: “Myosin VI (md) pre-powerstroke state (MG.ADP.VO4)”. X-ray diffraction, 4 ligands (ADP, MG, SO4), 6 pockets (best druggability 0.77). MolNFT v1 #51262 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
2V26
Type
protein
Length
747 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Myosin VI
UniProt
Q29122
Ligands
ADP, MG, SO4, VO4
Pockets
6 · best druggability 0.77

Structure

x-ray diffraction · 1 distinct chain · 48% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMyosin VIprotein74748% helix, 16% strandQ29122

Ligands and binding sites

  • ADP · Adenosine-5'-diphosphate · ligand · chains A
  • MG · Magnesium ion · metal · chains A
  • SO4 · Sulfate ion · ion · 2 copies · chains A
  • VO4 · Vanadate ion · ion · chains A
  • EDO · 1,2-ethanediol · additive · 7 copies · chains A

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

Pockets

6 pockets found on a 1 Å grid, 4 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18500.770.8087EDO
24800.740.8357ADP, VO4, MG
34170.700.8150empty
42330.660.8349EDO
5890.400.7718empty

Compared structures

  • 2V26 · Myosin VI (MD) pre-powerstroke state (Mg.ADP.VO4) · the same entry in another collection · chain A against A, TM-score 1.00
  • Q29122 · AlphaFold monomer V2.0 prediction for unconventional myosin-VI (Q29122) · a predicted model of the same protein · chain A against A, TM-score 0.94

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