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Myosin II dictyostelium discoideum motor domain S456E bound with mgadp-ALF4

Analyse Myosin II dictyostelium discoideum motor domain S456E bound with mgadp-ALF4 in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1W9L
Type
protein
Length
726 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Myosin II heavy chain
EC
3.6.4.1
UniProt
P08799
Ligands
ADP, ALF, MG
Pockets
8 · best druggability 0.78

Structure

x-ray diffraction · 1 distinct chain · 47% helix, 17% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMyosin II heavy chain (EC 3.6.4.1)protein72647% helix, 17% strandP08799

Ligands and binding sites

  • ADP · Adenosine-5'-diphosphate · ligand · chains A
  • ALF · Tetrafluoroaluminate ion · ligand · chains A
  • MG · Magnesium ion · metal · chains A
  • EDO · 1,2-ethanediol · additive · 6 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
19540.780.8084EDO
25110.680.7958MG, ADP, ALF
32720.580.7827empty
4770.450.8123empty
5590.350.7815empty

Compared structures

  • 1W9L · Myosin II Dictyostelium discoideum motor domain S456E bound with MgADP-AlF4 · the same entry in another collection · chain A against A, TM-score 1.00
  • P08799 · AlphaFold monomer V2.0 prediction for myosin-2 heavy chain (P08799) · a predicted model of the same protein · chain A against A, TM-score 0.97

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