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Crystal structure of the nucleotide-free dynamin a GTPase domain, determined as myosin fusion

Analyse Crystal structure of the nucleotide-free dynamin a GTPase domain, determined as… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1JX2
Type
protein
Length
1,039 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Myosin-2 heavy CHAIN,DYNAMIN-a
UniProt
P08799, Q94464
Ligands
ADP, BGC, MG
Pockets
12 · best druggability 0.84

Structure

x-ray diffraction · 1 distinct chain · 45% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMyosin-2 heavy CHAIN,DYNAMIN-aprotein103945% helix, 16% strandP08799, Q94464

Ligands and binding sites

  • ADP · Adenosine-5'-diphosphate · ligand · chains A
  • BGC · beta-D-glucopyranose · sugar · chains A
  • MG · Magnesium ion · metal · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
19770.840.85111MG, ADP
28210.690.7557empty
31360.600.8527empty
41800.500.7722empty
5660.500.8421empty

Compared structures

  • 1JX2 · Crystal structure of the nucleotide-free dynamin a GTPase domain, determined as myosin… · 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 0.66
  • Q94464 · AlphaFold monomer V2.0 prediction for dynamin-a (Q94464) · a predicted model of the same protein · chain A against A, TM-score 0.27

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