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Full-length human camkii

Analyse Full-length human camkii in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3SOA
Type
protein
Length
436 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
CALCIUM/CALMODULIN-dependent protein kinase type II subunit alpha with a beta 7 linker
EC
2.7.11.17
UniProt
Q9UQM7
Ligands
DB8
Pockets
4 · best druggability 0.76

Structure

x-ray diffraction · 1 distinct chain · 36% helix, 27% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACALCIUM/CALMODULIN-dependent protein kinase type II subunit alpha with a beta 7 linker (EC 2.7.11.17)protein43636% helix, 27% strandQ9UQM7

Ligands and binding sites

  • DB8 · 4-[(2,4-dichloro-5-methoxyphenyl)amino]-6-methoxy-7-[3-(4-methylpiperazin-1-yl)propoxy]quinoline-3-carbonitrile · ligand · chains A

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

Pockets

4 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111820.760.7893DB8
25800.720.8045empty
3940.330.7321empty
4610.290.7416empty

Compared structures

  • 3SOA · Full-length human CaMKII · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9UQM7 · AlphaFold monomer V2.0 prediction for CALCIUM/CALMODULIN-dependent protein kinase type II… · a predicted model of the same protein · chain A against A, TM-score 0.97

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