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Motions of calmodulin-four-conformer refinement

Analyse Motions of calmodulin-four-conformer refinement in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1CM4
Type
protein
Length
161 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Calmodulin; Calmodulin-dependent protein kinase II-alpha
EC
2.7.1.123
UniProt
P02593, P11275
Ligands
CA
Pockets
1 · best druggability 0.63

Structure

x-ray diffraction · 2 distinct chains · 57% helix, 4% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACalmodulinprotein14353% helix, 4% strandP02593
BCalmodulin-dependent protein kinase II-alpha (EC 2.7.1.123)protein1883% helix, 0% strandP11275

Ligands and binding sites

  • CA · Calcium ion · metal · 17 copies · chains A

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

Pockets

1 pocket found on a 1 Å grid, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13470.630.7837empty

Interfaces

1 interface between chains.

  • A–B · 1324 Ų buried · 7 hydrogen bonds · protein-protein

Compared structures

  • 1CM4 · Motions of calmodulin-four-conformer refinement · the same entry in another collection · chain A against A, TM-score 1.00
  • P11275 · AlphaFold monomer V2.0 prediction for CALCIUM/CALMODULIN-dependent protein kinase type II… · a predicted model of the same protein · chain B against A, TM-score 0.68

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