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Crystal structure of bovine brain ca++ calmodulin in a compact form

Analyse Crystal structure of bovine brain ca++ calmodulin in a compact form in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1PRW
Type
protein
Length
148 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Calmodulin
UniProt
P62157
Ligands
ACE, CA
Pockets
2 · best druggability 0.86

Structure

x-ray diffraction · 1 distinct chain · 58% helix, 4% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACalmodulinprotein14858% helix, 4% strandP62157

Ligands and binding sites

  • ACE · Acetyl group · ligand · chains A
  • CA · Calcium ion · metal · 4 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13200.860.9534empty
21080.400.7618empty

Modifications

Observed in the structure: 1 covalent, 1 modified (covalent ligand, methylation).

Compared structures

  • 1PRW · Crystal structure of bovine brain Ca++ calmodulin in a compact form · the same entry in another collection · chain A against A, TM-score 1.00
  • P62157 · AlphaFold monomer V2.0 prediction for calmodulin (P62157) · a predicted model of the same protein · chain A against A, TM-score 0.46

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