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Crystal structure of the protein-kinase a catalytic subunit from criteculus griseus in complex with compound RKP120

Analyse Crystal structure of the protein-kinase a catalytic subunit from criteculus… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6ERU
Type
protein
Length
368 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Camp-dependent protein kinase catalytic subunit alpha; UPF0418 protein FAM164A
EC
2.7.11.11
UniProt
P25321, G3HK48
Pockets
3 · best druggability 0.74

Structure

x-ray diffraction · 2 distinct chains · 40% helix, 14% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACamp-dependent protein kinase catalytic subunit alpha (EC 2.7.11.11)protein35040% helix, 15% strandP25321
BUPF0418 protein FAM164Aprotein1839% helix, 0% strandG3HK48

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17450.740.8055empty
21470.550.8124empty
3850.350.7518empty

Interfaces

1 interface between chains.

  • A–B · 749 Ų buried · 17 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 4 modified (phosphorylation).

Compared structures

  • 6ERU · Crystal Structure of the Protein-Kinase A catalytic subunit from Criteculus Griseus in… · the same entry in another collection · chain A against A, TM-score 1.00

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