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Crystal structure of death associated protein kinase in complex with ADP and MG2+

Analyse Crystal structure of death associated protein kinase in complex with ADP and… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3F5G
Type
protein
Length
279 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Death-associated protein kinase 1
EC
2.7.11.1
UniProt
P53355
Ligands
ADP, MG
Pockets
2 · best druggability 0.71

Structure

x-ray diffraction · 1 distinct chain · 35% helix, 20% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADeath-associated protein kinase 1 (EC 2.7.11.1)protein27935% helix, 20% strandP53355

Ligands and binding sites

  • ADP · Adenosine-5'-diphosphate · ligand · chains A
  • MG · Magnesium ion · metal · 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
14930.710.8049ADP, MG
2670.320.7514empty

Compared structures

  • 3F5G · Crystal structure of death associated protein kinase in complex with ADP and Mg2+ · the same entry in another collection · chain A against A, TM-score 1.00
  • P53355 · AlphaFold monomer V2.0 prediction for death-associated protein kinase 1 (P53355) · a predicted model of the same protein · chain A against A, TM-score 0.95

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