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CKSHS1: human cyclin dependent kinase subunit, type 1 complex with metavanadate

Analyse CKSHS1: human cyclin dependent kinase subunit, type 1 complex with metavanadate in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1DKT
Type
protein
Length
143 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Cyclin dependent kinase subunit, type 1
UniProt
P61024
Ligands
V7O
Pockets
1 · best druggability 0.40

Structure

x-ray diffraction · 2 distinct chains · 17% helix, 32% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACyclin dependent kinase subunit, type 1protein7218% helix, 32% strandP61024
BCyclin dependent kinase subunit, type 1protein7115% helix, 32% strandP61024

Ligands and binding sites

  • V7O · Meta vanadate · ligand · chains A, B

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

Pockets

1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1870.400.7820V7O

Interfaces

1 interface between chains.

  • A–B · 474 Ų buried · 10 hydrogen bonds · protein-protein

Compared structures

  • 1DKT · CKSHS1: human cyclin dependent kinase subunit, type 1 complex with metavanadate · the same entry in another collection · chain A against A, TM-score 1.00
  • P61024 · AlphaFold monomer V2.0 prediction for cyclin-dependent kinases regulatory subunit 1… · a predicted model of the same protein · chain B against A, TM-score 0.95

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