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Structure of full length CDK9 in complex with cyclint and drb

Analyse Structure of full length CDK9 in complex with cyclint and drb in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4EC8
Type
protein
Length
578 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Cyclin-dependent kinase 9; Cyclin-T1
EC
2.7.11.22, 2.7.11.23
UniProt
P50750, O60563
Pockets
8 · best druggability 0.77

Structure

x-ray diffraction · 2 distinct chains · 48% helix, 8% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACyclin-dependent kinase 9 (EC 2.7.11.22, 2.7.11.23)protein32635% helix, 14% strandP50750
BCyclin-T1protein25264% helix, 0% strandO60563

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12250.770.9128empty
22210.560.7930empty
31910.530.7824empty
4700.470.8321empty
5680.470.8316empty

Interfaces

1 interface between chains.

  • A–B · 887 Ų buried · 9 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 1 modified (phosphorylation).

Compared structures

  • 4EC8 · Structure of full length CDK9 in complex with cyclinT and DRB · the same entry in another collection · chain A against A, TM-score 1.00
  • O60563 · AlphaFold monomer V2.0 prediction for cyclin-T1 (O60563) · a predicted model of the same protein · chain B against A, TM-score 0.98
  • P50750 · AlphaFold monomer V2.0 prediction for cyclin-dependent kinase 9 (P50750) · a predicted model of the same protein · chain A against A, TM-score 0.98

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