GL1X · GenesisL1 explorer

MolNFT v1 · #90951 · protein

CDK2 in complex with nsc 134199

4EZ3 · Cyclin-dependent kinase 2: “CDK2 in complex with nsc 134199”. X-ray diffraction, 1 ligand (0S0), 2 pockets (best druggability 0.75). MolNFT v1 #90951 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
4EZ3
Type
protein
Length
294 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Cyclin-dependent kinase 2
EC
2.7.11.22
UniProt
P24941
Ligands
0S0
Pockets
2 · best druggability 0.75

Structure

x-ray diffraction · 1 distinct chain · 34% helix, 15% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACyclin-dependent kinase 2 (EC 2.7.11.22)protein29434% helix, 15% strandP24941

Ligands and binding sites

  • 0S0 · 4-[(E)-(6-hydroxy-2-oxo-1,2-dihydropyridin-3-yl)diazenyl]benzenesulfonamide · ligand · chains A
  • EDO · 1,2-ethanediol · additive · 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, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15050.750.83580S0
21270.690.9032EDO

Compared structures

  • 4EZ3 · CDK2 in complex with NSC 134199 · the same entry in another collection · chain A against A, TM-score 1.00
  • P24941 · AlphaFold monomer V2.0 prediction for cyclin-dependent kinase 2 (P24941) · a predicted model of the same protein · chain A against A, TM-score 0.93

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