Reaction Details
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Cyclin-A2/Cyclin-dependent kinase 1
Ligand
BDBM50521926
Substrate
n/a
Meas. Tech.
ChEMBL_1885553 (CHEMBL4387135)
Ki
770±n/a nM
Citation
Bronner, SM; Merrick, KA; Murray, J; Salphati, L; Moffat, JG; Pang, J; Sneeringer, CJ; Dompe, N; Cyr, P; Purkey, H; Boenig, GL; Li, J; Kolesnikov, A; Larouche-Gauthier, R; Lai, KW; Shen, X; Aubert-Nicol, S; Chen, YC; Cheong, J; Crawford, JJ; Hafner, M; Haghshenas, P; Jakalian, A; Leclerc, JP; Lim, NK; O'Brien, T; Plise, EG; Shalan, H; Sturino, C; Wai, J; Xiao, Y; Yin, J; Zhao, L; Gould, S; Olivero, A; Heffron, TP Design of a brain-penetrant CDK4/6 inhibitor for glioblastoma. Bioorg Med Chem Lett 29:2294-2301 (2019) [PubMed] Article More Info.:
Target
Name:
Cyclin-A2/Cyclin-dependent kinase 1
Synonyms:
CDK1/Cyclin A | Cyclin-Dependent Kinase 1 (CDK1)
Type:
Protein Complex
Mol. Mass.:
n/a
Description:
CDK1 was expressed in a baculovirus expression system and was partially purified. Cyclin A was purified separately and mixed with CDK1 before assays.
Components:
This complex has 2 components.
Component 1
Name:
Cyclin-dependent kinase 1
Synonyms:
CDC2 | CDC28A | CDK1 | CDK1_HUMAN | CDKN1 | Cell division control protein 2 homolog | Cell division protein kinase 1 | Cyclin-dependent kinase 1 (CDK1) | P34CDC2 | p34 protein kinase
Type:
Enzyme Subunit
Mol. Mass.:
34101.08
Organism:
Human
Description:
P06493
Residue:
297
Sequence:
MEDYTKIEKIGEGTYGVVYKGRHKTTGQVVAMKKIRLESEEEGVPSTAIREISLLKELRHPNIVSLQDVLMQDSRLYLIFEFLSMDLKKYLDSIPPGQYMDSSLVKSYLYQILQGIVFCHSRRVLHRDLKPQNLLIDDKGTIKLADFGLARAFGIPIRVYTHEVVTLWYRSPEVLLGSARYSTPVDIWSIGTIFAELATKKPLFHGDSEIDQLFRIFRALGTPNNEVWPEVESLQDYKNTFPKWKPGSLASHVKNLDENGLDLLSKMLIYDPAKRISGKMALNHPYFNDLDNQIKKM
Component 2
Name:
Cyclin-A2
Synonyms:
CCN1 | CCNA | CCNA1 | CCNA2 | CCNA2_HUMAN | Cyclin A | Cyclin-A
Type:
Enzyme Subunit
Mol. Mass.:
48550.19
Organism:
Human
Description:
P20248
Residue:
432
Sequence:
MLGNSAPGPATREAGSALLALQQTALQEDQENINPEKAAPVQQPRTRAALAVLKSGNPRGLAQQQRPKTRRVAPLKDLPVNDEHVTVPPWKANSKQPAFTIHVDEAEKEAQKKPAESQKIEREDALAFNSAISLPGPRKPLVPLDYPMDGSFESPHTMDMSIILEDEKPVSVNEVPDYHEDIHTYLREMEVKCKPKVGYMKKQPDITNSMRAILVDWLVEVGEEYKLQNETLHLAVNYIDRFLSSMSVLRGKLQLVGTAAMLLASKFEEIYPPEVAEFVYITDDTYTKKQVLRMEHLVLKVLTFDLAAPTVNQFLTQYFLHQQPANCKVESLAMFLGELSLIDADPYLKYLPSVIAGAAFHLALYTVTGQSWPESLIRKTGYTLESLKPCLMDLHQTYLKAPQHAQQSIREKYKNSKYHGVSLLNPPETLNL
Inhibitor
Name:
BDBM50521926
Synonyms:
CHEMBL4561999
Type:
Small organic molecule
Emp. Form.:
C22H27FN8
Mol. Mass.:
422.5018
SMILES:
C[C@@H]1CCCn2ncc(c12)-c1nc(Nc2ccc(cn2)N2CCN(C)CC2)ncc1F |r|
Structure:
