11GY image
Deposition Date 2026-02-23
Release Date 2026-07-08
Last Version Date 2026-07-08
Entry Detail
PDB ID:
11GY
Keywords:
SIGNALING PROTEIN
Title:
Crystal structure of selective inhibitor 16 bound at the active site of CDK1
Biological Source:
Source Organism(s):
Homo sapiens (Taxon ID: 9606)
Expression System(s):
Escherichia coli
Method Details:
Experimental Method:
X-RAY DIFFRACTION
Resolution:
2.40 Å
R-Value Free:
0.23
R-Value Work:
0.18
R-Value Observed:
0.18
Space Group:
P 43 21 2
11GY validation report missing
Macromolecular Entities
Structures with similar UniProt ID
Protein Blast
Polymer Type:polypeptide(L)
Molecule:Cyclin-dependent kinase 1
Gene (Uniprot):CDK1
Chain IDs:A
Chain Length:316
Number of Molecules:1
Biological Source:Homo sapiens
UniProt ID:P06493 Pfam ID:PF00069 EC:2.7.11.22
Structures with similar UniProt ID
Protein Blast
Polymer Type:polypeptide(L)
Molecule:G2/mitotic-specific cyclin-B1
Gene (Uniprot):CCNB1
Chain IDs:B
Chain Length:273
Number of Molecules:1
Biological Source:Homo sapiens
UniProt ID:P14635 Pfam ID:PF00134, PF02984
Structures with similar UniProt ID
Protein Blast
Polymer Type:polypeptide(L)
Molecule:Cyclin-dependent kinases regu
Gene (Uniprot):CKS2
Chain IDs:C
Chain Length:80
Number of Molecules:1
Biological Source:Homo sapiens
UniProt ID:P33552 Pfam ID:PF01111
Modified Residue
Compound ID Chain ID Parent Comp ID Details 2D Image
TPO A THR modified residue
Ligand Molecules
A1DEQ
A1DJL
DMS
EPE
GOL
SO4
Primary Citation
Utilizing Molecular Dynamics and Mechanistic Pharmacokinetic Studies in the Design of Selective CDK2 Inhibitors.
J.Med.Chem. ? ? ? (2026)
PMID: 42328801 DOI: 10.1021/acs.jmedchem.5c03803
Primary Citation of related structures
11GY
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