Brand  (β version)

PDB ID: 1H01

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Ligands
Code Name Style Show Link
FAL (2r)-1-[4-({4-[(2,5-dichlorophenyl)amino]pyrimidin-2-yl}amino)phenoxy]-3-(dimethylamino)propan-2-ol PoSSuM
FBL (2s)-1-[4-({4-[(2,5-dichlorophenyl)amino]pyrimidin-2-yl}amino)phenoxy]-3-(dimethylamino)propan-2-ol PoSSuM
GOL Glycerol PoSSuM
Non-standard Residues
Code Name Show
KCX Lysine nz-carboxylic acid
Glycosylation
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Structure summary

Code : 1H01   PDBj   RCSB PDB   PDBe
Header : TRANSFERASE
Title : CDK2 in complex with a disubstituted 2, 4-bis anilino pyrimidine CDK4 inhibitor
Release Data : 2003-07-11
Compound :
mol_id molecule chains synonym
1 CYCLIN-DEPENDENT KINASE 2 A P33 PROTEIN KINASE, CELL DIVISION PROTEIN KINASE 2
ec: 2.7.11.22
Source :
mol_id organism_scientific organism_common expression_system
1 HOMO SAPIENS  (taxid:9606) HUMAN SPODOPTERA FRUGIPERDA  (taxid:7108)
expression_system_strain: SF9
expression_system_vector_type: BACULOVIRUS
Authors : Breault, G.A., Ellston, R.P.A., Green, S., James, S.R., Jewsbury, P.J., Midgley, C.J., Minshull, C.A., Pauptit, R.A., Tucker, J.A., Pease, J.E.
Keywords : SERINE/THREONINE-PROTEIN KINASE, MITOSIS, TRANSFERASE
Exp. method : X-RAY DIFFRACTION ( 1.79 Å )
Citation :

Cyclin-Dependent Kinase 4 Inhibitors as a Treatment for Cancer. Part 1: Identification and Optimisation of Substituted 4,6-Bis Anilino Pyrimidines

Beattie, J.F.,Breault, G.A.,Ellston, R.P.A.  et al.
(2003)  Bioorg.Med.Chem.Lett.  13 : 2955

PubMed: 12941311
DOI: 10.1016/S0960-894X(03)00202-6

High-Resolution Crystal Structures of Human Cyclin-Dependent Kinase 2 with and without ATP: Bound Waters and Natural Ligand as a Guide for Inhibitor Design

Schulze-Gahmen, U.,De Bondt, H.,Kim, S.-H.
(1996)  J.Med.Chem.  39 : 4540

PubMed: 8917641
DOI: 10.1021/JM960402A

Reaction

Chain : A
UniProt : P24941 (CDK2_HUMAN)
Reaction: EC: Evidence:
Physiological Direction:
L-seryl-[protein] + ATP = O-phospho-L-seryl-[protein] + ADP + H(+) 2.7.11.22 PubMed:1396589, PubMed:24670654, PubMed:28216226, PubMed:28666995, PubMed:9030781
-
L-threonyl-[protein] + ATP = O-phospho-L-threonyl-[protein] + ADP + H(+) 2.7.11.22 PubMed:1396589, PubMed:24670654, PubMed:28666995, PubMed:9030781
-
Cofactor: Evidence: Note:
Mg(2+) ECO:0000269 | PubMed:21565702
Binds 2 Mg(2+) ions.