DIFFERENTIAL BINDING OF INHIBITORS TO ACTIVE AND INACTIVE CDK2 PROVIDES INSIGHTS FOR DRUG DESIGN
PDB id Source Resolution
2C5O 2.1 angstroms
Ligand Information
Ligand Validity Binding
Data		 Ligand
Warnings		 Eolus Viewer
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Viewer		 Molecular
Weight
(Da)		 Formula SMILES
CK2 Valid ic50 =  6.5 uM More atoms than expected were found for ligand in PDB. % Diff = 2.0  launch gocavviewer-lite   206.267
C9 H10 N4 S
 Cc1c(sc(n1)C)c2ccnc(n2)N

DIFFERENTIAL BINDING OF INHIBITORS TO ACTIVE AND INACTIVE CDK2 PROVIDES INSIGHTS FOR DRUG DESIGN. CHEM.BIOL. V. 13 201 2006

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90% Homology Family

The Class containing this family consists of a total of 5 families.
Leader:    2BPM
STRUCTURE OF CDK2-CYCLIN A WITH PHA-630529
PDB id Binding data Representative ligand
2BPM ic50 = 2.0 nM 529
1E9H ic50 = 35.0 nM INR
1FIN   ATP
1H1P Ki = 12.0 uM CMG
1H1Q ic50 = 1.0 uM 2A6
1H1R ic50 = 2.3 uM 6CP
1H1S Ki = 6.0 nM 4SP
1H24 Kd = 0.5 uM PRO-VAL-LYS-ARG-ARG-LEU-ASP-LEU-GLU
1OI9 ic50 = 69.0 nM N20
1OIU ic50 = 0.21 uM N76
1OIY ic50 ~ 64.0 nM N41
1OKV ic50 = 0.68 uM ARG-ARG-LEU-ILE-PHE-NH2
1OKW ic50 = 5.6 uM ACE-ARG-ARG-LEU-ASN-FCL-NH2
1P5E   TBS
1PKD   UCN
1QMZ   HIS-HIS-ALA-SER-PRO-ARG-LYS
1VYW ic50 = 37.0 nM 292
2C5N ic50 = 0.22 uM CK8
2C5O ic50 = 6.5 uM CK2
2CJM   ATP
2G9X ic50 = 45.0 nM NU5
2IW6 ic50 = 0.14 uM QQ2
2IW8 ic50 = 103.0 nM 4SP
2IW9 ic50 = 8.9 nM 4SP
2UUE ic50 = 1.3 uM ARG-LEU-ILE-PFF-NH2-GVC
2UZE ic50 = 48.0 uM C95
2UZL ic50 = 0.61 uM C94
2WEV ic50 = 30.0 uM ACE-ARG-ARG-B3L-MEA-NH2
2WIH ic50 = 0.045 uM P48
3BHT ic50 = 0.011 uM MFR
3BHU ic50 = 0.0030 uM MHR
3BHV ic50 = 0.08 uM VAR
3DDQ ic50 ~ 28.0 uM RRC
3F5X ic50 = 1040.0 nM EZV
3MY5 ic50 = 65.0 uM RFZ
3QHR   ADP
3QHW   ADP