PROTEIN KINASE PIM-1 IN COMPLEX WITH SMALL MOLECULE INHIBITOR
PDB id Source Resolution
2XJ2 2.2 angstroms
Ligand Information
Ligand Validity Binding
Data		 Ligand
Warnings		 Eolus Viewer
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Viewer		 Molecular
Weight
(Da)		 Formula SMILES
985 Valid Kd =  66.0 nM   launch gocavviewer-lite   338.404
C19 H22 N4 O2
 C[N@]1CCCN(CC1)c2cncc(n2)c3cccc(c3)C=CC(=O)O

CRYSTALLOGRAPHIC FRAGMENT SCREEN IDENTIFIES CINNAMI DERIVATIVES AS STARTING POINTS FOR POTENT PIM-1 INH ACTA CRYSTALLOGR.,SECT.D V. 67 156 2011

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90% Homology Family

The Class containing this family consists of a total of 56 families.
Leader:    3BWF
CRYSTAL STRUCTURE OF THE HUMAN PIM1 IN COMPLEX
WITH AN OSMIUM COMPOUND
PDB id Binding data Representative ligand
3BWF ic50 = 0.6 nM DWC
1XR1   ANP
1XWS   BI1
1YHS ic50 = 0.01 uM STO
1YI3 ic50 = 4.0 uM LY2
1YI4   ADN
1YXU   AMP
1YXV   LI6
1YXX   LI7
2BIK   BI1
2C3I Kd = 25.0 nM IYZ
2J2I ic50 = 0.2 uM LY4
2O3P ic50 = 1.1 uM QUE
2O63 Kd = 0.78 uM MYC
2O64 Kd = 0.34 uM MYU
2OBJ ic50 = 0.05 uM VRV
2OI4 ic50 = 2.5 nM JM1
2XIX   XIX
2XIY   XIY
2XIZ   XIZ
2XJ1 Kd = 28.0 nM XJ1
2XJ2 Kd = 66.0 nM 985
3A99   ANP
3BGQ Ki = 11.0 nM VX2
3BGZ Ki = 0.55 uM VX3
3C4E ic50 ~ 100.0 uM C4E
3F2A ic50 = 57.0 nM 985
3MA3 ic50 = 60.0 nM 01I
3R00 ic50 = 8.5 uM UNJ
3R02 ic50 = 0.0010 uM UNM
3R04 ic50 = 0.12 uM UNQ