Receptor
PDB id Resolution Class Description Source Keywords
1z5m 2.17 Å EC: 2.7.11.1 CRYSTAL STRUCTURE OF N1-[3-[[5-BROMO-2-[[3-[(1-PYRROLIDINYLC AMINO]PHENYL]AMINO]-4-PYRIMIDINYL]AMINO]PROPYL]-2,2- D IMETHYLPROPANEDIAMIDE COMPLEXED WITH HUMAN PDK1 HOMO SAPIENS PROTEIN INHIBITOR COMPLEX SERINE KINASE TRANSFERASE
Ref.: NOVEL SMALL MOLECULE INHIBITORS OF 3-PHOSPHOINOSITIDE-DEPENDENT KINASE-1. J.BIOL.CHEM. V. 280 19867 2005
Ligand Information
Ligand Validity Binding Data Ligand Warnings Chemaxon Viewer Molecular Weight (Da) Formula SMILES
LI8 Valid ic50 = 30 nM none 547.448
C23 H31 Br N8 O3
CC(C)(C(=O)N)C(=O)NCCCNc1c(cnc(n1)Nc2cccc(c2)NC(=O)N3CCCC3)Br
90% Homology Family

The Class containing this family consists of a total of 69 families.

Leader:    3RWP     DISCOVERY OF A NOVEL, POTENT AND SELECTIVE INHIBITOR OF 3- PHOSPHOINOSITIDE DEPENDENT KINASE (PDK1)
No: PDB id Binding Data Representative ligand
1 3QD3 ic50 = 1e-08 M 3Q5
2 2BIY - ATP
3 1UU9 ic50 = 3.8 uM BI3
4 1OKY ic50 = 6.5 nM STU
5 3IOP ic50 = 17 nM 8I1
6 2PE1 ic50 = 6 nM 517
7 3RWP Ki = 0.6 nM ABQ
8 3NAX - MP7
9 3QCQ ic50 = 1.58e-07 M 3Q0
10 4A06 - A06
11 2XCK ic50 = 713 nM MH4
12 3QD4 ic50 = 6.31e-09 M 3Q6
13 1Z5M ic50 = 30 nM LI8
14 3RCJ ic50 = 0.8 uM 3RC
15 2PE0 - 39Z
16 3QD0 ic50 = 3.16e-09 M 3Q4
17 3ORZ - BI4
18 3HRC - ATP
19 3ION ic50 = 8 nM 8H1
20 2XCH ic50 = 374 nM CKG
21 4AW0 - MJF
22 1UU7 ic50 = 14 uM BI2
23 3OTU - BI4
24 3HRF Kd = 10.3 uM P47
25 3QCS ic50 = 3.16e-07 M 3Q1
26 3QCX ic50 = 6.31e-08 M 3Q2
27 1UU3 ic50 = 0.75 uM LY4
28 1H1W - ATP
29 3QC4 ic50 = 0.002 uM MP7
30 4AW1 - ATP
31 3QCY ic50 = 2e-08 M 3Q3
32 1UU8 ic50 = 9 uM BI1
33 2PE2 - 464
34 3H9O ic50 = 70 nM 9BD
35 4A07 - ATP
More Information
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