Receptor
PDB id Resolution Class Description Source Keywords
1atp 2.2 Å EC: 2.7.11.11 2.2 ANGSTROM REFINED CRYSTAL STRUCTURE OF THE CATALYTIC SUBUNIT OF CAMP-DEPENDENT PROTEIN KINASE COMPLEXED WITH M NATP AND A PEPTIDE INHIBITOR MUS MUSCULUS TRANSFERASE(PHOSPHOTRANSFERASE)
Ref.: 2.2 A REFINED CRYSTAL STRUCTURE OF THE CATALYTIC SUBUNIT OF CAMP-DEPENDENT PROTEIN KINASE COMPLEXED WITH MNATP AND A PEPTIDE INHIBITOR. ACTA CRYSTALLOGR.,SECT.D V. 49 362 1993
Ligand Information
Ligand Validity Binding Data Ligand Warnings Chemaxon Viewer Molecular Weight (Da) Formula SMILES
ATP Valid Kd = 60 nM none 507.181
C10 H16 N5 O13 P3
c1nc(c2c(n1)n(cn2)[C@H]3[C@@H]([C@@H]([C@H](O3)CO[P@@](=O)(O)O[P@](=O)(O)OP(=O)(O)O)O)O)N
PO3 Invalid - none 78.972
O3 P
[O-][P-](=O)[O-]
MN Part of Protein - none 54.938
Mn
[Mn+2]
90% Homology Family

The Class containing this family consists of a total of 5 families.

Leader:    2GU8     DISCOVERY OF 2-PYRIMIDYL-5-AMIDOTHIOPHENES AS NOVEL AND POTENT INHIBITORS FOR AKT: SYNTHESIS AND SAR STUDIES
No: PDB id Binding Data Representative ligand
1 4AXA - RKD
2 2F7E ic50 = 1.3 nM 2EA
3 1XH8 ic50 = 1700 nM R55
4 3DNE - LL1
5 4DG0 - ANP
6 2UW5 ic50 = 34 nM GVN
7 2JDV - L20
8 2VNY - M02
9 3FJQ - ATP
10 2UZT ic50 = 14 nM SS3
11 1JBP - OCT
12 2VO6 - M05
13 1ATP Kd = 60 nM ATP
14 3OW3 ic50 = 742 nM SMY
15 1YDR Ki = 3 uM IQP
16 2C1A ic50 = 0.17 uM I5S
17 2UW0 - GVK
18 4DFX - ANP
19 3E8C - G96
20 1Q8U Kd = 1.1 uM H52
21 3L9L ic50 = 167 nM L9L
22 3MVJ ic50 = 3200 nM XFE
23 1YDT Ki = 48 nM IQB
24 3L9M - L9M
25 3AMB Ki = 0.66 uM VX6
26 3DND - LL2
27 2UW6 ic50 = 0.28 uM GVO
28 1XH7 Kd = 150 nM R96
29 2OJF ic50 = 15 nM 4PY
30 1XHA - R68
31 2GNF Ki = 6 uM Y27
32 2JDS ic50 = 27 nM L20
33 3E8E - G98
34 1SVG ic50 = 2 nM I04
35 2UW3 ic50 = 80 uM GVG
36 3L9N - L9N
37 2UZW Kd = 5 nM SS4
38 2GNJ Ki = 6 uM Y27
39 2VO0 - M03
40 2OH0 ic50 = 18 nM 2PY
41 2F7X ic50 = 14 nM 4EA
42 1L3R - ADP
43 2UVZ - GVJ
44 1XH5 Kd = 3400 nM R68
45 3NX8 - IPH
46 2JDT - I5S
47 2ERZ Ki = 2.2 uM HFS
48 2UW7 ic50 = 18 nM GVP
49 1Q8W Kd = 5.7 uM M77
50 1STC Ki = 8 nM STU
51 1XH6 Kd = 48 nM R94
52 2VNW - M01
53 1FMO Ki = 2.3 nM ADN
54 2UZV ic50 > 3 uM SS5
55 2UVX - GVH
56 2QUR - ADP
57 1RDQ - ATP
58 1Q8T Kd = 17.5 uM Y27
59 1XH9 Kd = 17 nM R69
60 2UW4 ic50 = 5.2 uM L15
61 2GNI Ki = 2280 nM M77
62 2GU8 ic50 = 0.1 nM 796
63 2UVY - GVI
64 1CDK - ANP
65 2VO3 - M04
66 2C1B ic50 = 0.4 uM CQP
67 2UW8 ic50 = 77 uM GVQ
68 3AMA Ki = 0.297 uM SKE
69 1SVH ic50 = 360 nM I08
70 2GNH Ki = 149 nM H52
71 1YDS Ki = 1.2 uM IQS
72 1SVE ic50 = 5 nM I01
73 1XH4 Kd = 34 nM R69
74 2VO7 ic50 = 15 nM M05
75 2UZU ic50 = 0.16 nM L20
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