Index | Ligand Name | Structure | PDB code | ligand desolvation |
1 | ak6 | Crystal structure of the mouse Aurora-A catalytic domain (Asn186->Gly, Lys240->Arg, Met302->Leu) in complex with Compound 823. | 3dj6 | 94.91 |
2 | ak5 | Crystal structure of the mouse Aurora-A catalytic domain (Asn186->Gly, Lys240->Arg, Met302->Leu) in complex with Compound 290. | 3dj5 | 94.37 |
3 | ak7 | Crystal structure of the mouse Aurora-A catalytic domain (Asn186->Gly, Lys240->Arg, Met302->Leu) in complex with Compound 130. | 3dj7 | 94.32 |
4 | ak1 | Crystal structure of mouse Aurora A (Asn186->Gly, Lys240->Arg, Met302->Leu) in complex with 1-{5-[2-(thieno[3,2-d]pyrimidin-4-ylamino)-ethyl]- thiazol-2-yl}-3-(3-trifluoromethyl-phenyl)-urea | 3d14 | 93.34 |
5 | cj5 | Aurora A in complex with CD532 | 4j8m | 93.29 |
6 | 0c4 | Aurora A in complex with RPM1722 | 3uoh | 93.23 |
7 | 0bz | Aurora A in Complex with RPM1679 | 3unz | 92.7 |
8 | ak3 | Crystal structure of mouse Aurora A (Asn186->Gly, Lys240->Arg, Met302->Leu) in complex with 1-{5-[2-(1-methyl-1H-pyrazolo[4,3-d]pyrimidin-7-ylamino)-ethyl]-thiazol-2-yl}-3-(3-trifluoromethyl-phenyl)-urea | 3d2i | 92.23 |
9 | ak2 | Crystal structure of mouse Aurora A (Asn186->Gly, Lys240->Arg, Met302->Leu) in complex with 1-(3-chloro-phenyl)-3-{5-[2-(thieno[3,2-d]pyrimidin-4-ylamino)- ethyl]-thiazol-2-yl}-urea [SNS-314] | 3d15 | 92.19 |
10 | 0c6 | Aurora A in complex with YL5-81-1 | 3uok | 90.81 |
11 | ak4 | Crystal structure of mouse Aurora A (Asn186->Gly, Lys240->Arg, Met302->Leu) in complex with [7-(2-{2-[3-(3-chloro-phenyl)-ureido]-thiazol-5-yl}-ethylamino)-pyrazolo[4,3-d]pyrimidin-1-yl]-acetic acid | 3d2k | 90.76 |
12 | f8z | Human AURKA bound to BRD-7880 | 6gra | 90.17 |
13 | 0c8 | Aurora A in complex with RPM1686 | 3up2 | 88.39 |
14 | 0by | Aurora A in complex with YL5-083 | 3uo6 | 87.92 |
15 | 4rj | Human Aurora A catalytic domain bound to FK1141 | 4ztr | 87.68 |
16 | zzl | Aurora-A Inhibitor Structure | 2wtv | 87.64 |
17 | adn | Crystal structures of human kinase Aurora A | 4o0s | 87.58 |
18 | 0c5 | Aurora A in complex with RPM1715 | 3uoj | 87.44 |
19 | g7w | Crystal Structure of Aurora-A L210C catalytic domain in complex with ASDO2 | 6hjk | 87.02 |
20 | 5vc | Crystal Structure of Aurora A Kinase Domain Bound to MK-5108 | 5ew9 | 86.68 |
21 | ak8 | Structure of AuroraA with pyridyl-pyrimidine urea inhibitor | 3efw | 86.26 |
22 | y3m | SAR156497 an exquisitely selective inhibitor of Aurora kinases | 4uyn | 85.97 |
23 | 0c0 | Aurora A in complex with RPM1680 | 3uo4 | 85.56 |
24 | n15 | Structure of Aurora kinase A complexed to benzoimidazole-indazole inhibitor XV | 3w2c | 85.3 |
25 | 0c3 | Aurora A in complex with RPM1693 | 3uod | 85.28 |
26 | 0c7 | Aurora A in complex with SO2-162 | 3uol | 85.15 |
27 | aki | Crystal Structure of Aurora A Kinase complexed with inhibitor | 3m11 | 85.1 |
28 | vek | Complex of Aurora-A bound to an Imidazopyridine-based inhibitor | 4b0g | 84.76 |
29 | 9qk | Aurora A kinase in complex with 2-(3-fluorophenyl)quinoline-4-carboxylic acid and ATP | 5obj | 84.5 |
30 | g7t | Crystal structure of Aurora-A L210C catalytic domain in complex with ASDO6 ligand | 6hjj | 84.44 |
31 | 4rm | Human Aurora A catalytic domain bound to FK932 | 4ztq | 84.33 |
32 | ske | Aurora A Kinase in Complex with JNJ-7706621 in Space Group P6122 | 5dt0 | 84.05 |
33 | lje | Crystal structure of benzamide 9 bound to AuroraA | 3o50 | 83.81 |
34 | 4rk | Human Aurora A catalytic domain bound to FK1142 | 4zts | 83.78 |
35 | 5dn | Aurora A Kinase in Complex with AA35 and JNJ-7706621 in Space Group P6122 | 5dpv | 82.61 |
36 | fh5 | Aurora A kinase bound to a highly selective imidazopyridine inhibitor | 4byj | 82.31 |
37 | vx6 | Crystal structure of Aurora A in complex with VX-680 and TPX2 | 3e5a | 82.04 |
38 | adn | CRYSTAL STRUCTURE OF AURORA-2, AN ONCOGENIC SERINE-THREONINE KINASE | 1muo | 81.99 |
39 | 0bx | Aurora A in complex with YL1-038-31 | 3uo5 | 81.98 |
40 | wph | Novel Aurora kinase inhibitors reveal mechanisms of HURP in nucleation of centrosomal and kinetochore microtubules | 4jbo | 81.98 |
41 | ske | Aurora A Kinase in Complex with AA29 and JNJ-7706621 in Space Group P6122 | 5dr9 | 81.74 |
42 | jve | SAR156497 an exquisitely selective inhibitor of Aurora kinases | 4uzh | 81.67 |
43 | ske | Aurora A Kinase in Complex with AA30 and JNJ-7706621 in Space Group P6122 | 5dr6 | 81.67 |
44 | ske | Aurora A Kinase in Complex with AA35 and JNJ-7706621 in Space Group P6122 | 5dpv | 81.5 |
45 | 5e1 | Aurora A Kinase in Complex with AA30 and JNJ-7706621 in Space Group P6122 | 5dr6 | 81.49 |
46 | 5e1 | Aurora A Kinase in Complex with AA30 and ATP in Space Group P6122 | 5dr2 | 81.43 |
47 | a4w | Crystal structure of Aurora-A kinase in complex with an allosterically binding fragment | 5orl | 81.16 |
48 | pfq | Identification, SAR Studies and X-ray Cocrystal Analysis of a Novel Furano-pyrimidine Aurora Kinase A Inhibitor | 3k5u | 80.92 |
49 | yph | Novel Aurora kinase inhibitors reveal mechanisms of HURP in nucleation of centrosomal and kinetochore microtubules | 4jbp | 80.38 |
50 | adn | Crystal structures of human kinase Aurora A | 4o0w | 79.94 |
51 | hpm | Aurora A kinase activated mutant (T287D) in complex with a 5- aminopyrimidinyl quinazoline inhibitor | 2c6e | 79.76 |
52 | l0f | Structure determination of Aurora Kinase in complex with inhibitor | 2w1f | 79.47 |
53 | adn | Crystal structures of human kinase Aurora A | 4o0u | 79.16 |
54 | 5dn | Aurora A Kinase in Complex with AA35 and ATP in Space Group P6122 | 5dos | 79.11 |
55 | 2vu | Aurora A kinase domain with compound 2 (N-[1-(3-cyanobenzyl)-1H-pyrazol-4-yl]-6-(1H-pyrazol-4-yl)-1H-indazole-3-carboxamide) | 4prj | 78.81 |
56 | vx6 | Novel Aurora kinase inhibitors reveal mechanisms of HURP in nucleation of centrosomal and kinetochore microtubules | 4jbq | 78.65 |
57 | a8h | Crystal structure of Aurora-A kinase in complex with an allosterically binding fragment | 5os4 | 78.49 |
58 | ofi | Crystal Structure of Aurora2 kinase in complex with a GSK3beta inhibitor | 3lau | 78.43 |
59 | eg7 | Aurora A ligand complex | 6c2r | 78.34 |
60 | l0e | Structure determination of Aurora Kinase in complex with inhibitor | 2w1e | 78.21 |
61 | x6d | Aurora-A bound to an inhibitor | 2x6d | 77.9 |
62 | ske | Aurora A kinase in complex with 2-(3-chloro-5-fluorophenyl)quinoline-4-carboxylic acid and JNJ-7706621 | 5obr | 77.65 |
63 | 0fy | Synthesis and SAR Studies of imidazo-[1,2-a]-pyrazine Aurora kinase inhibitors with improved off target kinase selectivity | 3vap | 77.55 |
64 | 97b | Aurora A inhibitor complex | 3h10 | 77.28 |
65 | d37 | Design, synthesis, and biological evaluation of pyrazolopyridine-sulfonamides as potent multiple-mitotic kinase (MMK) inhibitors (Part I) | 3r22 | 76.97 |
66 | 5dn | Aurora A Kinase in Complex with AA35 and ATP in Space Group P6122 | 5dt4 | 76.88 |
67 | nhi | Aurora A in complex with YL1-038-18 | 4dea | 76.77 |
68 | n13 | Structure of Aurora kinase A complexed to benzoimidazole-indazole inhibitor XIII | 3w18 | 76.38 |
69 | cc3 | Structural Basis for the Inhibition of Aurora A Kinase by a Novel Class of High Affinity Disubstituted Pyrimidine Inhibitors | 2np8 | 76.32 |
70 | p9j | Aurora A kinase domain with phthalazinone pyrazole inhibitor | 3p9j | 75.98 |
71 | fxg | Crystal structure of Aurora A complexed with an inhibitor discovered through site-directed dynamic tethering | 3daj | 75.66 |
72 | 400 | AURORA-A T288E COMPLEXED WITH PHA-828300 | 2xru | 75.58 |
73 | fh3 | Aurora A kinase bound to a highly selective imidazopyridine inhibitor | 4byi | 75.08 |
74 | zzl | STRUCTURE OF AURORA A IN COMPLEX WITH MLN8054 | 2x81 | 75.04 |
75 | eml | Aurora A Kinase complexed with SCH 1473759 | 3myg | 74.68 |
76 | nl4 | Aurora A kinase bound to an imidazopyridine inhibitor (14a) | 5aaf | 74.6 |
77 | d36 | Design, synthesis, and biological evaluation of pyrazolopyridine-sulfonamides as potent multiple-mitotic kinase (MMK) inhibitors (Part I) | 3r21 | 74.48 |
78 | 626 | Structure of Aurora-2 in complex with PHA-680626 | 2j4z | 74.31 |
79 | jrw | Aurora-A in complex with shape-diverse fragment 58 | 6r4d | 73.44 |
80 | p9j | Structure of Aurora kinase A complexed to pyrazole-aminoquinoline inhibitor III | 3w16 | 73.32 |
81 | a5w | Crystal structure of Aurora-A kinase in complex with an allosterically binding fragment | 5ors | 72.77 |
82 | 45b | Aurora A in complex with a bisanilinopyrimidine | 3h0z | 72 |
83 | 48b | Aurora A in complex with a bisanilinopyrimidine | 3h0y | 71.98 |
84 | mmh | Structure-based drug design of novel Aurora kinase A inhibitors: Structure basis for potency and specificity | 3fdn | 71.39 |
85 | 0k6 | Structure of Aurora A mutant bound to Biogenidec cpd 15 | 4dhf | 71.02 |
86 | 2jz | Crystal structure of aurora A in complex with TPX2 and compound 10 | 3ha6 | 70.21 |
87 | 627 | Structure of Aurora-2 in complex with PHA-739358 | 2j50 | 69.64 |
88 | 9yq | Crystal structure of Aurora-A in complex with FMF-03-145-1 (compound 2) | 5one | 69.44 |
89 | 35r | Structure of dephosphorylated Aurora A (122-403) in complex with inhibiting monobody and AT9283 in an inactive conformation | 6cpg | 68.67 |
90 | l0g | Structure determination of Aurora Kinase in complex with inhibitor | 2w1g | 68.29 |
91 | jsb | Aurora-A in complex with shape-diverse fragment 39 | 6r49 | 67.51 |
92 | egj | Aurora A ligand complex | 6c2t | 67.46 |
93 | 6f2 | Aurora A kinase bound to an imidazopyridine inhibitor (14b) | 5aag | 67.38 |
94 | 5dn | Aurora A in complex with ATP and AA35. | 5dn3 | 66.79 |
95 | 9a6 | Crystal Structure of Aurora-A in complex with a new Quinazoline inhibitor | 5zan | 66.66 |
96 | jsn | Aurora-A in complex with shape-diverse fragment 56 | 6r4b | 66.29 |
97 | a0h | Structure of Aurora-A bound to a selective imidazopyrazine inhibitor | 2xng | 65.49 |
98 | mpy | Aurora-2 T287D T288D complexed with PHA-680632 | 2bmc | 63.69 |
99 | a5h | Crystal structure of Aurora-A kinase in complex with an allosterically binding fragment | 5oro | 59.98 |
100 | a9e | Crystal structure of Aurora-A kinase in complex with an allosterically binding fragment | 5osf | 53.01 |