Aurora kinase A
Kinase structure
Kinase:AURKA (AurA)
Family:Aur
Group:Other
Species:HUMAN
IUPHAR/BPS ID:1936
PDB:2WTV
sc-PDB:
KIDFamMap:Search
Release date:2010-01-26
PubMed: 20067443
Chain:A
(Alternate) Model:A
Orthosteric ligand:ZZL
2D structure of the orthosteric ligand
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The orthosteric binding pocket


More entries for 2WTV
2WTVAlternative model: AChain: B
2WTVAlternative model: AChain: C
2WTVAlternative model: AChain: D
2WTVAlternative model: BChain: A
2WTVAlternative model: BChain: B
2WTVAlternative model: BChain: C
2WTVAlternative model: BChain: D


Structural information
DFG conformation:out-like
αC-helix conformation:in
G-rich loop angle (distance):71.9° (20.2Å)
G-rich loop rotation:71.8°
Quality Score:7.6
Resolution:2.4 Å
Missing Residues:0
Missing Atoms:0
Ligand binding mode
PocketsSubpocketsWaters
front
Cluster
I5
Ligand
Yes
Protein
Yes

Pocket alignment
Uniprot sequence:RPLGKGKFGNVYLLALKVLQLRREVEIQSHLRPNILRLYGYYLILEYAPLGTVYRELQKYCHSKRVIHRDIKPENLLLIADFGWS
Sequence structure:RPLGKGKFGNVYLLALKVLQLRREVEIQSHLRPNILRLYGYYLILEYAPRGEVYKELQKYCHSKRVIHRDIKPENLLLIADFGWS

Ligand affinity
ChEMBL ID:CHEMBL259084
Bioaffinities: 189 records for 71 kinases
Species Kinase (ChEMBL naming) Median Min Max Type Records
Homo sapiens3-phosphoinositide dependent protein kinase-16.16.16.1pKi1
Homo sapiensCasein kinase II alpha4.74.74.7pIC501
Homo sapiensCasein kinase II alpha5.45.45.4pKi1
Homo sapiensDeath-associated protein kinase 2555pKd1
Homo sapiensDual specificity protein kinase CLK25.55.55.5pKd2
Homo sapiensDual specificity protein kinase CLK35.65.65.6pKd2
Homo sapiensDual specificity protein kinase CLK45.65.65.6pKi1
Homo sapiensEphrin type-A receptor 15.85.85.8pKd2
Homo sapiensEphrin type-A receptor 26.46.46.4pKd2
Homo sapiensEphrin type-A receptor 26.96.96.9pKi1
Homo sapiensEphrin type-A receptor 35.75.75.7pKd2
Homo sapiensEphrin type-A receptor 46.46.46.4pKd2
Homo sapiensEphrin type-A receptor 55.95.95.9pKd2
Homo sapiensEphrin type-A receptor 66.26.26.2pKd2
Homo sapiensEphrin type-A receptor 7666pKd2
Homo sapiensEphrin type-B receptor 16.56.56.5pKd2
Homo sapiensEphrin type-B receptor 35.55.55.5pKd2
Homo sapiensEphrin type-B receptor 46.36.36.3pKd2
Homo sapiensEpidermal growth factor receptor erbB15.25.25.5pKd4
Homo sapiensEpidermal growth factor receptor erbB16.36.36.3pKi1
Homo sapiensEpithelial discoidin domain-containing receptor 15.45.45.4pKd2
Homo sapiensFibroblast growth factor receptor 15.65.65.6pKd2
Homo sapiensFibroblast growth factor receptor 1666pKi1
Homo sapiensFibroblast growth factor receptor 25.85.85.8pKd2
Homo sapiensFibroblast growth factor receptor 35.95.95.9pKd4
Homo sapiensFibroblast growth factor receptor 36.36.36.3pKi1
Homo sapiensFocal adhesion kinase 15.55.55.5pKi1
Homo sapiensG protein-coupled receptor kinase 5666pKi1
Homo sapiensInterleukin-1 receptor-associated kinase 35.95.95.9pKd2
Homo sapiensMAP kinase-activated protein kinase 58.18.18.1pKd1
Homo sapiensMAP kinase signal-integrating kinase 27.97.97.9pIC501
Homo sapiensMaternal embryonic leucine zipper kinase666pKi1
Homo sapiensNon-receptor tyrosine-protein kinase TNK15.65.65.6pKd2
Homo sapiensNT-3 growth factor receptor5.65.65.6pKi1
Homo sapiensPlatelet-derived growth factor receptor alpha6.16.16.1pIC501
Homo sapiensProtein tyrosine kinase 2 beta5.75.75.7pKd2
Homo sapiensProto-oncogene tyrosine-protein kinase MER6.16.16.1pKd2
Homo sapiensProto-oncogene tyrosine-protein kinase ROS5.55.55.5pKd2
Homo sapiensProto-oncogene tyrosine-protein kinase ROS6.16.16.1pKi1
Homo sapiensRibosomal protein S6 kinase alpha 15.35.35.3pKd2
Homo sapiensSerine/threonine-protein kinase 105.45.45.4pKd2
Mus musculusSerine/threonine-protein kinase 126.86.86.8pIC503
Homo sapiensSerine/threonine-protein kinase 17A6.76.76.7pKd2
Homo sapiensSerine/threonine-protein kinase 17B8.18.18.1pKd2
Homo sapiensSerine/threonine-protein kinase Aurora-A7.56.59pIC5010
Homo sapiensSerine/threonine-protein kinase Aurora-A8.78.29.5pKd7
Mus musculusSerine/threonine-protein kinase Aurora-A8.47.58.4pIC504
Mus musculusSerine/threonine-protein kinase Aurora-A8.28.28.2pKi1
Homo sapiensSerine/threonine-protein kinase Aurora-B5.45.28pIC507
Homo sapiensSerine/threonine-protein kinase Aurora-B7.47.47.4pKd2
Homo sapiensSerine/threonine-protein kinase Aurora-C7.67.67.6pKd2
Homo sapiensSerine/threonine-protein kinase Chk24.64.64.6pIC501
Homo sapiensSerine/threonine-protein kinase Chk25.75.75.7pKi1
Homo sapiensSerine/threonine-protein kinase PAK 1555pKi1
Homo sapiensSerine/threonine-protein kinase PLK14.34.34.3pIC501
Homo sapiensSerine/threonine-protein kinase PLK35.25.25.2pKi1
Homo sapiensSerine/threonine-protein kinase PLK46.46.46.4pKd2
Homo sapiensSerine/threonine-protein kinase SIK15.85.85.8pKd2
Homo sapiensTyrosine-protein kinase ABL6.15.46.4pKd18
Homo sapiensTyrosine-protein kinase ABL6.86.86.8pKi1
Homo sapiensTyrosine-protein kinase ABL25.55.55.5pKd2
Homo sapiensTyrosine-protein kinase BLK7.27.27.2pKd3
Homo sapiensTyrosine-protein kinase BLK7.17.17.1pKi1
Homo sapiensTyrosine-protein kinase BMX5.55.55.5pKd2
Homo sapiensTyrosine-protein kinase BTK5.45.45.4pKd2
Homo sapiensTyrosine-protein kinase BTK5.65.65.6pKi1
Homo sapiensTyrosine-protein kinase CSK5.15.15.1pKd2
Homo sapiensTyrosine-protein kinase FER5.45.45.4pKd2
Homo sapiensTyrosine-protein kinase FGR6.76.76.7pKd2
Homo sapiensTyrosine-protein kinase FYN5.95.95.9pKd2
Homo sapiensTyrosine-protein kinase HCK5.85.85.8pKd2
Homo sapiensTyrosine-protein kinase HCK6.26.26.2pKi1
Homo sapiensTyrosine-protein kinase LCK5.55.55.5pIC501
Homo sapiensTyrosine-protein kinase LCK6.26.26.2pKd2
Homo sapiensTyrosine-protein kinase LCK5.75.75.7pKi1
Homo sapiensTyrosine-protein kinase Lyn5.95.95.9pKd2
Homo sapiensTyrosine-protein kinase Lyn6.66.66.6pKi1
Homo sapiensTyrosine-protein kinase receptor FLT3555pKd1
Homo sapiensTyrosine-protein kinase receptor Tie-15.85.85.8pKd2
Homo sapiensTyrosine-protein kinase receptor TYRO35.55.55.5pKd2
Homo sapiensTyrosine-protein kinase receptor TYRO36.96.96.9pKi1
Homo sapiensTyrosine-protein kinase receptor UFO6.46.46.4pKd2
Homo sapiensTyrosine-protein kinase SRC6.16.16.1pKd2
Homo sapiensTyrosine-protein kinase SRC5.85.85.8pKi1
Homo sapiensTyrosine-protein kinase TEC6.16.16.1pKd2
Homo sapiensTyrosine-protein kinase TIE-26.56.56.5pKd2
Homo sapiensTyrosine-protein kinase YES6.66.66.6pKd2
Homo sapiensVascular endothelial growth factor receptor 1666pKd2
Homo sapiensVascular endothelial growth factor receptor 26.16.16.1pKi1
Homo sapiensVascular endothelial growth factor receptor 35.55.55.5pKd2
Homo sapiensVascular endothelial growth factor receptor 36.36.36.3pKi1


Kinase-ligand interaction pattern
Hydrophobic Aromatic face-to-face Aromatic face-to-edge H-bond donor H-bond acceptor Ionic positive Ionic negative
I g.l II III αC
1 R
137
2 P
138
3 L
139
4 G
140
5 K
141
6 G
142
7 K
143
8 F
144
9 G
145
10 N
146
11 V
147
12 Y
148
13 L
149
14 L
159
15 A
160
16 L
161
17 K
162
18 V
163
19 L
164
20 Q
177
αC b.l IV
21 L
178
22 R
179
23 R
180
24 E
181
25 V
182
26 E
183
27 I
184
28 Q
185
29 S
186
30 H
187
31 L
188
32 R
189
33 P
191
34 N
192
35 I
193
36 L
194
37 R
195
38 L
196
39 Y
197
40 G
198
IV V GK hinge linker αD αE
41 Y
199
42 Y
207
43 L
208
44 I
209
45 L
210
46 E
211
47 Y
212
48 A
213
49 P
214
50 R
215
51 G
216
52 E
217
53 V
218
54 Y
219
55 K
220
56 E
221
57 L
222
58 Q
223
59 K
224
60 Y
246
αE VI c.l VII VIII x
61 C
247
62 H
248
63 S
249
64 K
250
65 R
251
66 V
252
67 I
253
68 H
254
69 R
255
70 D
256
71 I
257
72 K
258
73 P
259
74 E
260
75 N
261
76 L
262
77 L
263
78 L
264
79 I
272
80 A
273
DFG a.l
81 D
274
82 F
275
83 G
276
84 W
277
85 S
278

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