Kinase insert domain receptor
Kinase structure
Kinase:KDR
Family:VEGFR
Group:TK
Species:HUMAN
IUPHAR/BPS ID:1813
PDB:3EFL
sc-PDB:
KIDFamMap:Search
Release date:2009-09-15
Chain:A
Orthosteric ligand:706
2D structure of the orthosteric ligand
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The orthosteric binding pocket


More entries for 3EFL
3EFLChain: B


Structural information
DFG conformation:out
αC-helix conformation:in
G-rich loop angle (distance):59.9° (18.5Å)
G-rich loop rotation:48.9°
Quality Score:6.4
Resolution:2.2 Å
Missing Residues:4
Missing Atoms:0
Ligand binding mode
PocketsSubpocketsWaters
front
gate
back
BP-I-B
BP-II-out
Cluster
I1
I7
Ligand
No
No
Protein
Yes
Yes

Pocket alignment
Uniprot sequence:KPLGRGAFGQVIEVAVKMLALMSELKILIHIGLNVVNLLGAMVIVEFCKFGNLSTYLRSFLASRKCIHRDLAARNILLICDFGLA
Sequence structure:KPLGRG__GQVIEVAVKMLALMSELKILIHIGLNVVNLLGAMVIVEFCKFGNLSTYLRSFLASRKCIHRDLAARNILLICDFG__

Ligand affinity
ChEMBL ID:CHEMBL572881
Bioaffinities: 129 records for 42 kinases
Species Kinase (ChEMBL naming) Median Min Max Type Records
Homo sapiensCitron Rho-interacting kinase6.56.56.5pKd2
Homo sapiensEphrin type-A receptor 66.36.36.3pKd2
Homo sapiensEpidermal growth factor receptor erbB15.65.27.8pKd16
Homo sapiensEpithelial discoidin domain-containing receptor 16.66.66.6pKd2
Homo sapiensEukaryotic translation initiation factor 2-alpha kinase 45.45.45.4pKd2
Homo sapiensFibroblast growth factor receptor 15.25.25.2pKd2
Homo sapiensFibroblast growth factor receptor 45.25.25.2pKd2
Homo sapiensMacrophage colony stimulating factor receptor8.38.38.3pKd2
Homo sapiensMitogen-activated protein kinase kinase kinase 25.25.25.2pKd1
Homo sapiensMitogen-activated protein kinase kinase kinase 35.75.75.7pKd1
Homo sapiensMitogen-activated protein kinase kinase kinase 75.95.95.9pKd1
Homo sapiensMitogen-activated protein kinase kinase kinase kinase 45.25.25.2pKd1
Homo sapiensMixed lineage kinase 78.18.18.1pKd2
Homo sapiensPlatelet-derived growth factor receptor alpha888pKd2
Homo sapiensPlatelet-derived growth factor receptor beta888pKd2
Homo sapiensSerine/threonine-protein kinase 10666pKd2
Homo sapiensSerine/threonine-protein kinase 25.95.95.9pKd2
Homo sapiensSerine/threonine-protein kinase 355.35.35.3pKd1
Homo sapiensSerine/threonine-protein kinase Aurora-C5.75.75.7pKd2
Homo sapiensSerine/threonine-protein kinase B-raf6.26.26.6pKd4
Homo sapiensSerine/threonine-protein kinase RAF6.16.16.1pKd2
Homo sapiensSerine/threonine-protein kinase RIPK2555pKd1
Homo sapiensSerine/threonine-protein kinase TNNI3K6.76.76.7pKd2
Homo sapiensSPS1/STE20-related protein kinase YSK46.76.76.7pKd1
Homo sapiensStem cell growth factor receptor7.96.48.9pKd15
Homo sapiensTyrosine-protein kinase ABL5.45.16.2pKd9
Homo sapiensTyrosine-protein kinase ABL25.45.45.4pKd1
Homo sapiensTyrosine-protein kinase BLK5.75.75.7pKd2
Homo sapiensTyrosine-protein kinase BRK666pKd2
Homo sapiensTyrosine-protein kinase FGR5.25.25.2pKd2
Homo sapiensTyrosine-protein kinase FRK777pKd2
Homo sapiensTyrosine-protein kinase FYN5.65.65.6pKd2
Homo sapiensTyrosine-protein kinase HCK5.15.15.1pKd1
Homo sapiensTyrosine-protein kinase JAK15.35.35.3pKd2
Homo sapiensTyrosine-protein kinase LCK6.46.46.4pKd2
Homo sapiensTyrosine-protein kinase Lyn6.86.86.8pKd2
Homo sapiensTyrosine-protein kinase receptor FLT3657.3pKd11
Homo sapiensTyrosine-protein kinase receptor RET7.17.17.2pIC502
Homo sapiensTyrosine-protein kinase receptor RET7.77.77.9pKd4
Homo sapiensTyrosine-protein kinase YES5.35.35.3pKd1
Homo sapiensVascular endothelial growth factor receptor 18.78.78.7pIC502
Homo sapiensVascular endothelial growth factor receptor 17.97.97.9pKd2
Homo sapiensVascular endothelial growth factor receptor 28.58.58.5pIC503
Homo sapiensVascular endothelial growth factor receptor 27.67.67.6pKd2
Homo sapiensVascular endothelial growth factor receptor 38.28.28.2pIC501
Homo sapiensVascular endothelial growth factor receptor 3888pKd2


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 K
838
2 P
839
3 L
840
4 G
841
5 R
842
6 G
843
7 _
_
8 _
_
9 G
846
10 Q
847
11 V
848
12 I
849
13 E
850
14 V
865
15 A
866
16 V
867
17 K
868
18 M
869
19 L
870
20 A
881
αC b.l IV
21 L
882
22 M
883
23 S
884
24 E
885
25 L
886
26 K
887
27 I
888
28 L
889
29 I
890
30 H
891
31 I
892
32 G
893
33 L
896
34 N
897
35 V
898
36 V
899
37 N
900
38 L
901
39 L
902
40 G
903
IV V GK hinge linker αD αE
41 A
904
42 M
913
43 V
914
44 I
915
45 V
916
46 E
917
47 F
918
48 C
919
49 K
920
50 F
921
51 G
922
52 N
923
53 L
924
54 S
925
55 T
926
56 Y
927
57 L
928
58 R
929
59 S
930
60 F
1018
αE VI c.l VII VIII x
61 L
1019
62 A
1020
63 S
1021
64 R
1022
65 K
1023
66 C
1024
67 I
1025
68 H
1026
69 R
1027
70 D
1028
71 L
1029
72 A
1030
73 A
1031
74 R
1032
75 N
1033
76 I
1034
77 L
1035
78 L
1036
79 I
1044
80 C
1045
DFG a.l
81 D
1046
82 F
1047
83 G
1048
84 _
_
85 _
_

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