SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'BI9'


List of Similar Pattern of Amino Acids


Hit pattern: 3D amino acid arrangements similar to known drug binding site

Query pattern: Residues from known binding site for annotated drug that match the hit pattern


(Click on the DrReposER ID to view details on interfaces and similar patterns of amino acids)
(Click on the view link on the last column to view superposed patterns of amino acids)
Filter list by:
DrReposER ID / Desc. Hit
PDBID
Hit
Macromolecule
Res.
Matches
Interface HETATM RMSD Dali
Z-score
Seq.
Identity (%)
View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1T46_A_STIA3_1
(HOMO SAPIENS V-KIT
HARDY-ZUCKERMAN 4
FELINE SARCOMA VIRAL
ONCOGENE HOMOLOG)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
8 / 12 ALA A 192
LYS A 194
GLU A 236
LEU A 240
VAL A 249
GLY A 273
LEU A 319
ASP A 330
BI9  A 501 (-3.3A)
NH4  A 506 ( 4.4A)
NH4  A 506 (-3.0A)
None
None
BI9  A 501 (-3.3A)
BI9  A 501 (-4.7A)
None
1.01A 1t46A-6bqlA:
21.8
1t46A-6bqlA:
11.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1T46_A_STIA3_1
(HOMO SAPIENS V-KIT
HARDY-ZUCKERMAN 4
FELINE SARCOMA VIRAL
ONCOGENE HOMOLOG)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
8 / 12 VAL A 179
ALA A 192
LYS A 194
GLU A 236
VAL A 249
GLY A 273
LEU A 319
ASP A 330
BI9  A 501 ( 4.8A)
BI9  A 501 (-3.3A)
NH4  A 506 ( 4.4A)
NH4  A 506 (-3.0A)
None
BI9  A 501 (-3.3A)
BI9  A 501 (-4.7A)
None
1.07A 1t46A-6bqlA:
21.8
1t46A-6bqlA:
11.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1XBB_A_STIA1_1
(TYROSINE-PROTEIN
KINASE SYK)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
5 / 9 VAL A 179
ALA A 192
GLY A 273
PRO A 274
LEU A 319
BI9  A 501 ( 4.8A)
BI9  A 501 (-3.3A)
BI9  A 501 (-3.3A)
None
BI9  A 501 (-4.7A)
0.36A 1xbbA-6bqlA:
25.7
1xbbA-6bqlA:
14.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2EUF_B_LQQB401_1
(CELL DIVISION
PROTEIN KINASE 6)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
7 / 12 ILE A 171
VAL A 179
LYS A 194
VAL A 249
PHE A 267
VAL A 270
LEU A 319
BI9  A 501 (-4.0A)
BI9  A 501 ( 4.8A)
NH4  A 506 ( 4.4A)
None
BI9  A 501 ( 4.2A)
BI9  A 501 (-4.0A)
BI9  A 501 (-4.7A)
0.87A 2eufB-6bqlA:
27.1
2eufB-6bqlA:
13.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2EUF_B_LQQB401_1
(CELL DIVISION
PROTEIN KINASE 6)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
8 / 12 VAL A 179
LYS A 194
VAL A 249
PHE A 267
VAL A 270
ASN A 317
LEU A 319
ALA A 329
BI9  A 501 ( 4.8A)
NH4  A 506 ( 4.4A)
None
BI9  A 501 ( 4.2A)
BI9  A 501 (-4.0A)
BI9  A 501 (-4.5A)
BI9  A 501 (-4.7A)
NH4  A 506 ( 3.7A)
0.93A 2eufB-6bqlA:
27.1
2eufB-6bqlA:
13.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2EUF_B_LQQB401_1
(CELL DIVISION
PROTEIN KINASE 6)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
7 / 12 VAL A 249
PHE A 267
VAL A 270
ASN A 317
LEU A 319
ALA A 329
ASP A 330
None
BI9  A 501 ( 4.2A)
BI9  A 501 (-4.0A)
BI9  A 501 (-4.5A)
BI9  A 501 (-4.7A)
NH4  A 506 ( 3.7A)
None
0.84A 2eufB-6bqlA:
27.1
2eufB-6bqlA:
13.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Y7J_A_B49A1294_1
(PHOSPHORYLASE B
KINASE GAMMA
CATALYTIC CHAIN,
TESTIS/LIVER ISOFORM)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
7 / 12 ILE A 171
VAL A 179
ALA A 192
PHE A 267
LEU A 269
GLY A 273
LEU A 319
BI9  A 501 (-4.0A)
BI9  A 501 ( 4.8A)
BI9  A 501 (-3.3A)
BI9  A 501 ( 4.2A)
BI9  A 501 (-4.4A)
BI9  A 501 (-3.3A)
BI9  A 501 (-4.7A)
0.43A 2y7jA-6bqlA:
31.7
2y7jA-6bqlA:
12.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Y7J_B_B49B1294_1
(PHOSPHORYLASE B
KINASE GAMMA
CATALYTIC CHAIN,
TESTIS/LIVER ISOFORM)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
7 / 10 ILE A 171
VAL A 179
ALA A 192
PHE A 267
LEU A 269
GLY A 273
LEU A 319
BI9  A 501 (-4.0A)
BI9  A 501 ( 4.8A)
BI9  A 501 (-3.3A)
BI9  A 501 ( 4.2A)
BI9  A 501 (-4.4A)
BI9  A 501 (-3.3A)
BI9  A 501 (-4.7A)
0.39A 2y7jB-6bqlA:
31.7
2y7jB-6bqlA:
12.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Y7J_C_B49C1294_1
(PHOSPHORYLASE B
KINASE GAMMA
CATALYTIC CHAIN,
TESTIS/LIVER ISOFORM)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
7 / 10 ILE A 171
VAL A 179
ALA A 192
PHE A 267
LEU A 269
GLY A 273
LEU A 319
BI9  A 501 (-4.0A)
BI9  A 501 ( 4.8A)
BI9  A 501 (-3.3A)
BI9  A 501 ( 4.2A)
BI9  A 501 (-4.4A)
BI9  A 501 (-3.3A)
BI9  A 501 (-4.7A)
0.41A 2y7jC-6bqlA:
31.7
2y7jC-6bqlA:
12.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Y7J_D_B49D1294_1
(PHOSPHORYLASE B
KINASE GAMMA
CATALYTIC CHAIN,
TESTIS/LIVER ISOFORM)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
7 / 10 ILE A 171
VAL A 179
ALA A 192
PHE A 267
LEU A 269
GLY A 273
LEU A 319
BI9  A 501 (-4.0A)
BI9  A 501 ( 4.8A)
BI9  A 501 (-3.3A)
BI9  A 501 ( 4.2A)
BI9  A 501 (-4.4A)
BI9  A 501 (-3.3A)
BI9  A 501 (-4.7A)
0.41A 2y7jD-6bqlA:
31.6
2y7jD-6bqlA:
12.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOX_A_EMHA901_1
(ALK TYROSINE KINASE
RECEPTOR)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
6 / 10 ALA A 192
LYS A 194
VAL A 249
LEU A 269
GLY A 273
LEU A 319
BI9  A 501 (-3.3A)
NH4  A 506 ( 4.4A)
None
BI9  A 501 (-4.4A)
BI9  A 501 (-3.3A)
BI9  A 501 (-4.7A)
0.48A 3aoxA-6bqlA:
22.3
3aoxA-6bqlA:
13.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3BBT_B_FMMB91_1
(RECEPTOR
TYROSINE-PROTEIN
KINASE ERBB-4)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
6 / 12 VAL A 179
ALA A 192
LEU A 251
LEU A 269
GLY A 273
LEU A 319
BI9  A 501 ( 4.8A)
BI9  A 501 (-3.3A)
None
BI9  A 501 (-4.4A)
BI9  A 501 (-3.3A)
BI9  A 501 (-4.7A)
0.55A 3bbtB-6bqlA:
20.9
3bbtB-6bqlA:
12.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3GCS_A_BAXA401_2
(MITOGEN-ACTIVATED
PROTEIN KINASE 14)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
4 / 6 VAL A 248
LEU A 269
ILE A 308
ILE A 328
None
BI9  A 501 (-4.4A)
None
None
0.82A 3gcsA-6bqlA:
21.2
3gcsA-6bqlA:
12.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3GVU_A_STIA1001_1
(TYROSINE-PROTEIN
KINASE ABL2)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
7 / 12 VAL A 179
ALA A 192
ILE A 239
VAL A 249
LEU A 319
ALA A 329
ASP A 330
BI9  A 501 ( 4.8A)
BI9  A 501 (-3.3A)
None
None
BI9  A 501 (-4.7A)
NH4  A 506 ( 3.7A)
None
0.96A 3gvuA-6bqlA:
22.1
3gvuA-6bqlA:
15.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IK3_A_0LIA1_1
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE ABL1)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
6 / 12 ALA A 192
VAL A 249
HIS A 310
LEU A 319
ALA A 329
ASP A 330
BI9  A 501 (-3.3A)
None
None
BI9  A 501 (-4.7A)
NH4  A 506 ( 3.7A)
None
0.86A 3ik3A-6bqlA:
21.8
3ik3A-6bqlA:
16.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IK3_B_0LIB2_1
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE ABL1)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
5 / 12 ALA A 192
VAL A 249
HIS A 310
LEU A 319
ALA A 329
BI9  A 501 (-3.3A)
None
None
BI9  A 501 (-4.7A)
NH4  A 506 ( 3.7A)
0.53A 3ik3B-6bqlA:
21.6
3ik3B-6bqlA:
16.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3MIY_A_B49A1_1
(TYROSINE-PROTEIN
KINASE ITK/TSK)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
7 / 11 ILE A 171
ALA A 192
LYS A 194
VAL A 249
PHE A 267
GLY A 273
LEU A 319
BI9  A 501 (-4.0A)
BI9  A 501 (-3.3A)
NH4  A 506 ( 4.4A)
None
BI9  A 501 ( 4.2A)
BI9  A 501 (-3.3A)
BI9  A 501 (-4.7A)
0.59A 3miyA-6bqlA:
23.0
3miyA-6bqlA:
14.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3MIY_B_B49B2_1
(TYROSINE-PROTEIN
KINASE ITK/TSK)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
6 / 9 ILE A 171
ALA A 192
LYS A 194
PHE A 267
GLY A 273
LEU A 319
BI9  A 501 (-4.0A)
BI9  A 501 (-3.3A)
NH4  A 506 ( 4.4A)
BI9  A 501 ( 4.2A)
BI9  A 501 (-3.3A)
BI9  A 501 (-4.7A)
0.58A 3miyB-6bqlA:
23.1
3miyB-6bqlA:
14.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3OXZ_A_0LIA1_1
(TYROSINE-PROTEIN
KINASE ABL1)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
6 / 12 ALA A 192
VAL A 249
GLY A 273
HIS A 310
ALA A 329
ASP A 330
BI9  A 501 (-3.3A)
None
BI9  A 501 (-3.3A)
None
NH4  A 506 ( 3.7A)
None
0.88A 3oxzA-6bqlA:
21.7
3oxzA-6bqlA:
16.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3PYY_B_STIB4_1
(V-ABL ABELSON MURINE
LEUKEMIA VIRAL
ONCOGENE HOMOLOG 1
ISOFORM B VARIANT)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
6 / 12 VAL A 179
ALA A 192
VAL A 249
LEU A 319
ALA A 329
ASP A 330
BI9  A 501 ( 4.8A)
BI9  A 501 (-3.3A)
None
BI9  A 501 (-4.7A)
NH4  A 506 ( 3.7A)
None
0.63A 3pyyB-6bqlA:
21.7
3pyyB-6bqlA:
15.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3RGF_A_BAXA465_1
(CYCLIN-DEPENDENT
KINASE 8)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
7 / 12 VAL A 179
ALA A 192
LEU A 240
PHE A 267
LEU A 303
HIS A 310
ALA A 329
BI9  A 501 ( 4.8A)
BI9  A 501 (-3.3A)
None
BI9  A 501 ( 4.2A)
None
None
NH4  A 506 ( 3.7A)
0.84A 3rgfA-6bqlA:
5.7
3rgfA-6bqlA:
10.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3TI1_A_B49A299_1
(CYCLIN-DEPENDENT
KINASE 2)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
5 / 9 ILE A 171
ALA A 192
VAL A 249
PHE A 267
LEU A 319
BI9  A 501 (-4.0A)
BI9  A 501 (-3.3A)
None
BI9  A 501 ( 4.2A)
BI9  A 501 (-4.7A)
0.69A 3ti1A-6bqlA:
22.4
3ti1A-6bqlA:
12.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3WZE_A_BAXA1201_2
(VASCULAR ENDOTHELIAL
GROWTH FACTOR
RECEPTOR 2)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
5 / 8 VAL A 248
VAL A 249
LEU A 319
ILE A 328
ASP A 330
None
None
BI9  A 501 (-4.7A)
None
None
0.61A 3wzeA-6bqlA:
22.1
3wzeA-6bqlA:
13.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ANQ_A_VGHA9000_1
(ALK TYROSINE KINASE
RECEPTOR)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
6 / 9 VAL A 179
ALA A 192
GLY A 273
LEU A 319
ALA A 329
ASP A 330
BI9  A 501 ( 4.8A)
BI9  A 501 (-3.3A)
BI9  A 501 (-3.3A)
BI9  A 501 (-4.7A)
NH4  A 506 ( 3.7A)
None
0.70A 4anqA-6bqlA:
22.8
4anqA-6bqlA:
12.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ANS_A_VGHA9000_1
(ALK TYROSINE KINASE
RECEPTOR)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
6 / 9 VAL A 179
ALA A 192
GLY A 273
LEU A 319
ALA A 329
ASP A 330
BI9  A 501 ( 4.8A)
BI9  A 501 (-3.3A)
BI9  A 501 (-3.3A)
BI9  A 501 (-4.7A)
NH4  A 506 ( 3.7A)
None
0.68A 4ansA-6bqlA:
22.7
4ansA-6bqlA:
12.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4BKJ_B_STIB1000_1
(EPITHELIAL DISCOIDIN
DOMAIN-CONTAINING
RECEPTOR 1)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
6 / 12 VAL A 179
ALA A 192
MET A 265
LEU A 319
ALA A 329
ASP A 330
BI9  A 501 ( 4.8A)
BI9  A 501 (-3.3A)
None
BI9  A 501 (-4.7A)
NH4  A 506 ( 3.7A)
None
0.88A 4bkjB-6bqlA:
21.4
4bkjB-6bqlA:
14.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4C8B_A_0LIA1000_1
(RECEPTOR-INTERACTING
SERINE/THREONINE-PRO
TEIN KINASE 2)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
7 / 12 ALA A 192
LYS A 194
LEU A 240
HIS A 310
LEU A 319
ALA A 329
ASP A 330
BI9  A 501 (-3.3A)
NH4  A 506 ( 4.4A)
None
None
BI9  A 501 (-4.7A)
NH4  A 506 ( 3.7A)
None
0.85A 4c8bA-6bqlA:
22.9
4c8bA-6bqlA:
14.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4C8B_B_0LIB1000_1
(RECEPTOR-INTERACTING
SERINE/THREONINE-PRO
TEIN KINASE 2)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
7 / 12 ALA A 192
LYS A 194
LEU A 240
HIS A 310
LEU A 319
ALA A 329
ASP A 330
BI9  A 501 (-3.3A)
NH4  A 506 ( 4.4A)
None
None
BI9  A 501 (-4.7A)
NH4  A 506 ( 3.7A)
None
0.89A 4c8bB-6bqlA:
22.7
4c8bB-6bqlA:
14.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KS8_A_B49A701_1
(SERINE/THREONINE-PRO
TEIN KINASE PAK 6)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
5 / 10 ILE A 171
ALA A 192
VAL A 249
GLY A 273
LEU A 319
BI9  A 501 (-4.0A)
BI9  A 501 (-3.3A)
None
BI9  A 501 (-3.3A)
BI9  A 501 (-4.7A)
0.42A 4ks8A-6bqlA:
29.7
4ks8A-6bqlA:
15.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4MXY_B_DB8B601_1
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE SRC)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
7 / 12 VAL A 179
ALA A 192
GLU A 236
VAL A 249
GLY A 273
LEU A 319
ALA A 329
BI9  A 501 ( 4.8A)
BI9  A 501 (-3.3A)
NH4  A 506 (-3.0A)
None
BI9  A 501 (-3.3A)
BI9  A 501 (-4.7A)
NH4  A 506 ( 3.7A)
0.64A 4mxyB-6bqlA:
24.5
4mxyB-6bqlA:
15.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4MXZ_B_DB8B601_1
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE SRC)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
7 / 12 VAL A 179
ALA A 192
GLU A 236
VAL A 249
GLY A 273
LEU A 319
ALA A 329
BI9  A 501 ( 4.8A)
BI9  A 501 (-3.3A)
NH4  A 506 (-3.0A)
None
BI9  A 501 (-3.3A)
BI9  A 501 (-4.7A)
NH4  A 506 ( 3.7A)
0.64A 4mxzB-6bqlA:
24.5
4mxzB-6bqlA:
15.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4OR0_A_NPSA602_1
(SERUM ALBUMIN)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
5 / 9 PHE A 267
ALA A 192
ALA A 182
LEU A 162
VAL A 252
BI9  A 501 ( 4.2A)
BI9  A 501 (-3.3A)
None
None
None
1.31A 4or0A-6bqlA:
2.5
4or0A-6bqlA:
9.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4RZ7_A_1E8A901_1
(CGMP-DEPENDENT
PROTEIN KINASE,
PUTATIVE)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
6 / 10 ILE A 171
ALA A 192
LYS A 194
LEU A 269
VAL A 270
LEU A 319
BI9  A 501 (-4.0A)
BI9  A 501 (-3.3A)
NH4  A 506 ( 4.4A)
BI9  A 501 (-4.4A)
BI9  A 501 (-4.0A)
BI9  A 501 (-4.7A)
0.65A 4rz7A-6bqlA:
11.8
4rz7A-6bqlA:
6.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4U0I_A_0LIA1001_2
(MAST/STEM CELL
GROWTH FACTOR
RECEPTOR
KIT,MAST/STEM CELL
GROWTH FACTOR
RECEPTOR KIT)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
7 / 12 ALA A 192
LYS A 194
LEU A 240
GLY A 273
HIS A 310
LEU A 319
ASP A 330
BI9  A 501 (-3.3A)
NH4  A 506 ( 4.4A)
None
BI9  A 501 (-3.3A)
None
BI9  A 501 (-4.7A)
None
0.99A 4u0iA-6bqlA:
21.6
4u0iA-6bqlA:
11.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UXQ_A_0LIA1752_1
(FIBROBLAST GROWTH
FACTOR RECEPTOR 4)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
5 / 12 ALA A 192
LEU A 303
HIS A 310
LEU A 319
ALA A 329
BI9  A 501 (-3.3A)
None
None
BI9  A 501 (-4.7A)
NH4  A 506 ( 3.7A)
0.39A 4uxqA-6bqlA:
22.0
4uxqA-6bqlA:
13.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4XEY_B_1N1B601_1
(TYROSINE-PROTEIN
KINASE ABL1)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
7 / 12 VAL A 179
ALA A 192
LYS A 194
VAL A 249
GLY A 273
LEU A 319
ALA A 329
BI9  A 501 ( 4.8A)
BI9  A 501 (-3.3A)
NH4  A 506 ( 4.4A)
None
BI9  A 501 (-3.3A)
BI9  A 501 (-4.7A)
NH4  A 506 ( 3.7A)
0.66A 4xeyB-6bqlA:
23.8
4xeyB-6bqlA:
13.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5I9Y_A_1N1A1001_1
(EPHRIN TYPE-A
RECEPTOR 2)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
6 / 12 ILE A 171
ALA A 192
LYS A 194
GLU A 236
GLY A 273
LEU A 319
BI9  A 501 (-4.0A)
BI9  A 501 (-3.3A)
NH4  A 506 ( 4.4A)
NH4  A 506 (-3.0A)
BI9  A 501 (-3.3A)
BI9  A 501 (-4.7A)
0.62A 5i9yA-6bqlA:
23.1
5i9yA-6bqlA:
13.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5IZJ_G_AZ1G2_1
(CAMP-DEPENDENT
PROTEIN KINASE
CATALYTIC SUBUNIT
ALPHA
47P-AZ1-DAR-DAR)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
6 / 7 GLY A 172
GLY A 174
SER A 175
VAL A 179
LYS A 194
LEU A 196
BI9  A 501 (-3.6A)
None
ACT  A 504 (-3.3A)
BI9  A 501 ( 4.8A)
NH4  A 506 ( 4.4A)
None
0.60A 5izjA-6bqlA:
29.2
5izjA-6bqlA:
13.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5J5X_B_AZ1B2_1
(CAMP-DEPENDENT
PROTEIN KINASE
CATALYTIC SUBUNIT
ALPHA
47P-AZ1-DAL-DAR-DAR-
DAR-DAR)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
5 / 7 GLY A 172
GLY A 174
SER A 175
VAL A 179
LYS A 194
BI9  A 501 (-3.6A)
None
ACT  A 504 (-3.3A)
BI9  A 501 ( 4.8A)
NH4  A 506 ( 4.4A)
0.46A 5j5xA-6bqlA:
29.4
5j5xA-6bqlA:
13.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5L2I_A_LQQA900_1
(CYCLIN-DEPENDENT
KINASE 6)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
7 / 12 GLY A 172
VAL A 179
ALA A 192
VAL A 249
PHE A 267
LEU A 319
ALA A 329
BI9  A 501 (-3.6A)
BI9  A 501 ( 4.8A)
BI9  A 501 (-3.3A)
None
BI9  A 501 ( 4.2A)
BI9  A 501 (-4.7A)
NH4  A 506 ( 3.7A)
0.84A 5l2iA-6bqlA:
8.0
5l2iA-6bqlA:
13.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5L2T_A_6ZZA900_1
(CYCLIN-DEPENDENT
KINASE 6)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
6 / 12 VAL A 179
ALA A 192
VAL A 249
PHE A 267
LEU A 319
ALA A 329
BI9  A 501 ( 4.8A)
BI9  A 501 (-3.3A)
None
BI9  A 501 ( 4.2A)
BI9  A 501 (-4.7A)
NH4  A 506 ( 3.7A)
0.90A 5l2tA-6bqlA:
8.0
5l2tA-6bqlA:
13.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5MO4_A_NILA601_2
(TYROSINE-PROTEIN
KINASE ABL1)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
5 / 12 ALA A 192
VAL A 249
HIS A 310
LEU A 319
ALA A 329
BI9  A 501 (-3.3A)
None
None
BI9  A 501 (-4.7A)
NH4  A 506 ( 3.7A)
0.48A 5mo4A-6bqlA:
18.8
5mo4A-6bqlA:
10.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VC3_A_DB8A601_1
(WEE1-LIKE PROTEIN
KINASE)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
6 / 12 ILE A 171
GLY A 172
ALA A 192
GLU A 236
GLY A 273
ASP A 330
BI9  A 501 (-4.0A)
BI9  A 501 (-3.6A)
BI9  A 501 (-3.3A)
NH4  A 506 (-3.0A)
BI9  A 501 (-3.3A)
None
0.88A 5vc3A-6bqlA:
26.5
5vc3A-6bqlA:
16.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XV7_A_EMHA705_1
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
5 / 12 GLY A 172
VAL A 179
ALA A 192
PHE A 267
ALA A 329
BI9  A 501 (-3.6A)
BI9  A 501 ( 4.8A)
BI9  A 501 (-3.3A)
BI9  A 501 ( 4.2A)
NH4  A 506 ( 3.7A)
0.31A 5xv7A-6bqlA:
25.5
5xv7A-6bqlA:
22.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6FNM_A_1N1A1001_1
(-)
6bql CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2

(Homo
sapiens)
7 / 12 ILE A 171
VAL A 179
ALA A 192
LYS A 194
GLU A 236
GLY A 273
LEU A 319
BI9  A 501 (-4.0A)
BI9  A 501 ( 4.8A)
BI9  A 501 (-3.3A)
NH4  A 506 ( 4.4A)
NH4  A 506 (-3.0A)
BI9  A 501 (-3.3A)
BI9  A 501 (-4.7A)
0.66A 6fnmA-6bqlA:
23.9
6fnmA-6bqlA:
13.80