SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4f99'

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.
1IE9_A_VDXA500_1
(VITAMIN D3 RECEPTOR)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE

(Homo
sapiens)
5 / 12 LEU A 550
LEU A 546
SER A 406
SER A 409
CYH A 462
None
1.19A 1ie9A-4f99A:
undetectable
1ie9A-4f99A:
21.64
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.
1IGX_A_EPAA700_1
(PROSTAGLANDIN
ENDOPEROXIDE H
SYNTHASE-1)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE
PROTEIN DBF4 HOMOLOG
A

(Homo
sapiens)
5 / 12 PHE A 414
PHE B 253
GLY A 432
ALA A 455
LEU A 461
None
0.90A 1igxA-4f99A:
undetectable
1igxA-4f99A:
19.90
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.
1NH8_A_HISA289_0
(ATP
PHOSPHORIBOSYLTRANSF
ERASE)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE

(Homo
sapiens)
4 / 5 ASP A 177
LEU A 194
ALA A 200
LEU A 199
None
1.04A 1nh8A-4f99A:
undetectable
1nh8A-4f99A:
22.65
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.
1QCA_A_FUAA221_1
(TYPE III
CHLORAMPHENICOL
ACETYLTRANSFERASE)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE

(Homo
sapiens)
4 / 7 CYH A 462
PHE A 151
SER A 409
PHE A 404
None
1.14A 1qcaA-4f99A:
undetectable
1qcaA-4f99A:
19.79
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.
1UWJ_A_BAXA1723_2
(B-RAF PROTO-ONCOGENE
SERINE/THREONINE-PRO
TEIN KINASE)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE

(Homo
sapiens)
4 / 7 ILE A  64
LYS A  90
LEU A 108
ILE A 173
None
ADP  A 601 (-2.6A)
None
None
0.88A 1uwjA-4f99A:
5.1
1uwjA-4f99A:
25.52
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.
2EVA_A_ADNA498_1
(TAK1 KINASE - TAB1
CHIMERA FUSION
PROTEIN)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE

(Homo
sapiens)
6 / 11 GLY A  65
VAL A  72
ALA A  88
MET A 134
TYR A 136
LEU A 184
ADP  A 601 ( 3.8A)
ADP  A 601 (-4.0A)
ADP  A 601 (-3.5A)
ADP  A 601 ( 3.9A)
ADP  A 601 (-4.1A)
ADP  A 601 ( 4.9A)
0.54A 2evaA-4f99A:
21.8
2evaA-4f99A:
24.02
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.
2FUM_B_MIXB1539_1
(PROBABLE
SERINE/THREONINE-PRO
TEIN KINASE PKNB)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE

(Homo
sapiens)
7 / 12 GLY A  65
VAL A  72
ALA A  88
MET A 134
LYS A 179
ASN A 182
ASP A 196
ADP  A 601 ( 3.8A)
ADP  A 601 (-4.0A)
ADP  A 601 (-3.5A)
ADP  A 601 ( 3.9A)
None
MG  A 602 ( 2.6A)
MG  A 602 ( 3.1A)
0.81A 2fumB-4f99A:
17.4
2fumB-4f99A:
23.02
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.
2FUM_B_MIXB1539_1
(PROBABLE
SERINE/THREONINE-PRO
TEIN KINASE PKNB)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE

(Homo
sapiens)
7 / 12 GLY A  65
VAL A  72
ALA A  88
MET A 134
TYR A 136
ASN A 182
ASP A 196
ADP  A 601 ( 3.8A)
ADP  A 601 (-4.0A)
ADP  A 601 (-3.5A)
ADP  A 601 ( 3.9A)
ADP  A 601 (-4.1A)
MG  A 602 ( 2.6A)
MG  A 602 ( 3.1A)
0.73A 2fumB-4f99A:
17.4
2fumB-4f99A:
23.02
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.
2FUM_C_MIXC2539_1
(PROBABLE
SERINE/THREONINE-PRO
TEIN KINASE PKNB)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE

(Homo
sapiens)
6 / 12 GLY A  65
VAL A  72
ALA A  88
MET A 134
TYR A 136
ASN A 182
ADP  A 601 ( 3.8A)
ADP  A 601 (-4.0A)
ADP  A 601 (-3.5A)
ADP  A 601 ( 3.9A)
ADP  A 601 (-4.1A)
MG  A 602 ( 2.6A)
0.70A 2fumC-4f99A:
16.1
2fumC-4f99A:
23.02
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.
2FUM_D_MIXD3539_1
(PROBABLE
SERINE/THREONINE-PRO
TEIN KINASE PKNB)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE

(Homo
sapiens)
7 / 12 GLY A  65
GLY A  67
VAL A  72
ALA A  88
MET A 134
LYS A 179
ASN A 182
ADP  A 601 ( 3.8A)
ADP  A 601 (-3.7A)
ADP  A 601 (-4.0A)
ADP  A 601 (-3.5A)
ADP  A 601 ( 3.9A)
None
MG  A 602 ( 2.6A)
0.93A 2fumD-4f99A:
16.0
2fumD-4f99A:
23.02
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.
2VN1_A_FK5A501_2
(70 KDA
PEPTIDYLPROLYL
ISOMERASE)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE
PROTEIN DBF4 HOMOLOG
A

(Homo
sapiens)
4 / 6 LEU A 550
SER B 251
PHE B 253
ASP B 254
None
0.99A 2vn1B-4f99A:
undetectable
2vn1B-4f99A:
15.67
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.
2Y6O_A_1N1A1892_1
(EPHRIN TYPE-A
RECEPTOR 4)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE

(Homo
sapiens)
7 / 12 ILE A  64
ALA A  88
LYS A  90
GLU A 104
ILE A 132
TYR A 136
LEU A 184
None
ADP  A 601 (-3.5A)
ADP  A 601 (-2.6A)
None
None
ADP  A 601 (-4.1A)
ADP  A 601 ( 4.9A)
0.62A 2y6oA-4f99A:
15.5
2y6oA-4f99A:
23.86
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.
2YY8_B_SAMB500_0
(UPF0106 PROTEIN
PH0461)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE

(Homo
sapiens)
5 / 11 HIS A 139
VAL A  72
GLY A  65
ILE A  87
ALA A  88
ADP  A 601 (-4.0A)
ADP  A 601 (-4.0A)
ADP  A 601 ( 3.8A)
None
ADP  A 601 (-3.5A)
0.98A 2yy8A-4f99A:
undetectable
2yy8B-4f99A:
undetectable
2yy8A-4f99A:
20.73
2yy8B-4f99A:
20.73
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.
3LD6_B_KKKB602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE

(Homo
sapiens)
5 / 12 PHE A 197
PHE A 569
PHE A 162
ILE A 403
MET A 397
None
1.47A 3ld6B-4f99A:
undetectable
3ld6B-4f99A:
22.03
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.
3M7R_A_VDXA425_1
(VITAMIN D3 RECEPTOR)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE

(Homo
sapiens)
5 / 12 LEU A 550
LEU A 546
SER A 406
SER A 409
CYH A 462
None
1.15A 3m7rA-4f99A:
undetectable
3m7rA-4f99A:
21.64
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.
3OEZ_B_STIB601_1
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE SRC)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE

(Homo
sapiens)
7 / 12 VAL A  72
ALA A  88
LYS A  90
GLU A 104
ILE A 132
TYR A 136
LEU A 184
ADP  A 601 (-4.0A)
ADP  A 601 (-3.5A)
ADP  A 601 (-2.6A)
None
None
ADP  A 601 (-4.1A)
ADP  A 601 ( 4.9A)
0.72A 3oezB-4f99A:
14.9
3oezB-4f99A:
26.20
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.
3SMT_A_ACTA500_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SETD3)
4f99 PROTEIN DBF4 HOMOLOG
A

(Homo
sapiens)
3 / 3 PHE B 318
SER B 321
GLN B 323
None
0.91A 3smtA-4f99B:
undetectable
3smtA-4f99B:
15.20
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.
3T3Z_C_9PLC501_1
(CYTOCHROME P450 2E1)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE
PROTEIN DBF4 HOMOLOG
A

(Homo
sapiens)
4 / 5 PHE A 124
PHE B 338
ALA A  77
LEU A  89
None
1.16A 3t3zC-4f99A:
undetectable
3t3zC-4f99A:
22.00
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.
3V5W_A_8PRA701_1
(G-PROTEIN COUPLED
RECEPTOR KINASE 2)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE

(Homo
sapiens)
6 / 12 ILE A  64
GLY A  67
VAL A  72
ALA A  88
LYS A  90
ASP A 196
None
ADP  A 601 (-3.7A)
ADP  A 601 (-4.0A)
ADP  A 601 (-3.5A)
ADP  A 601 (-2.6A)
MG  A 602 ( 3.1A)
0.61A 3v5wA-4f99A:
7.4
3v5wA-4f99A:
20.98
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.
3V5W_A_8PRA701_1
(G-PROTEIN COUPLED
RECEPTOR KINASE 2)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE

(Homo
sapiens)
6 / 12 ILE A  64
VAL A  72
ALA A  88
LYS A  90
LEU A  92
ASP A 196
None
ADP  A 601 (-4.0A)
ADP  A 601 (-3.5A)
ADP  A 601 (-2.6A)
None
MG  A 602 ( 3.1A)
0.76A 3v5wA-4f99A:
7.4
3v5wA-4f99A:
20.98
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.
4AGC_A_AXIA2000_1
(VASCULAR ENDOTHELIAL
GROWTH FACTOR
RECEPTOR 2)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE

(Homo
sapiens)
6 / 12 VAL A  72
ALA A  88
LYS A  90
GLU A 104
LEU A 108
LEU A 184
ADP  A 601 (-4.0A)
ADP  A 601 (-3.5A)
ADP  A 601 (-2.6A)
None
None
ADP  A 601 ( 4.9A)
0.55A 4agcA-4f99A:
13.7
4agcA-4f99A:
22.34
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)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE

(Homo
sapiens)
7 / 12 ALA A  88
LYS A  90
GLU A 104
LEU A 108
ILE A 132
HIS A 175
LEU A 184
ADP  A 601 (-3.5A)
ADP  A 601 (-2.6A)
None
None
None
None
ADP  A 601 ( 4.9A)
0.63A 4c8bA-4f99A:
14.0
4c8bA-4f99A:
27.11
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.
4E1G_A_LNLA701_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE
PROTEIN DBF4 HOMOLOG
A

(Homo
sapiens)
5 / 12 PHE A 414
PHE B 253
GLY A 432
ALA A 455
LEU A 461
None
0.91A 4e1gA-4f99A:
undetectable
4e1gA-4f99A:
20.33
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.
4E1G_B_LNLB701_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE
PROTEIN DBF4 HOMOLOG
A

(Homo
sapiens)
5 / 12 PHE A 414
PHE B 253
GLY A 432
ALA A 455
LEU A 461
None
0.92A 4e1gB-4f99A:
undetectable
4e1gB-4f99A:
20.33
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.
4IAA_A_RTZA401_1
(SERINE/THREONINE-PRO
TEIN KINASE PIM-1)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE

(Homo
sapiens)
5 / 11 VAL A  72
ALA A  88
LYS A  90
LEU A 184
ASP A 196
ADP  A 601 (-4.0A)
ADP  A 601 (-3.5A)
ADP  A 601 (-2.6A)
ADP  A 601 ( 4.9A)
MG  A 602 ( 3.1A)
0.57A 4iaaA-4f99A:
23.8
4iaaA-4f99A:
24.40
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.
4M6T_A_SAMA201_0
(RNA POLYMERASE
II-ASSOCIATED FACTOR
1 HOMOLOG, LINKER,
RNA
POLYMERASE-ASSOCIATE
D PROTEIN LEO1)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE

(Homo
sapiens)
4 / 4 ILE A 168
VAL A 195
VAL A 117
ARG A 167
None
1.24A 4m6tA-4f99A:
undetectable
4m6tA-4f99A:
21.70
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4OGR_A_ADNA401_1
(CYCLIN-DEPENDENT
KINASE 9)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE

(Homo
sapiens)
6 / 8 ILE A  64
VAL A  72
ALA A  88
ASN A 182
LEU A 184
ASP A 196
None
ADP  A 601 (-4.0A)
ADP  A 601 (-3.5A)
MG  A 602 ( 2.6A)
ADP  A 601 ( 4.9A)
MG  A 602 ( 3.1A)
0.53A 4ogrA-4f99A:
22.1
4ogrA-4f99A:
30.45
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4OGR_E_ADNE401_1
(CYCLIN-DEPENDENT
KINASE 9)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE

(Homo
sapiens)
5 / 7 GLY A  65
ALA A  88
ASN A 182
LEU A 184
ASP A 196
ADP  A 601 ( 3.8A)
ADP  A 601 (-3.5A)
MG  A 602 ( 2.6A)
ADP  A 601 ( 4.9A)
MG  A 602 ( 3.1A)
0.72A 4ogrE-4f99A:
17.7
4ogrE-4f99A:
30.45
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4OGR_I_ADNI401_1
(CYCLIN-DEPENDENT
KINASE 9)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE

(Homo
sapiens)
6 / 9 ILE A  64
VAL A  72
ALA A  88
ASN A 182
LEU A 184
ASP A 196
None
ADP  A 601 (-4.0A)
ADP  A 601 (-3.5A)
MG  A 602 ( 2.6A)
ADP  A 601 ( 4.9A)
MG  A 602 ( 3.1A)
0.58A 4ogrI-4f99A:
24.5
4ogrI-4f99A:
30.45
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.
4QMN_A_DB8A401_1
(SERINE/THREONINE-PRO
TEIN KINASE 24)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE

(Homo
sapiens)
7 / 12 ILE A  64
ALA A  88
GLU A 104
ILE A 132
TYR A 136
LEU A 184
ASP A 196
None
ADP  A 601 (-3.5A)
None
None
ADP  A 601 (-4.1A)
ADP  A 601 ( 4.9A)
MG  A 602 ( 3.1A)
0.69A 4qmnA-4f99A:
17.1
4qmnA-4f99A:
25.19
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.
4QMS_A_1N1A401_1
(SERINE/THREONINE-PRO
TEIN KINASE 24)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE

(Homo
sapiens)
9 / 11 ILE A  64
ALA A  88
LYS A  90
GLU A 104
ILE A 132
TYR A 136
LEU A 137
LEU A 184
ASP A 196
None
ADP  A 601 (-3.5A)
ADP  A 601 (-2.6A)
None
None
ADP  A 601 (-4.1A)
None
ADP  A 601 ( 4.9A)
MG  A 602 ( 3.1A)
0.84A 4qmsA-4f99A:
17.2
4qmsA-4f99A:
25.19
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.
4QMZ_A_B49A401_1
(SERINE/THREONINE-PRO
TEIN KINASE 24)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE

(Homo
sapiens)
8 / 12 ILE A  64
GLY A  65
VAL A  72
ALA A  88
MET A 134
TYR A 136
LEU A 137
LEU A 184
None
ADP  A 601 ( 3.8A)
ADP  A 601 (-4.0A)
ADP  A 601 (-3.5A)
ADP  A 601 ( 3.9A)
ADP  A 601 (-4.1A)
None
ADP  A 601 ( 4.9A)
0.80A 4qmzA-4f99A:
17.2
4qmzA-4f99A:
25.19
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.
4U8V_B_MIYB1103_1
(MULTIDRUG EFFLUX
PUMP SUBUNIT ACRB)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE

(Homo
sapiens)
5 / 12 PHE A 404
GLY A 401
ASP A 551
ALA A 563
PHE A 569
None
1.02A 4u8vB-4f99A:
undetectable
4u8vB-4f99A:
16.82
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.
4XV2_A_P06A801_1
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE

(Homo
sapiens)
5 / 12 VAL A  72
ALA A  88
LYS A  90
ASP A 196
PHE A 197
ADP  A 601 (-4.0A)
ADP  A 601 (-3.5A)
ADP  A 601 (-2.6A)
MG  A 602 ( 3.1A)
None
0.64A 4xv2A-4f99A:
15.8
4xv2A-4f99A:
24.74
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.
4XV2_B_P06B801_1
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE

(Homo
sapiens)
5 / 12 ALA A  88
LYS A  90
LEU A 108
ASP A 196
PHE A 197
ADP  A 601 (-3.5A)
ADP  A 601 (-2.6A)
None
MG  A 602 ( 3.1A)
None
0.93A 4xv2B-4f99A:
15.8
4xv2B-4f99A:
24.74
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.
5DZK_R_BEZR801_1
(ATP-DEPENDENT CLP
PROTEASE PROTEOLYTIC
SUBUNIT 2
BEZ-LEU-LEU)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE
PROTEIN DBF4 HOMOLOG
A

(Homo
sapiens;
Homo
sapiens)
4 / 8 ALA B 319
HIS A 129
LEU B 310
LEU B 311
None
0.89A 5dzkd-4f99B:
undetectable
5dzkr-4f99B:
undetectable
5dzkd-4f99B:
19.16
5dzkr-4f99B:
1.90
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.
5HES_B_032B401_1
(MITOGEN-ACTIVATED
PROTEIN KINASE
KINASE KINASE MLT)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE

(Homo
sapiens)
6 / 12 VAL A  72
ALA A  88
LYS A  90
ILE A 132
TYR A 136
PHE A 197
ADP  A 601 (-4.0A)
ADP  A 601 (-3.5A)
ADP  A 601 (-2.6A)
None
ADP  A 601 (-4.1A)
None
0.92A 5hesB-4f99A:
19.7
5hesB-4f99A:
23.98
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.
5IGJ_A_CTYA402_2
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE

(Homo
sapiens)
4 / 5 PRO A 554
LEU A 421
TYR A 415
PHE A 379
None
1.45A 5igjA-4f99A:
8.3
5igjA-4f99A:
21.93
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)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE

(Homo
sapiens)
4 / 7 GLY A  65
GLY A  67
VAL A  72
LYS A  90
ADP  A 601 ( 3.8A)
ADP  A 601 (-3.7A)
ADP  A 601 (-4.0A)
ADP  A 601 (-2.6A)
0.35A 5izjA-4f99A:
22.1
5izjA-4f99A:
26.68
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.
5J5X_B_AZ1B2_1
(CAMP-DEPENDENT
PROTEIN KINASE
CATALYTIC SUBUNIT
ALPHA
47P-AZ1-DAL-DAR-DAR-
DAR-DAR)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE

(Homo
sapiens)
4 / 7 GLY A  65
GLY A  67
VAL A  72
LYS A  90
ADP  A 601 ( 3.8A)
ADP  A 601 (-3.7A)
ADP  A 601 (-4.0A)
ADP  A 601 (-2.6A)
0.39A 5j5xA-4f99A:
17.0
5j5xA-4f99A:
26.68
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.
5JMN_B_FUAB1101_1
(MULTIDRUG EFFLUX
PUMP SUBUNIT ACRB)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE
PROTEIN DBF4 HOMOLOG
A

(Homo
sapiens)
4 / 5 ILE B 330
LEU A  92
LYS A  90
VAL A 120
None
None
ADP  A 601 (-2.6A)
None
1.04A 5jmnB-4f99B:
undetectable
5jmnB-4f99B:
8.98
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.
5LW1_B_ADNB401_1
(MITOGEN-ACTIVATED
PROTEIN KINASE 8)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE

(Homo
sapiens)
5 / 9 ILE A  64
GLY A  65
VAL A  72
ALA A  88
MET A 134
None
ADP  A 601 ( 3.8A)
ADP  A 601 (-4.0A)
ADP  A 601 (-3.5A)
ADP  A 601 ( 3.9A)
0.50A 5lw1B-4f99A:
8.4
5lw1B-4f99A:
12.68
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.
5MAF_A_XINA403_1
(MATERNAL EMBRYONIC
LEUCINE ZIPPER
KINASE)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE

(Homo
sapiens)
7 / 12 ILE A  64
GLY A  65
VAL A  72
ALA A  88
LYS A  90
GLU A 104
TYR A 136
None
ADP  A 601 ( 3.8A)
ADP  A 601 (-4.0A)
ADP  A 601 (-3.5A)
ADP  A 601 (-2.6A)
None
ADP  A 601 (-4.1A)
0.50A 5mafA-4f99A:
24.5
5mafA-4f99A:
13.01
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.
5OWR_A_1N1A401_1
(SERINE/THREONINE-PRO
TEIN KINASE 10)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE

(Homo
sapiens)
4 / 8 ALA A  88
GLU A 104
LEU A 184
ASP A 196
ADP  A 601 (-3.5A)
None
ADP  A 601 ( 4.9A)
MG  A 602 ( 3.1A)
0.47A 5owrA-4f99A:
14.8
5owrA-4f99A:
25.71
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.
6B89_A_NOVA403_2
(LIPOPOLYSACCHARIDE
EXPORT SYSTEM
ATP-BINDING PROTEIN
LPTB)
4f99 CELL DIVISION CYCLE
7-RELATED PROTEIN
KINASE

(Homo
sapiens)
4 / 6 PHE A 162
LEU A 165
ALA A 400
GLN A 170
None
1.01A 6b89B-4f99A:
undetectable
6b89B-4f99A:
13.38