SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1ekq'

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.
1DHF_B_FOLB187_0
(DIHYDROFOLATE
REDUCTASE)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 12 ILE A 127
ALA A 125
ILE A  66
ASN A  65
LEU A  93
 None
 1.18A 1dhfB-1ekqA:
undetectable		 1dhfB-1ekqA:
22.66
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.
1DLS_A_MTXA188_1
(DIHYDROFOLATE
REDUCTASE)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 12 ILE A 127
ALA A 125
ILE A  66
ASN A  65
LEU A  93
 None
 1.18A 1dlsA-1ekqA:
undetectable		 1dlsA-1ekqA:
22.66
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.
1ICT_C_T44C128_1
(TRANSTHYRETIN)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 11 LEU A  64
ALA A  76
GLU A  86
ALA A  56
VAL A  91
 None
 1.26A 1ictA-1ekqA:
0.0
1ictC-1ekqA:
0.0		 1ictA-1ekqA:
18.52
1ictC-1ekqA:
18.52
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.
1OG5_A_SWFA502_1
(CYTOCHROME P450 2C9)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 12 PHE A 207
ALA A 218
LEU A 183
LEU A 200
LEU A  39
 None
 1.17A 1og5A-1ekqA:
0.0		 1og5A-1ekqA:
18.94
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.
1T3R_A_017A1200_2
(PROTEASE RETROPEPSIN)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 11 LEU A 215
ALA A 119
VAL A 204
GLY A 122
ILE A 167
 None
 0.90A 1t3rB-1ekqA:
undetectable		 1t3rB-1ekqA:
16.54
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.
2FXD_A_DR7A102_1
(POL PROTEIN)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 11 ILE A 266
LEU A 183
ASP A 172
GLY A 169
GLY A 197
 None
 1.13A 2fxdA-1ekqA:
undetectable		 2fxdA-1ekqA:
19.78
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.
2IEN_B_017B402_1
(PROTEASE)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 12 LEU A 215
ALA A 119
VAL A 204
GLY A 122
ILE A 167
 None
 0.92A 2ienA-1ekqA:
undetectable		 2ienA-1ekqA:
19.40
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.
2IEO_A_017A402_1
(PROTEASE)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 12 LEU A 215
ALA A 119
VAL A 204
GLY A 122
ILE A 167
 None
 0.92A 2ieoA-1ekqA:
undetectable		 2ieoA-1ekqA:
19.03
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.
2PXC_A_SAMA500_0
(GENOME POLYPROTEIN
[CONTAINS: CAPSID
PROTEIN C (CORE
PROTEIN)
ENVELOPE PROTEIN M
(MATRIX PROTEIN)
MAJOR ENVELOPE
PROTEIN E
NON-STRUCTURAL
PROTEIN 1 (NS1)
NON-STRUCTURAL
PROTEIN 2A (NS2A)
FLAVIVIRIN PROTEASE
NS2B REGULATORY
SUBUNIT
FLAVIVIRIN PROTEASE
NS3 CATALYTIC
SUBUNIT
NON-STRUCTURAL
PROTEIN 4A (NS4A)
NON-STRUCTURAL
PROTEIN 4B (NS4B)
RNA-DIRECTED RNA
POLYMERASE (EC
2.7.7.48) (NS5)])		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		6 / 12 GLY A 197
GLY A  67
GLY A 195
THR A  68
ASP A  94
ILE A  66
 None
 1.38A 2pxcA-1ekqA:
2.4		 2pxcA-1ekqA:
20.50
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.
2W9S_E_TOPE1160_1
(DIHYDROFOLATE
REDUCTASE TYPE 1
FROM TN4003)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		4 / 8 ILE A 219
ALA A 221
LEU A 200
ILE A 174
 None
 0.81A 2w9sE-1ekqA:
undetectable		 2w9sE-1ekqA:
20.70
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.
3AX9_A_SALA1341_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		4 / 8 LEU A 248
THR A 254
VAL A 255
ALA A  38
 None
 1.02A 3ax9A-1ekqA:
0.0		 3ax9A-1ekqA:
13.02
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.
3EKP_B_478B200_1
(PROTEASE)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 8 LEU A 215
ALA A 119
VAL A 204
GLY A 122
ILE A 167
 None
 1.01A 3ekpA-1ekqA:
undetectable		 3ekpA-1ekqA:
16.91
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.
3EKP_C_478C200_1
(PROTEASE)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 10 LEU A 215
ALA A 119
VAL A 204
GLY A 122
ILE A 167
 None
 0.94A 3ekpC-1ekqA:
undetectable		 3ekpC-1ekqA:
16.91
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.
3EKT_B_017B200_1
(PROTEASE)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 9 LEU A 215
ALA A 119
VAL A 204
GLY A 122
ILE A 167
 None
 0.93A 3ektA-1ekqA:
undetectable		 3ektA-1ekqA:
16.91
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.
3EL5_B_1UNB201_1
(PROTEASE)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 10 LEU A 215
ALA A 119
VAL A 204
GLY A 122
ILE A 167
 None
 1.02A 3el5A-1ekqA:
undetectable		 3el5A-1ekqA:
19.44
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.
3HJ3_A_MTXA605_1
(CHAIN A, CRYSTAL
STRUCTURE OF DHFR)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 12 ALA A 108
LEU A  69
ILE A  23
LEU A  62
THR A 130
 None
 1.20A 3hj3A-1ekqA:
undetectable		 3hj3A-1ekqA:
19.39
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.
3N8X_A_NIMA701_2
(PROSTAGLANDIN G/H
SYNTHASE 1)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		3 / 3 VAL A  20
SER A  22
LEU A  36
 None
 0.76A 3n8xA-1ekqA:
0.0		 3n8xA-1ekqA:
18.69
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.
3OGP_A_017A200_2
(FIV PROTEASE)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 10 LEU A 215
ALA A 119
VAL A 204
GLY A 122
ILE A 167
 None
 0.86A 3ogpB-1ekqA:
undetectable		 3ogpB-1ekqA:
16.85
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.
3OGQ_A_AB1A200_1
(FIV PROTEASE)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 10 LEU A 215
ALA A 119
VAL A 204
GLY A 122
ILE A 167
 None
 0.90A 3ogqA-1ekqA:
undetectable		 3ogqA-1ekqA:
16.85
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.
3P97_A_SAMA263_0
(NON-STRUCTURAL
PROTEIN 5)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		6 / 12 GLY A 197
GLY A  67
GLY A 195
THR A  68
ASP A  94
ILE A  66
 None
 1.36A 3p97A-1ekqA:
undetectable		 3p97A-1ekqA:
20.00
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.
3P97_C_SAMC263_0
(NON-STRUCTURAL
PROTEIN 5)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		6 / 12 GLY A 197
GLY A  67
GLY A 195
THR A  68
ASP A  94
ILE A  66
 None
 1.40A 3p97C-1ekqA:
2.4		 3p97C-1ekqA:
20.00
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.
3PS9_A_SAMA670_0
(TRNA
5-METHYLAMINOMETHYL-
2-THIOURIDINE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
MNMC)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 12 GLU A 126
GLY A  97
ASN A 123
ILE A  66
GLY A  99
 None
 1.35A 3ps9A-1ekqA:
2.6		 3ps9A-1ekqA:
16.67
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.
3R9C_A_ECLA451_1
(CYTOCHROME P450
164A2)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 10 ALA A  80
LEU A 117
ILE A 111
ALA A 108
THR A 130
 None
 1.23A 3r9cA-1ekqA:
undetectable		 3r9cA-1ekqA:
20.62
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.
3RC0_B_SAMB480_0
(N-LYSINE
METHYLTRANSFERASE
SETD6)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 12 ALA A 196
GLY A 197
ALA A 228
HIS A 187
PHE A 244
 None
 1.05A 3rc0B-1ekqA:
undetectable		 3rc0B-1ekqA:
19.91
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.
3SI7_D_ACTD4_0
(CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		4 / 5 LEU A 248
LEU A 199
GLY A 197
GLY A 195
 None
 0.78A 3si7C-1ekqA:
0.5
3si7D-1ekqA:
0.7		 3si7C-1ekqA:
24.61
3si7D-1ekqA:
24.61
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.
3SPK_B_TPVB100_1
(HIV-1 PROTEASE)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 9 LEU A 215
ALA A 119
VAL A 204
GLY A 122
ILE A 167
 None
 1.11A 3spkA-1ekqA:
undetectable		 3spkA-1ekqA:
20.32
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.
3SPK_B_TPVB100_2
(HIV-1 PROTEASE)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 12 LEU A 215
ALA A 119
VAL A 204
GLY A 122
ILE A 167
 None
 1.00A 3spkB-1ekqA:
undetectable		 3spkB-1ekqA:
20.32
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.
4AC9_C_DXCC1475_0
(MJ0495-LIKE PROTEIN)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 8 ILE A 112
ASP A 110
ILE A 111
VAL A  91
GLY A  81
 None
 1.20A 4ac9C-1ekqA:
4.8		 4ac9C-1ekqA:
20.70
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.
4CTK_A_SAMA1263_0
(POLYPROTEIN)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		6 / 12 GLY A 197
GLY A  67
GLY A 195
THR A  68
ASP A  94
ILE A  66
 None
 1.36A 4ctkA-1ekqA:
2.1		 4ctkA-1ekqA:
20.59
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.
4DQB_B_017B101_1
(ASPARTYL PROTEASE)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 12 LEU A 215
ALA A 119
VAL A 204
GLY A 122
ILE A 167
 None
 0.92A 4dqbA-1ekqA:
undetectable		 4dqbA-1ekqA:
19.03
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.
4DQC_A_017A101_2
(ASPARTYL PROTEASE)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 9 LEU A 215
ALA A 119
VAL A 204
GLY A 122
ILE A 167
 None
 0.98A 4dqcB-1ekqA:
undetectable		 4dqcB-1ekqA:
17.91
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.
4DQE_B_017B101_1
(ASPARTYL PROTEASE)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 11 LEU A 215
ALA A 119
VAL A 204
GLY A 122
ILE A 167
 None
 0.91A 4dqeA-1ekqA:
undetectable		 4dqeA-1ekqA:
17.91
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.
4DQF_B_017B101_1
(ASPARTYL PROTEASE)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 12 LEU A 215
ALA A 119
VAL A 204
GLY A 122
ILE A 167
 None
 0.93A 4dqfA-1ekqA:
undetectable		 4dqfA-1ekqA:
19.78
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.
4DQH_B_017B101_1
(WILD-TYPE HIV-1
PROTEASE DIMER)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 11 LEU A 215
ALA A 119
VAL A 204
GLY A 122
ILE A 167
 None
 0.86A 4dqhA-1ekqA:
undetectable		 4dqhA-1ekqA:
18.66
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.
4GH8_A_MTXA201_1
(DIHYDROFOLATE
REDUCTASE)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 12 ILE A 127
ALA A 125
ILE A  66
ASN A  65
LEU A  93
 None
 1.11A 4gh8A-1ekqA:
undetectable		 4gh8A-1ekqA:
21.56
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.
4M6K_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 12 ALA A 108
ARG A 121
ILE A  23
LEU A  62
THR A 130
 None
 1.00A 4m6kA-1ekqA:
undetectable		 4m6kA-1ekqA:
21.45
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.
4NJT_B_017B101_1
(PROTEASE)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 11 LEU A 215
ALA A 119
VAL A 204
GLY A 122
ILE A 167
 None
 0.85A 4njtA-1ekqA:
undetectable		 4njtA-1ekqA:
18.28
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.
4NJT_B_017B101_2
(PROTEASE)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 10 LEU A 215
ALA A 119
VAL A 204
GLY A 122
ILE A 167
 None
 0.97A 4njtB-1ekqA:
undetectable		 4njtB-1ekqA:
18.28
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.
4NJT_D_017D101_1
(PROTEASE)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 11 LEU A 215
ALA A 119
VAL A 204
GLY A 122
ILE A 167
 None
 0.91A 4njtC-1ekqA:
undetectable		 4njtC-1ekqA:
18.28
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.
4NJU_A_TPVA500_1
(PROTEASE)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 12 LEU A 215
ALA A 119
VAL A 204
GLY A 122
ILE A 167
 None
 0.94A 4njuA-1ekqA:
undetectable		 4njuA-1ekqA:
18.28
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.
4NJU_C_TPVC500_1
(PROTEASE)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 12 LEU A 215
ALA A 119
VAL A 204
GLY A 122
ILE A 167
 None
 0.95A 4njuC-1ekqA:
undetectable		 4njuC-1ekqA:
18.28
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.
4RVJ_B_478B101_1
(HIV-1 PROTEASE)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 11 LEU A 215
ALA A 119
VAL A 204
GLY A 122
ILE A 167
 None
 0.93A 4rvjA-1ekqA:
undetectable		 4rvjA-1ekqA:
18.28
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.
4RVJ_D_478D101_1
(HIV-1 PROTEASE)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 11 LEU A 215
ALA A 119
VAL A 204
GLY A 122
ILE A 167
 None
 0.92A 4rvjC-1ekqA:
undetectable		 4rvjC-1ekqA:
18.28
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.
4TWD_F_377F402_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		4 / 8 ALA A  41
ALA A  59
ALA A  61
ALA A 206
 None
 0.78A 4twdF-1ekqA:
0.0
4twdG-1ekqA:
0.0
4twdH-1ekqA:
0.0
4twdI-1ekqA:
0.0
4twdJ-1ekqA:
0.0		 4twdF-1ekqA:
19.28
4twdG-1ekqA:
19.28
4twdH-1ekqA:
19.28
4twdI-1ekqA:
19.28
4twdJ-1ekqA:
19.28
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.
4W5Q_A_IPHA902_0
(PROTEIN ARGONAUTE-2)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		4 / 6 ARG A 121
ILE A 120
ILE A 222
ASP A 172
 None
 1.16A 4w5qA-1ekqA:
0.0		 4w5qA-1ekqA:
17.54
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.
4W5T_A_IPHA902_0
(PROTEIN ARGONAUTE-2)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		4 / 6 ARG A 121
ILE A 120
ILE A 222
ASP A 172
 None
 1.17A 4w5tA-1ekqA:
0.0		 4w5tA-1ekqA:
17.54
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.
4WOZ_F_MN9F401_0
(N-ACETYLNEURAMINATE
LYASE)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		4 / 5 LEU A  93
ASP A  94
LEU A 117
THR A 130
 None
 1.24A 4wozF-1ekqA:
2.6
4wozH-1ekqA:
2.7		 4wozF-1ekqA:
23.10
4wozH-1ekqA:
23.10
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.
4XI3_C_29SC601_1
(ESTROGEN RECEPTOR)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 12 LEU A 199
ALA A 196
LEU A 248
LEU A 249
GLY A 242
 None
 1.09A 4xi3C-1ekqA:
undetectable		 4xi3C-1ekqA:
20.63
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.
4YIA_B_IMNB401_1
(THYROXINE-BINDING
GLOBULIN)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 10 SER A  17
LEU A 199
SER A  42
LEU A  36
LEU A 249
 None
 1.19A 4yiaA-1ekqA:
0.0		 4yiaA-1ekqA:
21.96
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.
4Z4C_A_IPHA903_0
(PROTEIN ARGONAUTE-2)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		4 / 6 ARG A 121
ILE A 120
ILE A 222
ASP A 172
 None
 1.13A 4z4cA-1ekqA:
undetectable		 4z4cA-1ekqA:
17.54
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.
4Z4D_A_IPHA902_0
(PROTEIN ARGONAUTE-2)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		4 / 6 ARG A 121
ILE A 120
ILE A 222
ASP A 172
 None
 1.18A 4z4dA-1ekqA:
0.0		 4z4dA-1ekqA:
17.54
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.
5E9Q_C_SAMC4000_0
(GENOME POLYPROTEIN)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		6 / 12 GLY A 197
GLY A  67
GLY A 195
THR A  68
ASP A  94
ILE A  66
 None
 1.38A 5e9qC-1ekqA:
2.4		 5e9qC-1ekqA:
20.42
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.
5EC8_C_SAMC4000_0
(GENOME POLYPROTEIN)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		6 / 12 GLY A 197
GLY A  67
GLY A 195
THR A  68
ASP A  94
ILE A  66
 None
 1.37A 5ec8C-1ekqA:
2.5		 5ec8C-1ekqA:
20.59
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.
5EIF_C_SAMC4000_0
(GENOME POLYPROTEIN)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		6 / 12 GLY A 197
GLY A  67
GLY A 195
THR A  68
ASP A  94
ILE A  66
 None
 1.39A 5eifC-1ekqA:
1.1		 5eifC-1ekqA:
20.59
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.
5GTR_A_ESTA601_1
(ESTROGEN RECEPTOR)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 12 LEU A 199
ALA A 196
LEU A 248
LEU A 249
GLY A 242
 None
 1.00A 5gtrA-1ekqA:
0.0		 5gtrA-1ekqA:
19.86
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.
5KR0_A_478A101_2
(PROTEASE E35D-APV)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 9 LEU A 215
ALA A 119
VAL A 204
GLY A 122
ILE A 167
 None
 1.03A 5kr0B-1ekqA:
undetectable		 5kr0B-1ekqA:
19.03
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.
5NJV_A_SAMA301_0
(NS5)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		6 / 12 GLY A 197
GLY A  67
GLY A 195
THR A  68
ASP A  94
ILE A  66
 None
 1.38A 5njvA-1ekqA:
2.5		 5njvA-1ekqA:
21.12
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.
5NJV_C_SAMC301_0
(NS5)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		6 / 12 GLY A 197
GLY A  67
GLY A 195
THR A  68
ASP A  94
ILE A  66
 None
 1.44A 5njvC-1ekqA:
2.6		 5njvC-1ekqA:
21.12
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.
5OG9_A_TESA503_1
(-)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 9 VAL A  13
ILE A  92
LEU A 200
PRO A  18
ALA A 209
 None
 1.39A 5og9A-1ekqA:
undetectable		 5og9A-1ekqA:
19.88
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.
5X6Y_A_SAMA901_0
(MRNA CAPPING ENZYME
P5)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 11 VAL A 204
GLY A 205
SER A  22
ASP A  94
LEU A 200
 None
 1.24A 5x6yA-1ekqA:
undetectable		 5x6yA-1ekqA:
16.25
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.
6CBD_A_TRPA903_0
(PROTEIN ARGONAUTE-2)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		4 / 6 ARG A 121
ILE A 120
ILE A 222
ASP A 172
 None
 1.20A 6cbdA-1ekqA:
0.0		 6cbdA-1ekqA:
17.54
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.
6DIL_B_TPVB201_0
(HIV-1 PROTEASE)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		5 / 12 LEU A 215
ALA A 119
VAL A 204
GLY A 122
ILE A 167
 None
 0.98A 6dilA-1ekqA:
undetectable		 6dilA-1ekqA:
19.49
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.
6MA7_A_TPFA602_0
(CYTOCHROME P450 3A4)		 1ekq HYDROXYETHYLTHIAZOLE
KINASE
(Bacillus
subtilis) 		4 / 7 ALA A 118
THR A 163
ILE A 165
ALA A 166
 None
 0.98A 6ma7A-1ekqA:
0.0		 6ma7A-1ekqA:
12.87