SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1sg9'

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
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1NV8_A_SAMA300_0
(HEMK PROTEIN)
1sg9 HEMK PROTEIN
(Thermotoga
maritima)
7 / 12 PHE A 100
PRO A 102
GLY A 129
GLY A 131
THR A 150
PHE A 180
PRO A 198
SAM  A 301 ( 3.4A)
SAM  A 301 (-3.6A)
SAM  A 301 (-3.3A)
SAM  A 301 ( 3.8A)
None
SAM  A 301 (-3.5A)
GLN  A 400 (-4.9A)
1.42A 1nv8A-1sg9A:
39.7
1nv8A-1sg9A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1NV8_A_SAMA300_0
(HEMK PROTEIN)
1sg9 HEMK PROTEIN
(Thermotoga
maritima)
12 / 12 PHE A 100
PRO A 102
THR A 106
ILE A 128
GLY A 129
GLY A 131
THR A 150
VAL A 152
PHE A 180
ASN A 197
PRO A 199
ALA A 218
SAM  A 301 ( 3.4A)
SAM  A 301 (-3.6A)
SAM  A 301 (-3.4A)
None
SAM  A 301 (-3.3A)
SAM  A 301 ( 3.8A)
None
SAM  A 301 (-4.3A)
SAM  A 301 (-3.5A)
GLN  A 400 ( 3.1A)
SAM  A 301 ( 4.6A)
SAM  A 301 (-3.3A)
0.19A 1nv8A-1sg9A:
39.7
1nv8A-1sg9A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1NV8_B_SAMB301_0
(HEMK PROTEIN)
1sg9 HEMK PROTEIN
(Thermotoga
maritima)
12 / 12 PHE A 100
THR A 106
ILE A 128
GLY A 129
GLY A 131
ILE A 135
THR A 150
VAL A 152
GLU A 179
PHE A 180
PRO A 199
ALA A 218
SAM  A 301 ( 3.4A)
SAM  A 301 (-3.4A)
None
SAM  A 301 (-3.3A)
SAM  A 301 ( 3.8A)
SAM  A 301 (-4.8A)
None
SAM  A 301 (-4.3A)
None
SAM  A 301 (-3.5A)
SAM  A 301 ( 4.6A)
SAM  A 301 (-3.3A)
0.18A 1nv8B-1sg9A:
41.5
1nv8B-1sg9A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1SG9_A_SAMA301_0
(HEMK PROTEIN)
1sg9 HEMK PROTEIN
(Thermotoga
maritima)
6 / 12 PHE A 100
PRO A 102
GLY A 131
THR A 150
PHE A 180
PRO A 198
SAM  A 301 ( 3.4A)
SAM  A 301 (-3.6A)
SAM  A 301 ( 3.8A)
None
SAM  A 301 (-3.5A)
GLN  A 400 (-4.9A)
1.45A 1sg9A-1sg9A:
46.2
1sg9A-1sg9A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1SG9_A_SAMA301_0
(HEMK PROTEIN)
1sg9 HEMK PROTEIN
(Thermotoga
maritima)
12 / 12 PHE A 100
PRO A 102
ILE A 128
GLY A 131
ILE A 135
THR A 150
VAL A 152
SER A 153
GLU A 179
PHE A 180
ASN A 197
PRO A 199
SAM  A 301 ( 3.4A)
SAM  A 301 (-3.6A)
None
SAM  A 301 ( 3.8A)
SAM  A 301 (-4.8A)
None
SAM  A 301 (-4.3A)
None
None
SAM  A 301 (-3.5A)
GLN  A 400 ( 3.1A)
SAM  A 301 ( 4.6A)
0.05A 1sg9A-1sg9A:
46.2
1sg9A-1sg9A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1SG9_A_SAMA301_1
(HEMK PROTEIN)
1sg9 HEMK PROTEIN
(Thermotoga
maritima)
4 / 4 THR A 106
GLY A 129
ASP A 151
ALA A 218
SAM  A 301 (-3.4A)
SAM  A 301 (-3.3A)
SAM  A 301 (-2.9A)
SAM  A 301 (-3.3A)
0.00A 1sg9A-1sg9A:
46.2
1sg9A-1sg9A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1SG9_B_SAMB302_0
(HEMK PROTEIN)
1sg9 HEMK PROTEIN
(Thermotoga
maritima)
12 / 12 PHE A 100
PRO A 102
THR A 106
ILE A 128
GLY A 129
GLY A 131
ILE A 135
VAL A 152
SER A 153
GLU A 179
PRO A 199
ALA A 218
SAM  A 301 ( 3.4A)
SAM  A 301 (-3.6A)
SAM  A 301 (-3.4A)
None
SAM  A 301 (-3.3A)
SAM  A 301 ( 3.8A)
SAM  A 301 (-4.8A)
SAM  A 301 (-4.3A)
None
None
SAM  A 301 ( 4.6A)
SAM  A 301 (-3.3A)
0.14A 1sg9B-1sg9A:
43.8
1sg9B-1sg9A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1SG9_B_SAMB302_1
(HEMK PROTEIN)
1sg9 HEMK PROTEIN
(Thermotoga
maritima)
3 / 3 ASP A 151
PHE A 180
ASN A 197
SAM  A 301 (-2.9A)
SAM  A 301 (-3.5A)
GLN  A 400 ( 3.1A)
0.10A 1sg9B-1sg9A:
43.8
1sg9B-1sg9A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1SG9_C_SAMC303_0
(HEMK PROTEIN)
1sg9 HEMK PROTEIN
(Thermotoga
maritima)
12 / 12 PHE A 100
PRO A 102
ILE A 128
GLY A 131
ALA A 134
VAL A 152
SER A 153
GLU A 179
PHE A 180
ASN A 197
PRO A 199
ALA A 218
SAM  A 301 ( 3.4A)
SAM  A 301 (-3.6A)
None
SAM  A 301 ( 3.8A)
SAM  A 301 ( 4.0A)
SAM  A 301 (-4.3A)
None
None
SAM  A 301 (-3.5A)
GLN  A 400 ( 3.1A)
SAM  A 301 ( 4.6A)
SAM  A 301 (-3.3A)
0.15A 1sg9C-1sg9A:
43.7
1sg9C-1sg9A:
100.00
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.
1V8B_B_ADNB1502_2
(ADENOSYLHOMOCYSTEINA
SE)
1sg9 HEMK PROTEIN
(Thermotoga
maritima)
3 / 3 GLU A  97
GLU A 217
LEU A 207
None
0.72A 1v8bB-1sg9A:
2.6
1v8bB-1sg9A:
23.38
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1VQ1_A_SAMA301_0
(N5-GLUTAMINE
METHYLTRANSFERASE,
HEMK)
1sg9 HEMK PROTEIN
(Thermotoga
maritima)
12 / 12 PHE A 100
THR A 106
ILE A 128
GLY A 131
ALA A 134
ILE A 135
THR A 150
VAL A 152
GLU A 179
PHE A 180
PRO A 199
ALA A 218
SAM  A 301 ( 3.4A)
SAM  A 301 (-3.4A)
None
SAM  A 301 ( 3.8A)
SAM  A 301 ( 4.0A)
SAM  A 301 (-4.8A)
None
SAM  A 301 (-4.3A)
None
SAM  A 301 (-3.5A)
SAM  A 301 ( 4.6A)
SAM  A 301 (-3.3A)
0.22A 1vq1A-1sg9A:
39.6
1vq1A-1sg9A:
95.92
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1VQ1_A_SAMA301_1
(N5-GLUTAMINE
METHYLTRANSFERASE,
HEMK)
1sg9 HEMK PROTEIN
(Thermotoga
maritima)
3 / 3 GLY A 129
ASP A 151
ASN A 197
SAM  A 301 (-3.3A)
SAM  A 301 (-2.9A)
GLN  A 400 ( 3.1A)
0.10A 1vq1A-1sg9A:
39.6
1vq1A-1sg9A:
95.92
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1VQ1_B_SAMB301_0
(N5-GLUTAMINE
METHYLTRANSFERASE,
HEMK)
1sg9 HEMK PROTEIN
(Thermotoga
maritima)
12 / 12 PHE A 100
THR A 106
ILE A 128
GLY A 129
GLY A 131
SER A 132
ILE A 135
VAL A 152
GLU A 179
PHE A 180
PRO A 199
ALA A 218
SAM  A 301 ( 3.4A)
SAM  A 301 (-3.4A)
None
SAM  A 301 (-3.3A)
SAM  A 301 ( 3.8A)
SAM  A 301 ( 4.8A)
SAM  A 301 (-4.8A)
SAM  A 301 (-4.3A)
None
SAM  A 301 (-3.5A)
SAM  A 301 ( 4.6A)
SAM  A 301 (-3.3A)
0.31A 1vq1B-1sg9A:
39.0
1vq1B-1sg9A:
95.92
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.
2AOJ_C_FRDC305_2
(POL POLYPROTEIN
PEPTIDE INHIBITOR)
1sg9 HEMK PROTEIN
(Thermotoga
maritima)
4 / 7 LEU A 116
GLY A 136
ILE A 135
ILE A 117
None
None
SAM  A 301 (-4.8A)
None
0.79A 2aojB-1sg9A:
undetectable
2aojB-1sg9A:
16.13
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.
2BYO_A_LNLA1216_1
(LIPOPROTEIN LPPX)
1sg9 HEMK PROTEIN
(Thermotoga
maritima)
4 / 5 LEU A 181
ILE A 194
LEU A 195
SER A 196
None
0.86A 2byoA-1sg9A:
0.0
2byoA-1sg9A:
20.60
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.
2NXE_A_SAMA302_0
(RIBOSOMAL PROTEIN
L11
METHYLTRANSFERASE)
1sg9 HEMK PROTEIN
(Thermotoga
maritima)
5 / 12 PHE A 100
ASP A 127
GLY A 129
GLY A 131
ASN A 197
SAM  A 301 ( 3.4A)
SAM  A 301 ( 4.9A)
SAM  A 301 (-3.3A)
SAM  A 301 ( 3.8A)
GLN  A 400 ( 3.1A)
0.34A 2nxeA-1sg9A:
16.5
2nxeA-1sg9A:
25.51
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.
2NXE_B_SAMB303_0
(RIBOSOMAL PROTEIN
L11
METHYLTRANSFERASE)
1sg9 HEMK PROTEIN
(Thermotoga
maritima)
5 / 12 PHE A 100
ASP A 127
GLY A 129
GLY A 131
ASN A 197
SAM  A 301 ( 3.4A)
SAM  A 301 ( 4.9A)
SAM  A 301 (-3.3A)
SAM  A 301 ( 3.8A)
GLN  A 400 ( 3.1A)
0.39A 2nxeB-1sg9A:
16.7
2nxeB-1sg9A:
25.51
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.
2ZUL_A_SAMA376_0
(PROBABLE RIBOSOMAL
RNA SMALL SUBUNIT
METHYLTRANSFERASE)
1sg9 HEMK PROTEIN
(Thermotoga
maritima)
5 / 12 PHE A 100
ALA A 134
ASN A 197
PRO A 199
PHE A 228
SAM  A 301 ( 3.4A)
SAM  A 301 ( 4.0A)
GLN  A 400 ( 3.1A)
SAM  A 301 ( 4.6A)
None
1.06A 2zulA-1sg9A:
18.5
2zulA-1sg9A:
23.35
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.
2ZUL_A_SAMA376_0
(PROBABLE RIBOSOMAL
RNA SMALL SUBUNIT
METHYLTRANSFERASE)
1sg9 HEMK PROTEIN
(Thermotoga
maritima)
6 / 12 PHE A 100
GLY A 129
GLY A 131
ALA A 134
ASN A 197
PRO A 199
SAM  A 301 ( 3.4A)
SAM  A 301 (-3.3A)
SAM  A 301 ( 3.8A)
SAM  A 301 ( 4.0A)
GLN  A 400 ( 3.1A)
SAM  A 301 ( 4.6A)
0.49A 2zulA-1sg9A:
18.5
2zulA-1sg9A:
23.35
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.
3BRF_A_SORA1_0
(LIN-12 AND GLP-1
PHENOTYPE PROTEIN 1,
ISOFORM A)
1sg9 HEMK PROTEIN
(Thermotoga
maritima)
3 / 3 GLY A 131
ASP A 151
SER A 153
SAM  A 301 ( 3.8A)
SAM  A 301 (-2.9A)
None
0.58A 3brfA-1sg9A:
undetectable
3brfA-1sg9A:
19.18
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.
3DMF_A_SAMA388_0
(PROBABLE RIBOSOMAL
RNA SMALL SUBUNIT
METHYLTRANSFERASE)
1sg9 HEMK PROTEIN
(Thermotoga
maritima)
5 / 12 PHE A 100
ALA A 134
ASN A 197
PRO A 199
PHE A 228
SAM  A 301 ( 3.4A)
SAM  A 301 ( 4.0A)
GLN  A 400 ( 3.1A)
SAM  A 301 ( 4.6A)
None
1.03A 3dmfA-1sg9A:
18.5
3dmfA-1sg9A:
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.
3DMF_A_SAMA388_0
(PROBABLE RIBOSOMAL
RNA SMALL SUBUNIT
METHYLTRANSFERASE)
1sg9 HEMK PROTEIN
(Thermotoga
maritima)
6 / 12 PHE A 100
GLY A 129
GLY A 131
ALA A 134
ASN A 197
PRO A 199
SAM  A 301 ( 3.4A)
SAM  A 301 (-3.3A)
SAM  A 301 ( 3.8A)
SAM  A 301 ( 4.0A)
GLN  A 400 ( 3.1A)
SAM  A 301 ( 4.6A)
0.48A 3dmfA-1sg9A:
18.5
3dmfA-1sg9A:
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.
3DMH_A_SAMA384_0
(PROBABLE RIBOSOMAL
RNA SMALL SUBUNIT
METHYLTRANSFERASE)
1sg9 HEMK PROTEIN
(Thermotoga
maritima)
5 / 12 PHE A 100
ALA A 134
ASN A 197
PRO A 199
PHE A 228
SAM  A 301 ( 3.4A)
SAM  A 301 ( 4.0A)
GLN  A 400 ( 3.1A)
SAM  A 301 ( 4.6A)
None
1.00A 3dmhA-1sg9A:
12.8
3dmhA-1sg9A:
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.
3DMH_A_SAMA384_0
(PROBABLE RIBOSOMAL
RNA SMALL SUBUNIT
METHYLTRANSFERASE)
1sg9 HEMK PROTEIN
(Thermotoga
maritima)
6 / 12 PHE A 100
GLY A 129
GLY A 131
ALA A 134
ASN A 197
PRO A 199
SAM  A 301 ( 3.4A)
SAM  A 301 (-3.3A)
SAM  A 301 ( 3.8A)
SAM  A 301 ( 4.0A)
GLN  A 400 ( 3.1A)
SAM  A 301 ( 4.6A)
0.45A 3dmhA-1sg9A:
12.8
3dmhA-1sg9A:
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.
3FI0_G_TRPG1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)
1sg9 HEMK PROTEIN
(Thermotoga
maritima)
4 / 8 GLY A  23
ILE A  18
VAL A  36
VAL A  70
None
0.73A 3fi0G-1sg9A:
undetectable
3fi0G-1sg9A:
23.91
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.
3Q87_B_SAMB300_0
(N6 ADENINE SPECIFIC
DNA METHYLASE)
1sg9 HEMK PROTEIN
(Thermotoga
maritima)
6 / 12 THR A 106
GLY A 129
ILE A 135
ASP A 151
ASN A 197
PRO A 199
SAM  A 301 (-3.4A)
SAM  A 301 (-3.3A)
SAM  A 301 (-4.8A)
SAM  A 301 (-2.9A)
GLN  A 400 ( 3.1A)
SAM  A 301 ( 4.6A)
0.90A 3q87B-1sg9A:
18.2
3q87B-1sg9A:
22.89
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.
3SOA_A_DB8A445_1
(CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE TYPE II
SUBUNIT ALPHA WITH A
BETA 7 LINKER)
1sg9 HEMK PROTEIN
(Thermotoga
maritima)
4 / 6 LEU A 277
VAL A 243
PHE A 232
PHE A 188
None
0.99A 3soaA-1sg9A:
undetectable
3soaA-1sg9A:
22.81
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.
4A81_A_DXCA1161_0
(MAJOR POLLEN
ALLERGEN BET V 1-A)
1sg9 HEMK PROTEIN
(Thermotoga
maritima)
5 / 12 GLY A 225
ASP A 224
ILE A 258
VAL A 259
MET A 245
None
1.15A 4a81A-1sg9A:
undetectable
4a81A-1sg9A:
21.02
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.
4DCM_A_SAMA401_0
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE G)
1sg9 HEMK PROTEIN
(Thermotoga
maritima)
8 / 11 PHE A 100
ASP A 127
GLY A 129
GLY A 131
ILE A 135
ASP A 151
ASN A 197
PRO A 199
SAM  A 301 ( 3.4A)
SAM  A 301 ( 4.9A)
SAM  A 301 (-3.3A)
SAM  A 301 ( 3.8A)
SAM  A 301 (-4.8A)
SAM  A 301 (-2.9A)
GLN  A 400 ( 3.1A)
SAM  A 301 ( 4.6A)
0.57A 4dcmA-1sg9A:
17.2
4dcmA-1sg9A:
22.83
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.
4EAT_A_BEZA1000_0
(BENZOATE-COENZYME A
LIGASE)
1sg9 HEMK PROTEIN
(Thermotoga
maritima)
4 / 7 ALA A 156
ALA A 149
ILE A 128
GLY A 129
SAM  A 301 ( 4.7A)
None
None
SAM  A 301 (-3.3A)
0.59A 4eatA-1sg9A:
2.4
4eatA-1sg9A:
21.32
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.
4GC9_A_SAMA401_0
(DIMETHYLADENOSINE
TRANSFERASE 1,
MITOCHONDRIAL)
1sg9 HEMK PROTEIN
(Thermotoga
maritima)
5 / 12 GLY A 129
GLY A 131
ILE A 135
ASN A 197
PRO A 199
SAM  A 301 (-3.3A)
SAM  A 301 ( 3.8A)
SAM  A 301 (-4.8A)
GLN  A 400 ( 3.1A)
SAM  A 301 ( 4.6A)
0.50A 4gc9A-1sg9A:
9.7
4gc9A-1sg9A:
21.73
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.
4MGH_A_ACTA1320_0
(PHOSPHORIBOSYLFORMYL
GLYCINAMIDINE
SYNTHASE)
1sg9 HEMK PROTEIN
(Thermotoga
maritima)
4 / 5 VAL A  40
LEU A  51
ILE A  14
LEU A  17
None
0.84A 4mghA-1sg9A:
undetectable
4mghA-1sg9A:
12.47
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.
4XV2_A_P06A801_2
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)
1sg9 HEMK PROTEIN
(Thermotoga
maritima)
4 / 4 GLY A 136
LEU A 181
PHE A 188
ILE A 194
None
0.84A 4xv2A-1sg9A:
undetectable
4xv2A-1sg9A:
23.12
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.
4ZBR_A_ACTA608_0
(SERUM ALBUMIN)
1sg9 HEMK PROTEIN
(Thermotoga
maritima)
3 / 3 LYS A 162
ARG A 166
HIS A 167
None
1.25A 4zbrA-1sg9A:
2.8
4zbrA-1sg9A:
18.76
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.
4ZJZ_B_BEZB601_0
(BENZOATE-COENZYME A
LIGASE)
1sg9 HEMK PROTEIN
(Thermotoga
maritima)
5 / 8 ALA A 160
VAL A 175
PHE A 173
GLY A 133
ALA A 134
None
None
None
None
SAM  A 301 ( 4.0A)
1.36A 4zjzB-1sg9A:
3.2
4zjzB-1sg9A:
21.32
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.
5X7P_B_ACRB1421_1
(GLYCOSIDE HYDROLASE
FAMILY 31
ALPHA-GLUCOSIDASE)
1sg9 HEMK PROTEIN
(Thermotoga
maritima)
4 / 6 GLU A 246
TYR A 200
GLY A 225
GLY A 222
GLN  A 400 ( 4.8A)
GLN  A 400 (-3.2A)
None
None
0.74A 5x7pB-1sg9A:
undetectable
5x7pB-1sg9A:
12.64
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.
6NQA_K_SAMK500_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE,
H3 LYSINE-79
SPECIFIC)
1sg9 HEMK PROTEIN
(Thermotoga
maritima)
5 / 10 ASP A 127
GLY A 129
GLY A 131
ASN A 197
PHE A 228
SAM  A 301 ( 4.9A)
SAM  A 301 (-3.3A)
SAM  A 301 ( 3.8A)
GLN  A 400 ( 3.1A)
None
1.12A 6nqaK-1sg9A:
8.0
6nqaK-1sg9A:
23.31
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.
6NQA_K_SAMK500_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE,
H3 LYSINE-79
SPECIFIC)
1sg9 HEMK PROTEIN
(Thermotoga
maritima)
5 / 10 THR A 106
ASP A 127
GLY A 129
ASN A 197
PHE A 228
SAM  A 301 (-3.4A)
SAM  A 301 ( 4.9A)
SAM  A 301 (-3.3A)
GLN  A 400 ( 3.1A)
None
1.48A 6nqaK-1sg9A:
8.0
6nqaK-1sg9A:
23.31