SIMILAR PATTERNS OF AMINO ACIDS FOR 1JG2_A_ADNA500_1

List of similar pattern of amino acids derived from ASSAM search

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 link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. 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.
1bhy P64K

(Neisseria
meningitidis) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 GLY A 133
GLY A 439
ILE A 270
GLY A 130
ALA A 137
 FAD  A 600 (-3.4A)
FAD  A 600 (-3.3A)
None
None
None
 1.13A 1jg2A-1bhyA:
3.3		 1jg2A-1bhyA:
19.67
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.
1bhy P64K

(Neisseria
meningitidis) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 GLY A 134
GLY A 129
ILE A 270
LEU A 128
GLY A 455
 None
FAD  A 600 (-3.0A)
None
None
None
 0.85A 1jg2A-1bhyA:
3.3		 1jg2A-1bhyA:
19.67
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.
1bt4 PHOSPHOSERINE
AMINOTRANSFERASE

(Bacillus
circulans) 		PF00266
(Aminotran_5) 		5 GLY A 203
GLY A  75
ILE A  73
GLY A 244
ALA A 195
 None
 1.09A 1jg2A-1bt4A:
undetectable		 1jg2A-1bt4A:
22.31
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.
1dl5 PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Thermotoga
maritima) 		PF01135
(PCMT) 		5 GLY A  83
GLU A 107
ILE A 112
GLY A 135
THR A 151
 SAH  A 699 (-3.2A)
SAH  A 699 (-2.9A)
SAH  A 699 ( 4.5A)
SAH  A 699 (-3.5A)
SAH  A 699 (-3.2A)
 1.14A 1jg2A-1dl5A:
28.5		 1jg2A-1dl5A:
27.98
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.
1dl5 PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Thermotoga
maritima) 		PF01135
(PCMT) 		6 GLY A  83
GLY A  85
GLU A 107
ASP A 134
GLY A 135
THR A 151
 SAH  A 699 (-3.2A)
SAH  A 699 (-3.5A)
SAH  A 699 (-2.9A)
SAH  A 699 (-3.5A)
SAH  A 699 (-3.5A)
SAH  A 699 (-3.2A)
 0.46A 1jg2A-1dl5A:
28.5		 1jg2A-1dl5A:
27.98
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.
1dxl DIHYDROLIPOAMIDE
DEHYDROGENASE

(Pisum sativum) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 GLY A  17
GLY A 316
ILE A 145
GLY A  14
ALA A  21
 FAD  A 480 (-3.2A)
FAD  A 480 ( 4.0A)
None
FAD  A 480 ( 4.7A)
None
 1.09A 1jg2A-1dxlA:
4.2		 1jg2A-1dxlA:
20.34
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.
1e9y UREASE SUBUNIT BETA

(Helicobacter
pylori) 		PF00449
(Urease_alpha)
PF01979
(Amidohydro_1) 		5 ILE B  88
LEU B  68
GLY B  97
ALA B  73
VAL B 128
 None
 1.11A 1jg2A-1e9yB:
undetectable		 1jg2A-1e9yB:
18.25
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.
1f59 IMPORTIN BETA-1

(Homo sapiens) 		PF03810
(IBN_N)
PF13513
(HEAT_EZ) 		5 GLY A 391
LEU A 394
THR A 427
ALA A 428
LEU A 416
 None
 1.17A 1jg2A-1f59A:
undetectable		 1jg2A-1f59A:
19.42
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.
1h5y HISF

(Pyrobaculum
aerophilum) 		PF00977
(His_biosynth) 		5 ILE A  52
LEU A  11
ASP A  67
ALA A  75
VAL A  76
 None
 1.12A 1jg2A-1h5yA:
undetectable		 1jg2A-1h5yA:
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.
1itz TRANSKETOLASE

(Zea mays) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		5 GLY A 425
GLY A 427
GLY A 174
ALA A 179
VAL A 137
 None
 1.24A 1jg2A-1itzA:
undetectable		 1jg2A-1itzA:
16.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1jg3 PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Pyrococcus
furiosus) 		PF01135
(PCMT) 		12 GLN A  72
GLY A  99
GLY A 101
GLU A 121
ILE A 123
LEU A 126
ASP A 148
GLY A 149
THR A 165
ALA A 166
VAL A 219
LEU A 221
 ADN  A 500 (-3.7A)
ADN  A 500 (-3.2A)
ADN  A 500 (-3.4A)
ADN  A 500 (-2.9A)
ADN  A 500 (-4.6A)
ADN  A 500 (-4.2A)
ADN  A 500 (-3.7A)
ADN  A 500 (-3.3A)
ADN  A 500 (-4.5A)
ADN  A 500 ( 4.0A)
None
ADN  A 500 (-4.2A)
 0.35A 1jg2A-1jg3A:
41.6		 1jg2A-1jg3A:
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.
1kqj A/G-SPECIFIC ADENINE
GLYCOSYLASE

(Escherichia
coli) 		PF00633
(HHH)
PF00730
(HhH-GPD) 		5 GLY A 118
GLY A 116
THR A 121
ALA A 122
VAL A 111
 None
 1.19A 1jg2A-1kqjA:
undetectable		 1jg2A-1kqjA:
22.22
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1kr5 PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Homo sapiens) 		PF01135
(PCMT) 		8 GLY A  85
GLY A  87
ILE A 111
LEU A 114
ASP A 141
GLY A 142
ALA A 159
LEU A 215
 SAH  A 300 (-3.5A)
SAH  A 300 (-3.6A)
SAH  A 300 ( 4.9A)
SAH  A 300 (-4.7A)
SAH  A 300 (-3.7A)
SAH  A 300 (-3.5A)
SAH  A 300 ( 3.8A)
SAH  A 300 (-4.4A)
 0.46A 1jg2A-1kr5A:
31.1		 1jg2A-1kr5A:
35.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1kr5 PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Homo sapiens) 		PF01135
(PCMT) 		8 GLY A  85
GLY A  87
LEU A 114
ASP A 141
GLY A 142
ALA A 159
VAL A 213
LEU A 215
 SAH  A 300 (-3.5A)
SAH  A 300 (-3.6A)
SAH  A 300 (-4.7A)
SAH  A 300 (-3.7A)
SAH  A 300 (-3.5A)
SAH  A 300 ( 3.8A)
SAH  A 300 ( 4.8A)
SAH  A 300 (-4.4A)
 0.42A 1jg2A-1kr5A:
31.1		 1jg2A-1kr5A:
35.66
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.
1mjf SPERMIDINE SYNTHASE

(Pyrococcus
furiosus) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 GLY A  82
GLU A 104
ASP A 141
GLY A 142
LEU A 169
 None
 0.76A 1jg2A-1mjfA:
8.2		 1jg2A-1mjfA:
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.
1mjf SPERMIDINE SYNTHASE

(Pyrococcus
furiosus) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 GLY A  82
GLY A  84
GLU A 104
ASP A 141
GLY A 142
 None
 0.56A 1jg2A-1mjfA:
8.2		 1jg2A-1mjfA:
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.
1nnw HYPOTHETICAL PROTEIN

(Pyrococcus
furiosus) 		no annotation 5 GLY A 136
LEU A 125
ASP A  74
GLY A  71
ALA A   8
 None
 1.11A 1jg2A-1nnwA:
undetectable		 1jg2A-1nnwA:
23.55
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.
1p1m HYPOTHETICAL PROTEIN
TM0936

(Thermotoga
maritima) 		PF01979
(Amidohydro_1) 		5 GLY A 321
ILE A 108
LEU A 289
ASP A 339
VAL A 112
 None
 1.17A 1jg2A-1p1mA:
undetectable		 1jg2A-1p1mA:
21.67
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.
1pby QUINOHEMOPROTEIN
AMINE DEHYDROGENASE
60 KDA SUBUNIT

(Paracoccus
denitrificans) 		PF09098
(Dehyd-heme_bind)
PF09099
(Qn_am_d_aIII)
PF09100
(Qn_am_d_aIV)
PF14930
(Qn_am_d_aII) 		5 GLY A 321
GLY A 319
ALA A 297
VAL A 296
LEU A 279
 None
 1.17A 1jg2A-1pbyA:
undetectable		 1jg2A-1pbyA:
18.01
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.
1qyr HIGH LEVEL
KASUGAMYCIN
RESISTANCE PROTEIN

(Escherichia
coli) 		PF00398
(RrnaAD) 		5 GLY A  45
GLY A  47
GLU A  66
LEU A  71
ASP A  91
 None
 0.60A 1jg2A-1qyrA:
9.3		 1jg2A-1qyrA:
20.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1r18 PROTEIN-L-ISOASPARTA
TE(D-ASPARTATE)-O-ME
THYLTRANSFERASE

(Drosophila
melanogaster) 		PF01135
(PCMT) 		7 GLY A  86
GLY A  88
GLU A 115
LEU A 120
ASP A 147
GLY A 148
ALA A 165
 SAH  A 300 (-3.4A)
SAH  A 300 (-3.2A)
SAH  A 300 (-2.9A)
SAH  A 300 (-4.7A)
SAH  A 300 (-3.6A)
SAH  A 300 (-3.6A)
SAH  A 300 (-3.6A)
 0.30A 1jg2A-1r18A:
27.5		 1jg2A-1r18A:
36.82
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.
1u11 PURE
(N5-CARBOXYAMINOIMID
AZOLE RIBONUCLEOTIDE
MUTASE)

(Acetobacter
aceti) 		PF00731
(AIRC) 		5 GLY A 136
GLY A 139
LEU A 133
GLY A 114
THR A  36
 None
 1.15A 1jg2A-1u11A:
undetectable		 1jg2A-1u11A:
22.32
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1vbf 231AA LONG
HYPOTHETICAL
PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Sulfurisphaera
tokodaii) 		PF01135
(PCMT) 		6 GLY A  78
GLY A  80
GLU A  99
ASP A 124
GLY A 125
ALA A 142
 None
 0.53A 1jg2A-1vbfA:
30.5		 1jg2A-1vbfA:
31.78
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.
1vkn N-ACETYL-GAMMA-GLUTA
MYL-PHOSPHATE
REDUCTASE

(Thermotoga
maritima) 		PF01118
(Semialdhyde_dh)
PF02774
(Semialdhyde_dhC) 		5 GLY A 144
LEU A 126
ASP A  93
GLY A  95
ALA A 312
 None
 1.14A 1jg2A-1vknA:
2.7		 1jg2A-1vknA:
20.45
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.
1wy7 HYPOTHETICAL PROTEIN
PH1948

(Pyrococcus
horikoshii) 		PF05175
(MTS) 		5 GLN A  27
GLY A  57
GLY A  59
GLU A  79
ASP A 105
 SAH  A1001 (-3.8A)
SAH  A1001 (-3.4A)
SAH  A1001 (-3.3A)
SAH  A1001 (-2.8A)
SAH  A1001 (-3.2A)
 0.92A 1jg2A-1wy7A:
10.9		 1jg2A-1wy7A:
22.87
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.
1xj5 SPERMIDINE SYNTHASE
1

(Arabidopsis
thaliana) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 GLY A 128
GLY A 130
GLU A 151
ASP A 182
GLY A 183
 None
 0.45A 1jg2A-1xj5A:
8.0		 1jg2A-1xj5A:
20.36
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.
1xj5 SPERMIDINE SYNTHASE
1

(Arabidopsis
thaliana) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 GLY A 128
GLY A 130
GLU A 151
GLY A 183
LEU A 212
 None
 0.77A 1jg2A-1xj5A:
8.0		 1jg2A-1xj5A:
20.36
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.
1zq9 PROBABLE
DIMETHYLADENOSINE
TRANSFERASE

(Homo sapiens) 		PF00398
(RrnaAD) 		5 GLY A  64
GLY A  66
GLU A  85
LEU A  90
ASP A 113
 SAM  A4000 (-3.1A)
SAM  A4000 (-3.2A)
SAM  A4000 (-2.8A)
SAM  A4000 (-4.8A)
SAM  A4000 (-3.8A)
 0.59A 1jg2A-1zq9A:
8.6		 1jg2A-1zq9A:
19.93
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.
2d1q LUCIFERIN
4-MONOOXYGENASE

(Luciola
cruciata) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		5 GLY A 236
GLY A 261
ASP A  52
ALA A 238
VAL A 239
 None
 1.13A 1jg2A-2d1qA:
undetectable		 1jg2A-2d1qA:
16.73
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.
2d1q LUCIFERIN
4-MONOOXYGENASE

(Luciola
cruciata) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		5 GLY A 261
ASP A  52
THR A 237
ALA A 238
VAL A 239
 None
 1.19A 1jg2A-2d1qA:
undetectable		 1jg2A-2d1qA:
16.73
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.
2gqt UDP-N-ACETYLENOLPYRU
VYLGLUCOSAMINE
REDUCTASE

(Thermus
caldophilus) 		PF01565
(FAD_binding_4)
PF02873
(MurB_C) 		5 GLY A  19
GLY A  17
GLY A  56
ALA A 243
VAL A 246
 None
 0.94A 1jg2A-2gqtA:
undetectable		 1jg2A-2gqtA:
25.09
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.
2grv LPQW

(Mycolicibacterium
smegmatis) 		PF00496
(SBP_bac_5) 		5 GLY A 451
GLU A 166
GLY A 137
ALA A 454
LEU A 537
 None
 0.98A 1jg2A-2grvA:
undetectable		 1jg2A-2grvA:
14.74
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.
2i58 SUGAR ABC
TRANSPORTER,
SUGAR-BINDING
PROTEIN

(Streptococcus
pneumoniae) 		PF13416
(SBP_bac_8) 		5 GLN A 169
GLY A 179
GLY A 177
VAL A 276
LEU A 274
 None
 1.12A 1jg2A-2i58A:
undetectable		 1jg2A-2i58A:
22.31
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.
2jjx URIDYLATE KINASE

(Bacillus
anthracis) 		PF00696
(AA_kinase) 		5 GLY A  51
GLY A  13
ILE A  55
GLY A 131
THR A 141
 None
 1.16A 1jg2A-2jjxA:
4.5		 1jg2A-2jjxA:
19.64
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2pbf PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE
BETA-ASPARTATE
METHYLTRANSFERASE

(Plasmodium
falciparum) 		PF01135
(PCMT) 		7 GLY A  88
GLY A  90
GLU A 116
LEU A 121
ALA A 170
VAL A 222
LEU A 224
 SAH  A 301 (-3.1A)
SAH  A 301 (-3.4A)
SAH  A 301 (-2.8A)
SAH  A 301 ( 4.1A)
SAH  A 301 ( 3.8A)
SAH  A 301 (-4.5A)
SAH  A 301 (-4.3A)
 0.25A 1jg2A-2pbfA:
28.3		 1jg2A-2pbfA:
32.66
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.
2pff FATTY ACID SYNTHASE
SUBUNIT BETA

(Saccharomyces
cerevisiae) 		PF00698
(Acyl_transf_1)
PF16073
(SAT) 		5 GLY B 276
GLY B 161
LEU B 512
THR B 279
ALA B 280
 None
 1.17A 1jg2A-2pffB:
undetectable		 1jg2A-2pffB:
6.13
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.
2pt6 SPERMIDINE SYNTHASE

(Plasmodium
falciparum) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 GLY A 124
GLY A 126
GLU A 147
ASP A 178
LEU A 207
 S4M  A 501 (-3.4A)
S4M  A 501 ( 4.4A)
S4M  A 501 (-2.7A)
S4M  A 501 (-3.3A)
S4M  A 501 (-4.4A)
 0.86A 1jg2A-2pt6A:
7.9		 1jg2A-2pt6A:
23.78
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.
2pyx TRYPTOPHAN
HALOGENASE

(Shewanella
frigidimarina) 		PF04820
(Trp_halogenase) 		5 ILE A   9
LEU A 223
GLY A  18
THR A 370
ALA A 371
 None
 0.91A 1jg2A-2pyxA:
3.3		 1jg2A-2pyxA:
15.88
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.
2qna IMPORTIN SUBUNIT
BETA-1

(Homo sapiens) 		PF13513
(HEAT_EZ) 		5 GLY A 391
LEU A 394
THR A 427
ALA A 428
LEU A 416
 None
 1.19A 1jg2A-2qnaA:
undetectable		 1jg2A-2qnaA:
14.23
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.
2r6r CELL DIVISION
PROTEIN FTSZ

(Aquifex
aeolicus) 		PF00091
(Tubulin)
PF12327
(FtsZ_C) 		5 GLY 1 225
ASP 1 301
GLY 1 229
ALA 1 233
VAL 1 275
 None
 1.06A 1jg2A-2r6r1:
3.4		 1jg2A-2r6r1:
22.73
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.
2uv8 FATTY ACID SYNTHASE
SUBUNIT BETA (FAS1)

(Saccharomyces
cerevisiae) 		PF00698
(Acyl_transf_1)
PF01575
(MaoC_dehydratas)
PF08354
(DUF1729)
PF13452
(MaoC_dehydrat_N)
PF16073
(SAT) 		5 GLY G 276
GLY G 161
LEU G 512
THR G 279
ALA G 280
 None
 1.02A 1jg2A-2uv8G:
undetectable		 1jg2A-2uv8G:
8.11
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.
2vaw CELL DIVISION
PROTEIN FTSZ

(Pseudomonas
aeruginosa) 		PF00091
(Tubulin)
PF12327
(FtsZ_C) 		5 GLY A  78
ILE A 116
ALA A  43
VAL A  19
LEU A  59
 None
 1.11A 1jg2A-2vawA:
3.2		 1jg2A-2vawA:
20.80
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.
2w1v NITRILASE HOMOLOG 2

(Mus musculus) 		PF00795
(CN_hydrolase) 		5 GLY A 120
ILE A  47
LEU A  79
ALA A 111
VAL A 110
 None
 1.09A 1jg2A-2w1vA:
2.3		 1jg2A-2w1vA:
21.28
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.
2yfq NAD-SPECIFIC
GLUTAMATE
DEHYDROGENASE

(Peptoniphilus
asaccharolyticus) 		PF00208
(ELFV_dehydrog)
PF02812
(ELFV_dehydrog_N) 		5 GLY A  96
ILE A 345
GLY A 350
ALA A 384
VAL A 388
 None
 1.24A 1jg2A-2yfqA:
undetectable		 1jg2A-2yfqA:
21.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2yxe PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Methanocaldococcus
jannaschii) 		PF01135
(PCMT) 		7 GLN A  58
ILE A 111
LEU A 114
ASP A 136
GLY A 137
ALA A 154
LEU A 207
 None
 0.77A 1jg2A-2yxeA:
35.1		 1jg2A-2yxeA:
50.21
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2yxe PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Methanocaldococcus
jannaschii) 		PF01135
(PCMT) 		11 GLY A  85
GLY A  87
GLU A 109
ILE A 111
LEU A 114
ASP A 136
GLY A 137
THR A 153
ALA A 154
VAL A 205
LEU A 207
 None
 0.47A 1jg2A-2yxeA:
35.1		 1jg2A-2yxeA:
50.21
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.
2zsu SPERMIDINE SYNTHASE

(Pyrococcus
horikoshii) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 GLY A  84
GLU A 107
ASP A 144
GLY A 145
LEU A 172
 None
 0.68A 1jg2A-2zsuA:
8.0		 1jg2A-2zsuA:
26.76
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.
2zsu SPERMIDINE SYNTHASE

(Pyrococcus
horikoshii) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 GLY A  84
GLY A  86
GLU A 107
ASP A 144
GLY A 145
 None
 0.49A 1jg2A-2zsuA:
8.0		 1jg2A-2zsuA:
26.76
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.
3beu TRYPSIN

(Streptomyces
griseus) 		PF00089
(Trypsin) 		5 GLY A  69
GLY A  44
THR A  67
ALA A  66
VAL A  83
 None
 1.06A 1jg2A-3beuA:
undetectable		 1jg2A-3beuA:
20.15
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.
3fut DIMETHYLADENOSINE
TRANSFERASE

(Thermus
thermophilus) 		PF00398
(RrnaAD) 		5 GLY A  54
GLY A  56
GLU A  75
LEU A  80
ASP A  99
 None
 0.57A 1jg2A-3futA:
9.5		 1jg2A-3futA:
22.92
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.
3gq9 PRENECK APPENDAGE
PROTEIN

(Bacillus virus
phi29) 		PF11962
(Peptidase_G2)
PF12708
(Pectate_lyase_3) 		5 GLY A 114
GLY A 139
ILE A 165
ALA A 112
VAL A 107
 None
 0.95A 1jg2A-3gq9A:
undetectable		 1jg2A-3gq9A:
15.93
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3lbf PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Escherichia
coli) 		PF01135
(PCMT) 		12 GLN A  56
GLY A  83
GLY A  85
GLU A 104
ILE A 106
LEU A 109
ASP A 131
GLY A 132
THR A 148
ALA A 149
VAL A 200
LEU A 202
 SAH  A 300 (-3.8A)
SAH  A 300 (-3.4A)
SAH  A 300 (-3.4A)
SAH  A 300 (-2.9A)
SAH  A 300 (-4.3A)
SAH  A 300 (-4.8A)
SAH  A 300 (-3.7A)
SAH  A 300 (-3.6A)
SAH  A 300 (-3.3A)
SAH  A 300 ( 3.7A)
None
SAH  A 300 (-4.2A)
 0.43A 1jg2A-3lbfA:
32.8		 1jg2A-3lbfA:
36.56
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.
3llc PUTATIVE HYDROLASE

(Agrobacterium
vitis) 		PF12697
(Abhydrolase_6) 		5 GLY A 115
GLY A  43
ILE A 142
ALA A 119
LEU A 120
 None
 1.18A 1jg2A-3llcA:
undetectable		 1jg2A-3llcA:
21.20
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.
3lxd FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULPHID
E OXIDOREDUCTASE

(Novosphingobium
aromaticivorans) 		PF07992
(Pyr_redox_2)
PF14759
(Reductase_C) 		5 GLY A 246
GLY A 164
GLY A 248
ALA A 134
VAL A 135
 None
 0.93A 1jg2A-3lxdA:
3.0		 1jg2A-3lxdA:
22.54
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.
3nrk LIC12922

(Leptospira
interrogans) 		PF13145
(Rotamase_2)
PF13624
(SurA_N_3) 		5 GLY A 165
ILE A 172
LEU A 168
ALA A 108
VAL A 104
 None
 0.95A 1jg2A-3nrkA:
undetectable		 1jg2A-3nrkA:
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.
3nwy URIDYLATE KINASE

(Mycobacterium
tuberculosis) 		PF00696
(AA_kinase) 		5 GLY A 155
ILE A 153
GLY A  38
THR A 168
ALA A 169
 None
 1.08A 1jg2A-3nwyA:
3.8		 1jg2A-3nwyA:
22.22
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.
3o4f SPERMIDINE SYNTHASE

(Escherichia
coli) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 GLY A  85
GLY A  87
GLU A 108
ASP A 140
GLY A 141
 None
 0.65A 1jg2A-3o4fA:
7.8		 1jg2A-3o4fA:
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.
3oix DIHYDROOROTATE
OXIDASE
PUTATIVE
DIHYDROOROTATE
DEHYDROGENASE

(Streptococcus
mutans) 		PF01180
(DHO_dh) 		5 GLY A 219
GLY A 249
ILE A 193
GLY A 217
THR A 271
 FMN  A 400 (-3.7A)
FMN  A 400 (-3.8A)
None
None
FMN  A 400 (-3.6A)
 1.22A 1jg2A-3oixA:
undetectable		 1jg2A-3oixA:
22.44
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.
3om8 PROBABLE HYDROLASE

(Pseudomonas
aeruginosa) 		PF00561
(Abhydrolase_1) 		5 GLY A 188
GLY A 185
LEU A 186
ASP A 135
ALA A 192
 None
 1.13A 1jg2A-3om8A:
undetectable		 1jg2A-3om8A:
22.58
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.
3q3v PHOSPHOGLYCERATE
KINASE

(Campylobacter
jejuni) 		PF00162
(PGK) 		5 GLY A 353
GLY A 321
GLY A 375
ALA A 357
VAL A 360
 None
 1.21A 1jg2A-3q3vA:
4.3		 1jg2A-3q3vA:
20.99
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.
3rha PUTRESCINE OXIDASE

(Paenarthrobacter
aurescens) 		PF01593
(Amino_oxidase) 		5 GLY A 441
ASP A 435
GLY A 436
THR A 444
ALA A 443
 None
 1.12A 1jg2A-3rhaA:
undetectable		 1jg2A-3rhaA:
20.83
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.
3rre PUTATIVE
UNCHARACTERIZED
PROTEIN

(Thermotoga
maritima) 		PF01256
(Carb_kinase)
PF03853
(YjeF_N) 		5 GLY A  49
GLY A  76
ILE A 116
ASP A  55
GLY A  54
 None
None
None
GOL  A 496 (-3.1A)
None
 1.02A 1jg2A-3rreA:
3.5		 1jg2A-3rreA:
19.17
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.
3rw9 SPERMIDINE SYNTHASE

(Homo sapiens) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		6 GLY A 101
GLY A 103
GLU A 124
ASP A 155
GLY A 156
LEU A 184
 DSH  A 303 (-3.4A)
DSH  A 303 (-3.5A)
DSH  A 303 (-2.6A)
DSH  A 303 (-3.5A)
DSH  A 303 (-3.7A)
DSH  A 303 (-4.2A)
 0.74A 1jg2A-3rw9A:
7.8		 1jg2A-3rw9A:
22.08
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.
3sul CERATO-PLATANIN-LIKE
PROTEIN

(Moniliophthora
perniciosa) 		PF07249
(Cerato-platanin) 		5 GLY A  60
GLY A  92
ASP A  26
GLY A 103
VAL A  35
 None
 1.22A 1jg2A-3sulA:
undetectable		 1jg2A-3sulA:
17.52
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.
3uzu RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE A

(Burkholderia
pseudomallei) 		PF00398
(RrnaAD) 		5 GLY A  46
GLY A  48
GLU A  71
LEU A  76
LEU A 118
 None
 1.11A 1jg2A-3uzuA:
8.7		 1jg2A-3uzuA:
19.27
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.
3vyw MNMC2

(Aquifex
aeolicus) 		PF05430
(Methyltransf_30) 		6 GLY A 104
GLY A 106
GLU A 133
ASP A 174
ALA A 194
LEU A 203
 SAM  A 501 (-3.6A)
SAM  A 501 (-3.3A)
SAM  A 501 (-2.3A)
SAM  A 501 (-3.4A)
None
SAM  A 501 (-4.6A)
 0.77A 1jg2A-3vywA:
7.6		 1jg2A-3vywA:
25.62
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.
4b45 CELL DIVISION
PROTEIN FTSZ

(Haloferax
volcanii) 		PF00091
(Tubulin) 		5 GLY A 108
GLY A 102
LEU A 103
GLY A  71
VAL A  99
 GSP  A1342 (-4.0A)
GSP  A1342 ( 4.1A)
None
None
None
 1.16A 1jg2A-4b45A:
3.5		 1jg2A-4b45A:
19.71
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.
4b46 CELL DIVISION
PROTEIN FTSZ

(Haloferax
volcanii) 		PF00091
(Tubulin) 		5 GLY A 112
GLY A 106
LEU A 107
GLY A  75
VAL A 103
 GDP  A1368 (-3.5A)
GDP  A1368 (-3.6A)
None
None
None
 1.19A 1jg2A-4b46A:
undetectable		 1jg2A-4b46A:
20.80
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.
4e13 DIKETOREDUCTASE

(Acinetobacter
baylyi) 		PF00725
(3HCDH)
PF02737
(3HCDH_N) 		5 GLY A 108
ILE A 103
GLY A 134
ALA A 111
VAL A  83
 None
None
None
None
GOL  A 305 (-4.9A)
 1.20A 1jg2A-4e13A:
6.2		 1jg2A-4e13A:
24.92
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.
4h1g MALTOSE BINDING
PROTEIN-CAKAR3 MOTOR
DOMAIN FUSION
PROTEIN

(Candida
albicans;
Escherichia
coli) 		PF00225
(Kinesin)
PF13416
(SBP_bac_8) 		5 GLY A 485
ILE A 564
THR A 527
VAL A 525
LEU A 499
 None
 0.97A 1jg2A-4h1gA:
undetectable		 1jg2A-4h1gA:
15.69
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.
4hf0 HTH-TYPE
TRANSCRIPTIONAL
REGULATOR ISCR

(Escherichia
coli) 		PF02082
(Rrf2) 		5 GLY A  64
ILE A  31
GLY A  24
VAL A  55
LEU A  66
 None
 0.86A 1jg2A-4hf0A:
undetectable		 1jg2A-4hf0A:
23.83
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.
4jn6 ACETALDEHYDE
DEHYDROGENASE

(Mycobacterium
tuberculosis) 		PF01118
(Semialdhyde_dh)
PF09290
(AcetDehyd-dimer) 		5 GLY B 182
ILE B 135
GLY B 177
ALA B 184
VAL B 145
 None
 1.04A 1jg2A-4jn6B:
undetectable		 1jg2A-4jn6B:
23.03
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.
4jn6 ACETALDEHYDE
DEHYDROGENASE

(Mycobacterium
tuberculosis) 		PF01118
(Semialdhyde_dh)
PF09290
(AcetDehyd-dimer) 		5 GLY B 182
ILE B 206
GLY B 177
ALA B 184
VAL B 145
 None
 1.08A 1jg2A-4jn6B:
undetectable		 1jg2A-4jn6B:
23.03
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.
4k2x POLYKETIDE
OXYGENASE/HYDROXYLAS
E

(Streptomyces
rimosus) 		PF01494
(FAD_binding_3) 		5 GLY A 153
LEU A 165
GLY A 156
ALA A   8
VAL A 123
 None
None
FAD  A 601 (-3.5A)
FAD  A 601 ( 4.3A)
FAD  A 601 (-4.3A)
 1.19A 1jg2A-4k2xA:
3.1		 1jg2A-4k2xA:
19.17
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.
4kpr THIOREDOXIN
REDUCTASE 1,
CYTOPLASMIC

(Rattus
norvegicus) 		no annotation 5 GLY E  23
GLY E 333
ILE E 159
GLY E  20
ALA E  27
 FAD  E 505 (-3.6A)
FAD  E 505 (-3.3A)
None
FAD  E 505 ( 4.8A)
None
 1.15A 1jg2A-4kprE:
3.3		 1jg2A-4kprE:
18.76
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4l7v PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Vibrio cholerae) 		PF01135
(PCMT) 		11 GLY A  83
GLY A  85
GLU A 104
ILE A 106
LEU A 109
ASP A 131
GLY A 132
THR A 148
ALA A 149
VAL A 200
LEU A 202
 SAH  A 301 (-3.3A)
SAH  A 301 (-3.5A)
SAH  A 301 (-2.7A)
SAH  A 301 (-4.3A)
SAH  A 301 (-4.6A)
SAH  A 301 (-4.0A)
SAH  A 301 (-3.4A)
SAH  A 301 (-3.4A)
SAH  A 301 ( 4.1A)
None
SAH  A 301 (-4.3A)
 0.40A 1jg2A-4l7vA:
27.8		 1jg2A-4l7vA:
36.21
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4l7v PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Vibrio cholerae) 		PF01135
(PCMT) 		5 LEU A 159
GLY A 132
ALA A 151
VAL A 172
LEU A 202
 None
SAH  A 301 (-3.4A)
None
None
SAH  A 301 (-4.3A)
 0.99A 1jg2A-4l7vA:
27.8		 1jg2A-4l7vA:
36.21
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4o29 PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Pyrobaculum
aerophilum) 		PF01135
(PCMT) 		10 GLY A  80
GLY A  82
GLU A 104
LEU A 109
ASP A 132
GLY A 133
THR A 149
ALA A 150
VAL A 202
LEU A 204
 SAH  A 500 (-3.1A)
SAH  A 500 (-3.3A)
SAH  A 500 (-2.8A)
SAH  A 500 (-3.8A)
SAH  A 500 (-4.0A)
SAH  A 500 (-3.2A)
SAH  A 500 (-3.3A)
SAH  A 500 ( 4.5A)
None
SAH  A 500 (-4.3A)
 0.51A 1jg2A-4o29A:
33.0		 1jg2A-4o29A:
47.56
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.
4qgr DEGT/DNRJ/ERYC1/STRS
AMINOTRANSFERASE

(Brucella
abortus) 		PF01041
(DegT_DnrJ_EryC1) 		5 GLY A 200
ILE A 167
LEU A 193
ASP A 162
VAL A  52
 None
None
None
PLP  A 403 (-2.7A)
None
 1.22A 1jg2A-4qgrA:
undetectable		 1jg2A-4qgrA:
20.93
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.
4rqu ALCOHOL
DEHYDROGENASE

(Arabidopsis
thaliana) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 GLY A 209
GLY A 213
LEU A 187
GLY A 178
VAL A 269
 None
None
None
ZN  A 401 ( 4.8A)
None
 1.01A 1jg2A-4rquA:
6.5		 1jg2A-4rquA:
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.
4u7d ATP-DEPENDENT DNA
HELICASE Q1

(Homo sapiens) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF16124
(RecQ_Zn_bind) 		5 GLY A 317
ILE A 387
GLY A 403
ALA A 412
LEU A 286
 None
 0.89A 1jg2A-4u7dA:
4.1		 1jg2A-4u7dA:
19.56
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.
4uir OLEATE HYDRATASE

(Elizabethkingia
meningoseptica) 		PF06100
(MCRA) 		5 GLN A  97
GLY A  69
GLU A  96
LEU A  98
THR A 329
 FAD  A 701 (-4.2A)
FAD  A 701 (-3.4A)
FAD  A 701 (-3.6A)
FAD  A 701 (-4.3A)
FAD  A 701 (-4.4A)
 1.08A 1jg2A-4uirA:
4.0		 1jg2A-4uirA:
16.33
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.
4w8j PESTICIDAL CRYSTAL
PROTEIN CRY1AC

(Bacillus
thuringiensis) 		PF00555
(Endotoxin_M)
PF03944
(Endotoxin_C)
PF03945
(Endotoxin_N) 		5 GLY A 357
GLY A 355
ALA A 352
VAL A 351
LEU A 300
 None
 1.23A 1jg2A-4w8jA:
undetectable		 1jg2A-4w8jA:
11.90
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.
4wd3 L-AMINO ACID LIGASE

(Bacillus
subtilis) 		PF13535
(ATP-grasp_4) 		5 GLY A 101
GLY A  99
ILE A  77
THR A 104
ALA A 105
 None
 0.87A 1jg2A-4wd3A:
3.0		 1jg2A-4wd3A:
21.62
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.
4xhp PARM HYBRID FUSION
PROTEIN

(Bacillus
thuringiensis) 		no annotation 5 GLY A 377
GLY A 373
LEU A 237
ASP A 383
LEU A 345
 None
ADP  A 901 (-4.2A)
None
None
None
 1.15A 1jg2A-4xhpA:
undetectable		 1jg2A-4xhpA:
13.51
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.
5bxy RNA
METHYLTRANSFERASE

(Salinibacter
ruber) 		PF13847
(Methyltransf_31) 		5 GLY A  31
GLY A  33
GLU A  53
LEU A  58
ASP A  81
 SAH  A 201 (-3.4A)
SAH  A 201 (-3.4A)
SAH  A 201 (-2.8A)
SAH  A 201 (-4.4A)
SAH  A 201 (-3.6A)
 0.31A 1jg2A-5bxyA:
10.0		 1jg2A-5bxyA:
20.17
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.
5cx7 ATP:COB(I)ALAMIN
ADENOSYLTRANSFERASE

(Salmonella
enterica) 		PF03928
(Haem_degrading) 		5 GLN A 135
GLY A 107
GLY A 119
THR A  77
ALA A  76
 None
None
None
None
GOL  A 204 ( 4.0A)
 1.15A 1jg2A-5cx7A:
undetectable		 1jg2A-5cx7A:
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.
5f4b NAD(P)H
DEHYDROGENASE
(QUINONE)

(Brucella
abortus) 		PF03358
(FMN_red) 		5 GLY A  29
ILE A 193
GLY A  25
ALA A  31
VAL A   2
 None
 0.96A 1jg2A-5f4bA:
2.5		 1jg2A-5f4bA:
26.03
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.
5ldy IG DOMAIN PROTEIN
GROUP 1 DOMAIN
PROTEIN

(Yersinia
pseudotuberculosis) 		PF09134
(Invasin_D3) 		5 GLY A1883
ILE A1886
GLY A1813
THR A1810
ALA A1756
 None
 1.14A 1jg2A-5ldyA:
undetectable		 1jg2A-5ldyA:
19.72
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.
5lw3 POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE 6

(Azotobacter
vinelandii) 		no annotation 5 GLY A  12
GLY A  42
ILE A  75
ALA A  10
VAL A   5
 None
 0.98A 1jg2A-5lw3A:
undetectable		 1jg2A-5lw3A:
21.57
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.
5m60 BETA-1,3-GLUCANASE

(Chaetomium
thermophilum) 		PF12708
(Pectate_lyase_3) 		5 GLY A 421
GLY A 449
ILE A 473
ALA A 419
VAL A 414
 None
 0.94A 1jg2A-5m60A:
undetectable		 1jg2A-5m60A:
15.32
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.
5o4g RECEPTOR
TYROSINE-PROTEIN
KINASE ERBB-2

(Homo sapiens) 		no annotation 5 GLY C 386
GLY C 411
LEU C 414
GLY C 322
LEU C 352
 None
 1.20A 1jg2A-5o4gC:
undetectable		 1jg2A-5o4gC:
16.17
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.
5oak BAZOOKA, ISOFORM
C,LD29223P

(Drosophila
melanogaster) 		no annotation 5 GLY A  20
ILE A  11
ALA A  23
VAL A  35
LEU A  33
 None
 1.01A 1jg2A-5oakA:
undetectable		 1jg2A-5oakA:
19.11
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.
5ttk AMINE OXIDASE

(Pseudomonas
putida) 		PF01593
(Amino_oxidase) 		5 ILE A 448
GLY A 287
THR A 300
ALA A 301
VAL A  57
 None
 1.20A 1jg2A-5ttkA:
undetectable		 1jg2A-5ttkA:
18.29
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.
5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)

(Neisseria
gonorrhoeae) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 GLY A 128
GLY A 434
ILE A 265
GLY A 125
ALA A 132
 FAD  A 601 (-3.7A)
FAD  A 601 (-3.2A)
None
None
None
 1.19A 1jg2A-5u25A:
2.8		 1jg2A-5u25A:
16.53
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.
5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)

(Neisseria
gonorrhoeae) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 GLY A 129
GLY A 124
ILE A 265
LEU A 123
GLY A 450
 None
FAD  A 601 (-3.3A)
None
FAD  A 601 (-4.9A)
None
 0.85A 1jg2A-5u25A:
2.8		 1jg2A-5u25A:
16.53
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.
5u9m SUPEROXIDE DISMUTASE
1 COPPER CHAPERONE

(Saccharomyces
cerevisiae) 		PF00080
(Sod_Cu)
PF00403
(HMA) 		5 GLY B 213
ILE B 192
LEU B  84
ASP B 208
THR B 146
 None
 1.16A 1jg2A-5u9mB:
undetectable		 1jg2A-5u9mB:
20.75
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.
5vf5 SM80.1 VICILIN

(Solanum
melongena) 		no annotation 5 GLY A  69
GLY A 106
ALA A  71
VAL A 124
LEU A 103
 None
 1.14A 1jg2A-5vf5A:
undetectable		 1jg2A-5vf5A:
15.14
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.
5weo GLUTAMATE RECEPTOR
2,VOLTAGE-DEPENDENT
CALCIUM CHANNEL
GAMMA-2 SUBUNIT
CHIMERA

(Mus musculus;
Rattus
norvegicus) 		PF00060
(Lig_chan)
PF00822
(PMP22_Claudin)
PF01094
(ANF_receptor)
PF10613
(Lig_chan-Glu_bd) 		5 GLY A 470
GLY A 217
GLY A 465
ALA A 472
VAL A 396
 None
 1.18A 1jg2A-5weoA:
undetectable		 1jg2A-5weoA:
12.90
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.
6fik POLYKETIDE SYNTHASE

(Cercospora
nicotianae) 		no annotation 5 GLY A 121
GLY A  13
LEU A 339
THR A 124
ALA A 125
 None
 1.22A 1jg2A-6fikA:
undetectable		 1jg2A-6fikA:
23.40