SIMILAR PATTERNS OF AMINO ACIDS FOR 1SA1_B_PODB700_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.
1awb MYO-INOSITOL
MONOPHOSPHATASE

(Homo sapiens) 		PF00459
(Inositol_P) 		5 VAL A 193
LEU A 235
ALA A 252
ASN A 199
VAL A 148
 None
 1.09A 1sa1A-1awbA:
undetectable
1sa1B-1awbA:
undetectable		 1sa1A-1awbA:
21.51
1sa1B-1awbA:
18.36
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.
1dof ADENYLOSUCCINATE
LYASE

(Pyrobaculum
aerophilum) 		PF00206
(Lyase_1) 		5 VAL A 290
LEU A 170
ALA A 229
LEU A 226
ALA A 316
 None
 1.03A 1sa1A-1dofA:
undetectable
1sa1B-1dofA:
undetectable		 1sa1A-1dofA:
20.00
1sa1B-1dofA:
22.29
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.
1g38 MODIFICATION
METHYLASE TAQI

(Thermus
aquaticus) 		PF07669
(Eco57I)
PF12950
(TaqI_C) 		5 VAL A  27
ALA A  35
LEU A 103
ALA A  56
ALA A  60
 None
 1.17A 1sa1A-1g38A:
undetectable
1sa1B-1g38A:
undetectable		 1sa1A-1g38A:
20.39
1sa1B-1g38A:
21.18
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.
1ode CHORISMATE MUTASE

(Thermus
thermophilus) 		PF07736
(CM_1) 		5 LEU A  28
LEU A  31
ASN A  34
ALA A  92
VAL A  90
 None
 1.11A 1sa1A-1odeA:
undetectable
1sa1B-1odeA:
undetectable		 1sa1A-1odeA:
14.74
1sa1B-1odeA:
13.13
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.
1ode CHORISMATE MUTASE

(Thermus
thermophilus) 		PF07736
(CM_1) 		5 VAL A 103
LEU A  28
LEU A  31
ASN A  34
ALA A  92
 None
 0.98A 1sa1A-1odeA:
undetectable
1sa1B-1odeA:
undetectable		 1sa1A-1odeA:
14.74
1sa1B-1odeA:
13.13
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.
1ral 3-ALPHA-HYDROXYSTERO
ID DEHYDROGENASE

(Rattus
norvegicus) 		PF00248
(Aldo_ket_red) 		5 VAL A 234
LEU A 257
ALA A 256
LEU A 219
ALA A 245
 None
 1.07A 1sa1A-1ralA:
undetectable
1sa1B-1ralA:
2.1		 1sa1A-1ralA:
22.77
1sa1B-1ralA:
20.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1rhi HUMAN RHINOVIRUS 3
COAT PROTEIN

(Rhinovirus B) 		PF00073
(Rhv) 		5 LEU 2  82
ALA 2  85
LYS 2  87
LEU 2  86
VAL 2 242
 None
 1.16A 1sa1A-1rhi2:
undetectable
1sa1B-1rhi2:
undetectable		 1sa1A-1rhi2:
18.78
1sa1B-1rhi2:
21.39
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.
1t3q QUINOLINE
2-OXIDOREDUCTASE
MEDIUM SUBUNIT

(Pseudomonas
putida) 		PF00941
(FAD_binding_5)
PF03450
(CO_deh_flav_C) 		5 LEU C 199
ALA C 209
LEU C 230
ALA C 247
ALA C 212
 None
 1.06A 1sa1A-1t3qC:
undetectable
1sa1B-1t3qC:
undetectable		 1sa1A-1t3qC:
22.12
1sa1B-1t3qC:
22.67
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.
1u08 HYPOTHETICAL
AMINOTRANSFERASE
YBDL

(Escherichia
coli) 		PF00155
(Aminotran_1_2) 		5 VAL A 112
CYH A 248
ALA A 103
LEU A 104
ALA A 250
 None
 1.17A 1sa1A-1u08A:
undetectable
1sa1B-1u08A:
undetectable		 1sa1A-1u08A:
21.07
1sa1B-1u08A:
21.91
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.
1vb5 TRANSLATION
INITIATION FACTOR
EIF-2B

(Pyrococcus
horikoshii) 		PF01008
(IF-2B) 		5 LEU A  33
ALA A  85
LEU A  89
MET A  92
ALA A  25
 None
 1.08A 1sa1A-1vb5A:
undetectable
1sa1B-1vb5A:
undetectable		 1sa1A-1vb5A:
19.60
1sa1B-1vb5A:
20.18
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.
1ve5 THREONINE DEAMINASE

(Thermus
thermophilus) 		PF00291
(PALP) 		5 LEU A 198
ALA A 172
LEU A 294
ALA A 286
ALA A 175
 None
 1.08A 1sa1A-1ve5A:
undetectable
1sa1B-1ve5A:
undetectable		 1sa1A-1ve5A:
20.30
1sa1B-1ve5A:
20.53
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.
1wqa PHOSPHO-SUGAR MUTASE

(Pyrococcus
horikoshii) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		5 VAL A 337
LEU A  43
ALA A  92
VAL A  46
ALA A  96
 VAL  A 337 ( 0.6A)
LEU  A  43 ( 0.6A)
ALA  A  92 ( 0.0A)
VAL  A  46 ( 0.6A)
ALA  A  96 ( 0.0A)
 1.07A 1sa1A-1wqaA:
undetectable
1sa1B-1wqaA:
undetectable		 1sa1A-1wqaA:
23.84
1sa1B-1wqaA:
21.60
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.
1xqs HSPBP1 PROTEIN

(Homo sapiens) 		PF08609
(Fes1) 		5 VAL A 248
LEU A 195
ALA A 208
ALA A 238
VAL A 234
 None
 1.10A 1sa1A-1xqsA:
undetectable
1sa1B-1xqsA:
undetectable		 1sa1A-1xqsA:
20.54
1sa1B-1xqsA:
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.
2bji INOSITOL-1(OR
4)-MONOPHOSPHATASE

(Bos taurus) 		PF00459
(Inositol_P) 		5 VAL A1193
LEU A1235
ALA A1252
ASN A1199
VAL A1148
 None
 1.08A 1sa1A-2bjiA:
undetectable
1sa1B-2bjiA:
undetectable		 1sa1A-2bjiA:
20.96
1sa1B-2bjiA:
19.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2chr CHLOROMUCONATE
CYCLOISOMERASE

(Cupriavidus
necator) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 LEU A  75
ALA A  72
LEU A  71
VAL A  34
ALA A   8
 None
 1.16A 1sa1A-2chrA:
3.2
1sa1B-2chrA:
3.1		 1sa1A-2chrA:
23.01
1sa1B-2chrA:
22.62
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.
2csu 457AA LONG
HYPOTHETICAL PROTEIN

(Pyrococcus
horikoshii) 		PF13380
(CoA_binding_2)
PF13607
(Succ_CoA_lig) 		5 VAL A 345
LEU A 423
ALA A 408
ALA A 360
VAL A 397
 None
 1.14A 1sa1A-2csuA:
undetectable
1sa1B-2csuA:
2.7		 1sa1A-2csuA:
23.09
1sa1B-2csuA:
22.33
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.
2fsv NAD(P)
TRANSHYDROGENASE
SUBUNIT BETA

(Rhodospirillum
rubrum) 		PF02233
(PNTB) 		5 VAL C  78
ALA C 157
MET C  43
VAL C  52
ALA C  83
 None
 0.94A 1sa1A-2fsvC:
3.4
1sa1B-2fsvC:
3.8		 1sa1A-2fsvC:
17.79
1sa1B-2fsvC:
18.75
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.
2irw CORTICOSTEROID
11-BETA-DEHYDROGENAS
E ISOZYME 1

(Homo sapiens) 		PF00106
(adh_short) 		5 CYH A  78
LEU A  79
ALA A  83
MET A 110
ALA A  51
 None
 1.04A 1sa1A-2irwA:
6.9
1sa1B-2irwA:
7.0		 1sa1A-2irwA:
19.18
1sa1B-2irwA:
18.60
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.
2j2m CATALASE

(Exiguobacterium
oxidotolerans) 		PF00199
(Catalase)
PF06628
(Catalase-rel) 		5 VAL A 427
LEU A 331
ALA A 280
ASN A 175
MET A 176
 None
HEM  A 501 (-4.2A)
None
None
None
 1.07A 1sa1A-2j2mA:
undetectable
1sa1B-2j2mA:
undetectable		 1sa1A-2j2mA:
20.31
1sa1B-2j2mA:
21.58
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.
2job ANTILIPOPOLYSACCHARI
DE FACTOR

(Penaeus monodon) 		PF11630
(DUF3254) 		5 ALA A  85
MET A  53
ALA A  78
VAL A  14
ALA A  11
 None
 1.16A 1sa1A-2jobA:
undetectable
1sa1B-2jobA:
undetectable		 1sa1A-2jobA:
13.40
1sa1B-2jobA:
13.71
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.
2l7n TALIN-1

(Mus musculus) 		no annotation 5 CYH A1087
LEU A1091
ALA A1134
ALA A1140
LYS A1077
 None
 1.10A 1sa1A-2l7nA:
undetectable
1sa1B-2l7nA:
undetectable		 1sa1A-2l7nA:
18.75
1sa1B-2l7nA:
18.33
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.
2pg1 DYNEIN LIGHT CHAIN
TCTEX-TYPE

(Drosophila
melanogaster) 		PF03645
(Tctex-1) 		5 VAL E  37
CYH E  48
ALA E  22
ALA E  65
VAL E  63
 None
 1.12A 1sa1A-2pg1E:
undetectable
1sa1B-2pg1E:
undetectable		 1sa1A-2pg1E:
12.50
1sa1B-2pg1E:
13.45
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.
2qr6 IMP
DEHYDROGENASE/GMP
REDUCTASE

(Corynebacterium
glutamicum) 		PF00478
(IMPDH) 		5 LEU A 162
ALA A 140
ASN A  53
VAL A 143
ALA A  79
 None
 1.09A 1sa1A-2qr6A:
undetectable
1sa1B-2qr6A:
undetectable		 1sa1A-2qr6A:
22.06
1sa1B-2qr6A:
20.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qya UNCHARACTERIZED
CONSERVED PROTEIN

(Methanopyrus
kandleri) 		PF04242
(DUF424) 		5 ALA A  74
LEU A  19
ALA A  86
VAL A  84
ALA A  89
 None
 1.15A 1sa1A-2qyaA:
undetectable
1sa1B-2qyaA:
undetectable		 1sa1A-2qyaA:
12.64
1sa1B-2qyaA:
12.81
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.
2qya UNCHARACTERIZED
CONSERVED PROTEIN

(Methanopyrus
kandleri) 		PF04242
(DUF424) 		5 VAL A  70
ALA A  74
LEU A  19
VAL A  84
ALA A  89
 None
 1.05A 1sa1A-2qyaA:
undetectable
1sa1B-2qyaA:
undetectable		 1sa1A-2qyaA:
12.64
1sa1B-2qyaA:
12.81
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.
2r7m 5-FORMAMINOIMIDAZOLE
-4-CARBOXAMIDE-1-(BE
TA)-D-RIBOFURANOSYL
5'-MONOPHOSPHATE
SYNTHETASE

(Methanocaldococcus
jannaschii) 		PF06849
(DUF1246)
PF06973
(DUF1297) 		5 LEU A 137
ALA A 135
LYS A 281
LEU A 278
MET A 290
 None
 1.16A 1sa1A-2r7mA:
2.8
1sa1B-2r7mA:
undetectable		 1sa1A-2r7mA:
20.80
1sa1B-2r7mA:
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.
2w9m POLYMERASE X

(Deinococcus
radiodurans) 		PF14520
(HHH_5)
PF14716
(HHH_8) 		5 LEU A 177
ALA A 174
LEU A 173
ALA A 198
ALA A 185
 None
 1.06A 1sa1A-2w9mA:
undetectable
1sa1B-2w9mA:
undetectable		 1sa1A-2w9mA:
20.00
1sa1B-2w9mA:
21.54
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.
2woc ADP-RIBOSYL-[DINITRO
GEN REDUCTASE]
GLYCOHYDROLASE

(Rhodospirillum
rubrum) 		PF03747
(ADP_ribosyl_GH) 		5 VAL A 150
LEU A 293
ALA A 291
LEU A 140
VAL A 284
 None
 1.00A 1sa1A-2wocA:
undetectable
1sa1B-2wocA:
undetectable		 1sa1A-2wocA:
22.81
1sa1B-2wocA:
21.08
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.
3c4q PREDICTED
GLYCOSYLTRANSFERASES

(Corynebacterium
glutamicum) 		PF00534
(Glycos_transf_1)
PF13439
(Glyco_transf_4) 		5 LEU A 128
ALA A 165
LEU A 161
ALA A 132
ALA A 169
 None
 1.04A 1sa1A-3c4qA:
4.1
1sa1B-3c4qA:
6.0		 1sa1A-3c4qA:
23.09
1sa1B-3c4qA:
24.03
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.
3cmt PROTEIN RECA

(Escherichia
coli) 		PF00154
(RecA) 		5 VAL A1143
LEU A1166
ALA A1167
ALA A1174
ALA A1214
 None
 1.14A 1sa1A-3cmtA:
undetectable
1sa1B-3cmtA:
undetectable		 1sa1A-3cmtA:
14.81
1sa1B-3cmtA:
14.17
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.
3cmt PROTEIN RECA

(Escherichia
coli) 		PF00154
(RecA) 		5 VAL A2143
LEU A2166
ALA A2167
ALA A2174
ALA A2214
 None
 1.15A 1sa1A-3cmtA:
undetectable
1sa1B-3cmtA:
undetectable		 1sa1A-3cmtA:
14.81
1sa1B-3cmtA:
14.17
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.
3cmt PROTEIN RECA

(Escherichia
coli) 		PF00154
(RecA) 		5 VAL A3143
LEU A3166
ALA A3167
ALA A3174
ALA A3214
 None
 1.15A 1sa1A-3cmtA:
undetectable
1sa1B-3cmtA:
undetectable		 1sa1A-3cmtA:
14.81
1sa1B-3cmtA:
14.17
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.
3cze SUCROSE HYDROLASE

(Xanthomonas
citri) 		PF00128
(Alpha-amylase) 		6 VAL A 475
ALA A 458
LEU A 467
ALA A 497
VAL A 499
ALA A 451
 None
 1.34A 1sa1A-3czeA:
undetectable
1sa1B-3czeA:
undetectable		 1sa1A-3czeA:
20.83
1sa1B-3czeA:
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.
3dwf 11-BETA-HYDROXYSTERO
ID DEHYDROGENASE 1

(Cavia porcellus) 		PF00106
(adh_short) 		5 CYH A  78
LEU A  79
ALA A  83
MET A 110
ALA A  51
 None
 1.08A 1sa1A-3dwfA:
7.2
1sa1B-3dwfA:
7.1		 1sa1A-3dwfA:
20.82
1sa1B-3dwfA:
20.13
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.
3eoo METHYLISOCITRATE
LYASE

(Burkholderia
pseudomallei) 		PF13714
(PEP_mutase) 		5 LEU A 236
LEU A  86
VAL A  17
LYS A  12
ALA A  16
 None
 1.09A 1sa1A-3eooA:
2.7
1sa1B-3eooA:
undetectable		 1sa1A-3eooA:
21.06
1sa1B-3eooA:
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.
3gyq RRNA
(ADENOSINE-2'-O-)-ME
THYLTRANSFERASE

(Streptomyces
cyaneus) 		PF00588
(SpoU_methylase)
PF04705
(TSNR_N) 		5 VAL A 203
LEU A 121
LEU A 253
VAL A 118
ALA A 214
 None
 1.17A 1sa1A-3gyqA:
undetectable
1sa1B-3gyqA:
undetectable		 1sa1A-3gyqA:
20.68
1sa1B-3gyqA:
21.75
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.
3ijf CYTIDINE DEAMINASE

(Mycobacterium
tuberculosis) 		PF00383
(dCMP_cyt_deam_1) 		5 LEU X   9
ALA X  77
LEU X  76
ALA X  57
ALA X  17
 None
 1.12A 1sa1A-3ijfX:
undetectable
1sa1B-3ijfX:
undetectable		 1sa1A-3ijfX:
14.93
1sa1B-3ijfX:
15.51
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.
3is5 CALCIUM-DEPENDENT
PROTEIN KINASE

(Toxoplasma
gondii) 		PF00069
(Pkinase) 		6 LEU A 362
ALA A 366
LEU A 370
MET A 373
VAL A 237
ALA A 238
 None
 1.06A 1sa1A-3is5A:
undetectable
1sa1B-3is5A:
undetectable		 1sa1A-3is5A:
20.87
1sa1B-3is5A:
20.54
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.
3jbb ALLOPHYCOCYANIN BETA
CHAIN

(Halomicronema
hongdechloris) 		PF00502
(Phycobilisome) 		5 LEU B 153
ALA B  92
LEU B  89
VAL B 141
ALA B  40
 None
 1.10A 1sa1A-3jbbB:
undetectable
1sa1B-3jbbB:
undetectable		 1sa1A-3jbbB:
18.14
1sa1B-3jbbB:
17.67
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.
3kje CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE
COMPLEX, ACCESSORY
PROTEIN COOC

(Carboxydothermus
hydrogenoformans) 		PF01656
(CbiA) 		5 VAL A 186
LEU A 129
ALA A 153
ALA A   4
VAL A 135
 None
 1.03A 1sa1A-3kjeA:
3.4
1sa1B-3kjeA:
3.7		 1sa1A-3kjeA:
20.27
1sa1B-3kjeA:
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.
3lrk ALPHA-GALACTOSIDASE
1

(Saccharomyces
cerevisiae) 		PF16499
(Melibiase_2) 		5 LEU A 360
ALA A 358
ALA A 284
VAL A 286
ALA A 324
 None
 1.12A 1sa1A-3lrkA:
undetectable
1sa1B-3lrkA:
undetectable		 1sa1A-3lrkA:
20.97
1sa1B-3lrkA:
21.54
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.
3oee ATP SYNTHASE SUBUNIT
ALPHA

(Saccharomyces
cerevisiae) 		PF00006
(ATP-synt_ab)
PF00306
(ATP-synt_ab_C)
PF02874
(ATP-synt_ab_N) 		5 VAL A 101
LEU A 244
ALA A 112
LEU A 113
ALA A 131
 None
 1.17A 1sa1A-3oeeA:
3.0
1sa1B-3oeeA:
undetectable		 1sa1A-3oeeA:
21.22
1sa1B-3oeeA:
22.57
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.
3q34 YCEI-LIKE FAMILY
PROTEIN

(Pseudomonas
savastanoi) 		PF04264
(YceI) 		5 VAL A 182
LEU A 188
ALA A 186
LEU A  32
ALA A 133
 None
None
UQ8  A   1 ( 4.4A)
UQ8  A   1 (-4.3A)
UQ8  A   1 ( 3.9A)
 0.99A 1sa1A-3q34A:
undetectable
1sa1B-3q34A:
undetectable		 1sa1A-3q34A:
16.89
1sa1B-3q34A:
18.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rko NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT A
NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT J

(Escherichia
coli) 		PF00507
(Oxidored_q4)
no annotation 		5 LEU A  62
ALA A  66
LEU A  70
MET A  73
ALA J 155
 None
 1.06A 1sa1A-3rkoA:
undetectable
1sa1B-3rkoA:
undetectable		 1sa1A-3rkoA:
15.08
1sa1B-3rkoA:
14.51
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.
3stt METHYLKETONE
SYNTHASE I

(Solanum
habrochaites) 		PF12697
(Abhydrolase_6) 		5 ALA A  87
LEU A  88
VAL A 132
LYS A 127
ALA A 131
 DKA  A 266 (-3.4A)
DKA  A 266 (-4.2A)
None
None
None
 1.15A 1sa1A-3sttA:
3.0
1sa1B-3sttA:
3.1		 1sa1A-3sttA:
21.75
1sa1B-3sttA:
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.
3uve CARVEOL
DEHYDROGENASE
((+)-TRANS-CARVEOL
DEHYDROGENASE)

(Mycobacterium
avium) 		PF13561
(adh_short_C2) 		5 VAL A  79
LEU A 158
ALA A 106
ALA A 142
VAL A 144
 None
 1.16A 1sa1A-3uveA:
6.1
1sa1B-3uveA:
6.4		 1sa1A-3uveA:
20.40
1sa1B-3uveA:
20.53
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.
3va8 PROBABLE DEHYDRATASE

(Fusarium
graminearum) 		PF13378
(MR_MLE_C) 		5 VAL A 117
ALA A  64
LEU A  61
VAL A 107
ALA A 108
 None
 1.04A 1sa1A-3va8A:
3.1
1sa1B-3va8A:
3.1		 1sa1A-3va8A:
21.14
1sa1B-3va8A:
22.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zyx AMINE OXIDASE
[FLAVIN-CONTAINING]
B

(Homo sapiens) 		PF01593
(Amino_oxidase) 		5 LEU A  22
ALA A 447
LEU A 451
MET A 454
VAL A  30
 None
 0.98A 1sa1A-3zyxA:
undetectable
1sa1B-3zyxA:
undetectable		 1sa1A-3zyxA:
20.70
1sa1B-3zyxA:
20.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ak9 CPFTSY

(Physcomitrella
patens) 		PF00448
(SRP54)
PF02881
(SRP54_N) 		5 LEU A 213
ALA A 260
ALA A 296
VAL A 293
ALA A 300
 None
 1.08A 1sa1A-4ak9A:
3.3
1sa1B-4ak9A:
3.4		 1sa1A-4ak9A:
22.06
1sa1B-4ak9A:
23.18
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.
4apb FUMARATE HYDRATASE
CLASS II

(Mycobacterium
tuberculosis) 		PF00206
(Lyase_1)
PF10415
(FumaraseC_C) 		5 VAL A 250
LEU A  54
ALA A  53
LEU A  57
ALA A 151
 None
 1.18A 1sa1A-4apbA:
undetectable
1sa1B-4apbA:
undetectable		 1sa1A-4apbA:
23.58
1sa1B-4apbA:
20.78
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.
4as5 INOSITOL
MONOPHOSPHATASE 1

(Mus musculus) 		PF00459
(Inositol_P) 		5 VAL A 193
LEU A 235
ALA A 252
ASN A 199
VAL A 148
 None
 1.13A 1sa1A-4as5A:
undetectable
1sa1B-4as5A:
undetectable		 1sa1A-4as5A:
22.03
1sa1B-4as5A:
18.56
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.
4c1n CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE,
IRON-SULFUR PROTEIN

(Carboxydothermus
hydrogenoformans) 		PF03599
(CdhD) 		5 VAL B 243
CYH B  83
ALA B  88
ALA B  92
VAL B  53
 None
 1.03A 1sa1A-4c1nB:
undetectable
1sa1B-4c1nB:
undetectable		 1sa1A-4c1nB:
22.32
1sa1B-4c1nB:
21.88
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.
4chb KELCH-LIKE PROTEIN 2

(Homo sapiens) 		PF01344
(Kelch_1) 		5 VAL A 444
ALA A 419
LEU A 401
ALA A 471
ALA A 431
 None
 1.18A 1sa1A-4chbA:
undetectable
1sa1B-4chbA:
undetectable		 1sa1A-4chbA:
21.49
1sa1B-4chbA:
24.57
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.
4did INOSITOL PHOSPHATE
PHOSPHATASE SOPB

(Salmonella
enterica) 		PF05925
(IpgD) 		5 LEU B  98
ALA B  88
LYS B  93
LEU B  91
ALA B 161
 None
 1.17A 1sa1A-4didB:
undetectable
1sa1B-4didB:
undetectable		 1sa1A-4didB:
15.12
1sa1B-4didB:
15.96
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.
4dyk AMIDOHYDROLASE

(Pseudomonas
aeruginosa) 		PF01979
(Amidohydro_1) 		5 LEU A 346
ALA A 349
LEU A  68
ASN A  70
ALA A 326
 None
 1.14A 1sa1A-4dykA:
undetectable
1sa1B-4dykA:
undetectable		 1sa1A-4dykA:
22.82
1sa1B-4dykA:
21.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4dzh AMIDOHYDROLASE

(Xanthomonas
campestris) 		PF01979
(Amidohydro_1) 		5 LEU A 352
ALA A 355
LEU A  74
ASN A  76
ALA A 332
 None
 1.14A 1sa1A-4dzhA:
2.6
1sa1B-4dzhA:
2.7		 1sa1A-4dzhA:
22.05
1sa1B-4dzhA:
21.09
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.
4f32 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 2

(Burkholderia
vietnamiensis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 VAL A 412
ALA A 327
ASN A 413
VAL A 310
ALA A 312
 None
 1.16A 1sa1A-4f32A:
undetectable
1sa1B-4f32A:
undetectable		 1sa1A-4f32A:
23.01
1sa1B-4f32A:
20.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4go4 PUTATIVE
GAMMA-HYDROXYMUCONIC
SEMIALDEHYDE
DEHYDROGENASE

(Pseudomonas sp.
WBC-3) 		PF00171
(Aldedh) 		5 LEU A  68
ALA A 164
LEU A 163
ASN A 167
ALA A 463
 None
 1.17A 1sa1A-4go4A:
undetectable
1sa1B-4go4A:
undetectable		 1sa1A-4go4A:
22.98
1sa1B-4go4A:
21.92
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.
4gvl TRKA DOMAIN PROTEIN

(Geobacter
sulfurreducens) 		PF02080
(TrkA_C)
PF02254
(TrkA_N) 		5 VAL A 231
CYH A 212
LEU A 213
ALA A 239
ALA A 225
 None
 1.04A 1sa1A-4gvlA:
5.2
1sa1B-4gvlA:
4.7		 1sa1A-4gvlA:
21.51
1sa1B-4gvlA:
21.10
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.
4gx0 TRKA DOMAIN PROTEIN

(Geobacter
sulfurreducens) 		PF02080
(TrkA_C)
PF02254
(TrkA_N)
PF07885
(Ion_trans_2) 		5 VAL A 231
CYH A 212
LEU A 213
ALA A 239
ALA A 225
 None
 1.00A 1sa1A-4gx0A:
5.5
1sa1B-4gx0A:
5.2		 1sa1A-4gx0A:
23.78
1sa1B-4gx0A:
22.11
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.
4hq1 PROBABLE RECEPTOR
PROTEIN KINASE TMK1

(Arabidopsis
thaliana) 		PF00560
(LRR_1)
PF08263
(LRRNT_2)
PF13855
(LRR_8) 		5 LEU A 191
LEU A 216
ASN A 217
VAL A 172
ALA A 170
 None
 1.14A 1sa1A-4hq1A:
undetectable
1sa1B-4hq1A:
undetectable		 1sa1A-4hq1A:
20.23
1sa1B-4hq1A:
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.
4jg5 PUTATIVE CELL
ADHESION PROTEIN

(Parabacteroides
distasonis) 		PF06321
(P_gingi_FimA) 		5 ALA A  89
LEU A  86
ASN A  64
ALA A 112
ALA A  41
 None
 0.99A 1sa1A-4jg5A:
undetectable
1sa1B-4jg5A:
undetectable		 1sa1A-4jg5A:
23.04
1sa1B-4jg5A:
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.
4myd 2-SUCCINYL-6-HYDROXY
-2,4-CYCLOHEXADIENE-
1-CARBOXYLATE
SYNTHASE

(Escherichia
coli) 		PF12697
(Abhydrolase_6) 		5 LEU A 180
ALA A 177
LEU A 176
ASN A 172
VAL A 143
 None
 1.18A 1sa1A-4mydA:
4.4
1sa1B-4mydA:
3.9		 1sa1A-4mydA:
20.26
1sa1B-4mydA:
20.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4oo2 CHLOROPHENOL-4-MONOO
XYGENASE

(Streptomyces
globisporus) 		PF03241
(HpaB)
PF11794
(HpaB_N) 		5 ALA A 402
LEU A 405
MET A 443
ALA A 327
ALA A 333
 None
 1.17A 1sa1A-4oo2A:
undetectable
1sa1B-4oo2A:
undetectable		 1sa1A-4oo2A:
21.60
1sa1B-4oo2A:
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.
4piv FATTY ACID SYNTHASE

(Homo sapiens) 		PF08242
(Methyltransf_12)
PF08659
(KR) 		5 LEU A1336
ALA A1310
LYS A1241
LEU A1312
VAL A1245
 None
 1.14A 1sa1A-4pivA:
6.2
1sa1B-4pivA:
5.9		 1sa1A-4pivA:
21.02
1sa1B-4pivA:
20.09
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.
4qhr ALANINE RACEMASE

(Acinetobacter
baumannii) 		PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N) 		5 ALA A  48
LEU A  17
ASN A  16
VAL A  33
ALA A  37
 None
None
None
LLP  A  34 ( 3.3A)
None
 0.98A 1sa1A-4qhrA:
undetectable
1sa1B-4qhrA:
undetectable		 1sa1A-4qhrA:
21.24
1sa1B-4qhrA:
22.60
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.
4rvw ZNUD

(Neisseria
meningitidis) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		5 LEU A 537
ALA A 536
LEU A 535
ASN A 534
LYS A 476
 None
 1.17A 1sa1A-4rvwA:
undetectable
1sa1B-4rvwA:
undetectable		 1sa1A-4rvwA:
19.57
1sa1B-4rvwA:
20.29
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.
4ure CYCLOHEXANOL
DEHYDROGENASE

(Aromatoleum
aromaticum) 		PF13561
(adh_short_C2) 		5 ALA A 224
MET A   1
VAL A  32
LYS A   6
ALA A   8
 None
 1.05A 1sa1A-4ureA:
5.6
1sa1B-4ureA:
6.7		 1sa1A-4ureA:
21.54
1sa1B-4ureA:
18.42
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.
4wer DIACYLGLYCEROL
KINASE CATALYTIC
DOMAIN PROTEIN

(Enterococcus
faecalis) 		PF00781
(DAGK_cat) 		6 VAL A 135
LEU A 103
ALA A  98
LEU A  97
ASN A 134
MET A 133
 None
 1.47A 1sa1A-4werA:
undetectable
1sa1B-4werA:
undetectable		 1sa1A-4werA:
21.79
1sa1B-4werA:
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.
4yei BETA1MUT

(synthetic
construct) 		PF00805
(Pentapeptide) 		5 LEU A 127
ALA A 130
LEU A 112
ASN A 111
ALA A  90
 None
 1.14A 1sa1A-4yeiA:
undetectable
1sa1B-4yeiA:
undetectable		 1sa1A-4yeiA:
17.90
1sa1B-4yeiA:
19.96
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.
4yxx DTOR_6X35L

(synthetic
construct) 		no annotation 5 LEU A 133
ALA A 132
LEU A 143
LYS A 116
ALA A 118
 None
 1.10A 1sa1A-4yxxA:
undetectable
1sa1B-4yxxA:
undetectable		 1sa1A-4yxxA:
19.96
1sa1B-4yxxA:
21.22
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.
4zyj DNMZ

(Streptomyces
peucetius) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		5 VAL A  12
LEU A 265
LEU A 307
ALA A 272
ALA A  94
 None
 1.15A 1sa1A-4zyjA:
undetectable
1sa1B-4zyjA:
undetectable		 1sa1A-4zyjA:
24.22
1sa1B-4zyjA:
20.74
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.
5a2e T-CELL
DIFFERENTIATION
ANTIGEN CD6

(Homo sapiens) 		PF00530
(SRCR) 		5 ALA A  78
LEU A 127
ALA A 151
VAL A 153
ALA A  94
 None
 0.94A 1sa1A-5a2eA:
undetectable
1sa1B-5a2eA:
undetectable		 1sa1A-5a2eA:
19.14
1sa1B-5a2eA:
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.
5dbk TRANSCRIPTIONAL
REGULATOR/TPR DOMAIN
PROTEIN

(Bacillus
thuringiensis) 		PF13424
(TPR_12) 		5 LEU A 299
ALA A 270
LEU A 273
ASN A 275
MET A 276
 None
 1.17A 1sa1A-5dbkA:
undetectable
1sa1B-5dbkA:
undetectable		 1sa1A-5dbkA:
22.34
1sa1B-5dbkA:
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.
5e9u GLYCOSYLTRANSFERASE
GTF1

(Streptococcus
gordonii) 		PF00534
(Glycos_transf_1) 		5 VAL A 305
ALA A 413
LEU A 410
VAL A 480
ALA A 481
 NAG  A 602 ( 4.7A)
None
None
None
None
 1.02A 1sa1A-5e9uA:
4.7
1sa1B-5e9uA:
4.7		 1sa1A-5e9uA:
21.28
1sa1B-5e9uA:
22.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ehk LANTIBIOTIC
DEHYDRATASE

(Microbispora
corallina) 		PF04738
(Lant_dehydr_N)
PF14028
(Lant_dehydr_C) 		5 VAL A 269
ALA A 277
LEU A 282
ALA A 251
VAL A 195
 None
 1.04A 1sa1A-5ehkA:
undetectable
1sa1B-5ehkA:
undetectable		 1sa1A-5ehkA:
17.29
1sa1B-5ehkA:
17.47
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.
5eue PUTATIVE
SPHINGOSINE-1-PHOSPH
ATE LYASE

(Symbiobacterium
thermophilum) 		PF00282
(Pyridoxal_deC) 		5 ALA A 207
LEU A 172
ALA A 243
VAL A 241
ALA A 194
 None
 1.12A 1sa1A-5eueA:
undetectable
1sa1B-5eueA:
undetectable		 1sa1A-5eueA:
21.85
1sa1B-5eueA:
21.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5guw NITRIC OXIDE
REDUCTASE SUBUNIT C

(Pseudomonas
aeruginosa) 		PF00034
(Cytochrom_C) 		5 LEU A  95
ALA A 126
LYS A 130
LEU A 129
VAL A  55
 None
 1.06A 1sa1A-5guwA:
undetectable
1sa1B-5guwA:
undetectable		 1sa1A-5guwA:
15.78
1sa1B-5guwA:
14.32
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.
5h6o PORPHOBILINOGEN
DEAMINASE

(Vibrio cholerae) 		no annotation 6 VAL A 202
LEU A 244
ASN A 241
MET A 240
ALA A 267
VAL A 278
 None
 1.26A 1sa1A-5h6oA:
undetectable
1sa1B-5h6oA:
undetectable		 1sa1A-5h6oA:
20.52
1sa1B-5h6oA:
22.12
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.
5haf DEUBIQUITINASE SSEL

(Salmonella
enterica) 		no annotation 5 CYH A  48
ALA A  51
ALA A 118
VAL A  89
ALA A  86
 None
 1.12A 1sa1A-5hafA:
undetectable
1sa1B-5hafA:
undetectable		 1sa1A-5hafA:
20.48
1sa1B-5hafA:
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.
5ie2 OXALATE--COA LIGASE

(Arabidopsis
thaliana) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		5 VAL A 341
LEU A   6
ALA A 188
LYS A 192
ASN A 193
 None
 1.11A 1sa1A-5ie2A:
undetectable
1sa1B-5ie2A:
undetectable		 1sa1A-5ie2A:
22.42
1sa1B-5ie2A:
21.13
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.
5imu TAT (TWIN-ARGININE
TRANSLOCATION)
PATHWAY SIGNAL
SEQUENCE CONTAINING
PROTEIN

(Mycobacterium
tuberculosis) 		no annotation 5 LEU A 393
ALA A 377
LEU A 374
ALA A 329
VAL A 333
 None
 1.12A 1sa1A-5imuA:
undetectable
1sa1B-5imuA:
undetectable		 1sa1A-5imuA:
18.40
1sa1B-5imuA:
20.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jpn COMPLEMENT C4-A

(Homo sapiens) 		PF00207
(A2M)
PF01821
(ANATO)
PF07678
(A2M_comp)
PF10569
(Thiol-ester_cl) 		5 ALA B1213
LEU B1200
ALA B1143
VAL B1139
ALA B1192
 None
 1.06A 1sa1A-5jpnB:
undetectable
1sa1B-5jpnB:
undetectable		 1sa1A-5jpnB:
20.00
1sa1B-5jpnB:
20.18
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.
5mkk MULTIDRUG RESISTANCE
ABC TRANSPORTER
ATP-BINDING AND
PERMEASE PROTEIN

(Thermus
thermophilus) 		PF00005
(ABC_tran)
PF00664
(ABC_membrane) 		5 VAL A 466
ALA A 506
LEU A 505
ALA A 475
ALA A 539
 None
 1.16A 1sa1A-5mkkA:
undetectable
1sa1B-5mkkA:
undetectable		 1sa1A-5mkkA:
20.26
1sa1B-5mkkA:
20.73
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5n5n TUBULIN BETA CHAIN

(Homo sapiens) 		no annotation 5 ALA B 250
LEU B 255
ASN B 258
MET B 259
ALA B 316
 None
 1.11A 1sa1A-5n5nB:
50.6
1sa1B-5n5nB:
53.1		 1sa1A-5n5nB:
40.88
1sa1B-5n5nB:
97.89
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5n5n TUBULIN BETA CHAIN

(Homo sapiens) 		no annotation 5 CYH B 241
LEU B 242
LEU B 252
VAL B 318
ALA B 354
 None
 1.02A 1sa1A-5n5nB:
50.6
1sa1B-5n5nB:
53.1		 1sa1A-5n5nB:
40.88
1sa1B-5n5nB:
97.89
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.
5tch TRYPTOPHAN SYNTHASE
BETA CHAIN

(Mycobacterium
tuberculosis) 		PF00291
(PALP) 		6 VAL B 215
LEU B 139
ALA B 136
LEU B 106
ASN B 104
ALA B 112
 None
 1.40A 1sa1A-5tchB:
undetectable
1sa1B-5tchB:
undetectable		 1sa1A-5tchB:
23.20
1sa1B-5tchB:
22.13
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.
5v2i GLYCOSYLASPARAGINASE

(Elizabethkingia
meningoseptica) 		PF01112
(Asparaginase_2) 		5 LEU A 164
ALA A 199
LEU A 260
VAL A  35
ALA A 167
 None
 1.01A 1sa1A-5v2iA:
undetectable
1sa1B-5v2iA:
undetectable		 1sa1A-5v2iA:
20.39
1sa1B-5v2iA:
20.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5vrf CADMIUM AND ZINC
EFFLUX PUMP FIEF

(Shewanella
oneidensis) 		no annotation 5 LEU B 118
ALA B  32
LEU B  31
VAL B 125
ALA B 126
 None
 1.14A 1sa1A-5vrfB:
undetectable
1sa1B-5vrfB:
undetectable		 1sa1A-5vrfB:
10.93
1sa1B-5vrfB:
9.89
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.
5wc1 MEIOTIC SPINDLE
FORMATION PROTEIN
MEI-1

(Caenorhabditis
elegans) 		PF00004
(AAA) 		5 LEU A 318
LEU A 349
ALA A 337
VAL A 335
ALA A 228
 None
 1.02A 1sa1A-5wc1A:
undetectable
1sa1B-5wc1A:
undetectable		 1sa1A-5wc1A:
21.51
1sa1B-5wc1A:
21.72
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.
5wdx JFH-1 NS3

(Hepacivirus C) 		no annotation 5 CYH A 622
ALA A 625
LEU A 627
VAL A 535
ALA A 534
 None
 1.17A 1sa1A-5wdxA:
undetectable
1sa1B-5wdxA:
undetectable		 1sa1A-5wdxA:
21.00
1sa1B-5wdxA:
21.81
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.
5wp6 TRANSIENT RECEPTOR
POTENTIAL CATION
CHANNEL SUBFAMILY M
MEMBER 4

(Homo sapiens) 		no annotation 5 LEU A 138
ALA A 169
ASN A 228
ALA A 185
ALA A 146
 None
 1.12A 1sa1A-5wp6A:
3.0
1sa1B-5wp6A:
3.2		 1sa1A-5wp6A:
11.65
1sa1B-5wp6A:
11.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5wte VP3

(Hepatovirus A) 		PF00073
(Rhv) 		5 VAL C 224
LEU C 231
ALA C 228
LEU C 115
ALA C 100
 None
 1.14A 1sa1A-5wteC:
undetectable
1sa1B-5wteC:
undetectable		 1sa1A-5wteC:
18.78
1sa1B-5wteC:
18.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5x6x MRNA CAPPING ENZYME
P5

(Rice dwarf
virus) 		no annotation 5 VAL C 609
LEU C 500
ALA C 567
LEU C 564
ALA C 506
 None
 1.03A 1sa1A-5x6xC:
undetectable
1sa1B-5x6xC:
undetectable		 1sa1A-5x6xC:
14.07
1sa1B-5x6xC:
11.92
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.
5xzx IMPORTIN SUBUNIT
ALPHA-3

(Homo sapiens) 		PF00514
(Arm)
PF16186
(Arm_3) 		5 CYH A 122
LEU A 123
ALA A 135
LEU A 139
ALA A  80
 None
 1.03A 1sa1A-5xzxA:
undetectable
1sa1B-5xzxA:
undetectable		 1sa1A-5xzxA:
23.66
1sa1B-5xzxA:
21.80
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.
6b5d MEIOTIC SPINDLE
FORMATION PROTEIN
MEI-1

(Caenorhabditis
elegans) 		no annotation 5 LEU A 318
LEU A 349
ALA A 337
VAL A 335
ALA A 228
 None
 1.08A 1sa1A-6b5dA:
undetectable
1sa1B-6b5dA:
undetectable		 1sa1A-6b5dA:
12.13
1sa1B-6b5dA:
10.93
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.
6bc5 AAC 3-VI PROTEIN

(Enterobacter
cloacae) 		no annotation 5 VAL A 185
ALA A 166
LEU A 169
VAL A 194
ALA A 193
 None
 1.14A 1sa1A-6bc5A:
undetectable
1sa1B-6bc5A:
undetectable		 1sa1A-6bc5A:
11.92
1sa1B-6bc5A:
14.29
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.
6bfi VIN1

(Oscarella
pearsei) 		no annotation 5 LEU A 736
LEU A 691
ALA A 681
VAL A 677
ALA A 699
 None
 1.18A 1sa1A-6bfiA:
undetectable
1sa1B-6bfiA:
undetectable		 1sa1A-6bfiA:
12.05
1sa1B-6bfiA:
12.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6cyz HOMOSERINE KINASE

(Mycobacteroides
abscessus) 		no annotation 5 VAL A 251
LEU A  22
LEU A 272
ALA A 270
ALA A 267
 None
 1.15A 1sa1A-6cyzA:
undetectable
1sa1B-6cyzA:
undetectable		 1sa1A-6cyzA:
11.42
1sa1B-6cyzA:
12.80
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.
6fah CAFFEYL-COA
REDUCTASE-ETF
COMPLEX SUBUNIT CARD

(Acetobacterium
woodii) 		no annotation 5 VAL B 112
CYH B  74
LEU B  75
ALA B  79
ALA B   7
 None
 1.05A 1sa1A-6fahB:
undetectable
1sa1B-6fahB:
undetectable		 1sa1A-6fahB:
10.73
1sa1B-6fahB:
12.06