SIMILAR PATTERNS OF AMINO ACIDS FOR 3OU6_C_SAMC300_0

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.
1bev BOVINE ENTEROVIRUS
COAT PROTEINS VP1 TO
VP4
BOVINE ENTEROVIRUS
COAT PROTEINS VP1 TO
VP4

(Enterovirus E;
Enterovirus E) 		PF00073
(Rhv)
PF00073
(Rhv) 		5 GLY 3 100
SER 3  95
LEU 3 102
ALA 1 107
TRP 1 111
 None
 1.26A 3ou6C-1bev3:
undetectable		 3ou6C-1bev3:
20.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1h4u NIDOGEN-1

(Mus musculus) 		PF07474
(G2F) 		5 LEU A 623
GLU A 471
ALA A 469
GLY A 465
LEU A 603
 None
 1.18A 3ou6C-1h4uA:
undetectable		 3ou6C-1h4uA:
22.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ni6 HEME OXYGENASE 1

(Homo sapiens) 		PF01126
(Heme_oxygenase) 		5 GLU A  29
GLY A 143
SER A 142
LEU A 147
ALA A  28
 None
 1.18A 3ou6C-1ni6A:
undetectable		 3ou6C-1ni6A:
19.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1o0s NAD-DEPENDENT MALIC
ENZYME

(Ascaris suum) 		PF00390
(malic)
PF03949
(Malic_M) 		5 GLY A 327
SER A 406
ASP A 361
LEU A 359
ALA A 401
 NAI  A 920 (-3.5A)
NAI  A 920 ( 4.7A)
NAI  A 920 (-4.5A)
None
None
 1.28A 3ou6C-1o0sA:
undetectable		 3ou6C-1o0sA:
16.92
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.
1rcq CATABOLIC ALANINE
RACEMASE DADX

(Pseudomonas
aeruginosa) 		PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N) 		5 GLU A  46
ALA A  47
GLY A 356
ASP A   9
ALA A  49
 None
 1.18A 3ou6C-1rcqA:
undetectable		 3ou6C-1rcqA:
25.70
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.
1uar RHODANESE

(Thermus
thermophilus) 		PF00581
(Rhodanese) 		5 TYR A   3
GLU A 226
GLY A 258
LEU A 253
ALA A 223
 None
 1.07A 3ou6C-1uarA:
undetectable		 3ou6C-1uarA:
20.97
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.
1w1k VANILLYL-ALCOHOL
OXIDASE

(Penicillium
simplicissimum) 		PF01565
(FAD_binding_4)
PF02913
(FAD-oxidase_C) 		5 ALA A 112
GLY A 109
SER A 106
LEU A 507
ALA A  71
 None
None
FAD  A1561 ( 4.5A)
None
None
 1.04A 3ou6C-1w1kA:
undetectable		 3ou6C-1w1kA:
18.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1yjk PEPTIDYL-GLYCINE
ALPHA-AMIDATING
MONOOXYGENASE

(Rattus
norvegicus) 		PF01082
(Cu2_monooxygen)
PF03712
(Cu2_monoox_C) 		5 LEU A 317
ALA A 290
GLY A 252
SER A 251
ALA A 339
 None
 1.14A 3ou6C-1yjkA:
undetectable		 3ou6C-1yjkA:
20.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1yjk PEPTIDYL-GLYCINE
ALPHA-AMIDATING
MONOOXYGENASE

(Rattus
norvegicus) 		PF01082
(Cu2_monooxygen)
PF03712
(Cu2_monoox_C) 		5 LEU A 317
GLY A 252
SER A 251
LEU A 289
ALA A 339
 None
 1.27A 3ou6C-1yjkA:
undetectable		 3ou6C-1yjkA:
20.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2eba PUTATIVE
GLUTARYL-COA
DEHYDROGENASE

(Thermus
thermophilus) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		5 LEU A 298
GLU A 289
GLY A 297
LEU A 256
ALA A 288
 None
 1.05A 3ou6C-2ebaA:
undetectable		 3ou6C-2ebaA:
20.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fv0 UNSATURATED
GLUCURONYL HYDROLASE

(Bacillus sp.
GL1) 		PF07470
(Glyco_hydro_88) 		5 LEU A  53
ALA A  99
GLY A 370
LEU A  95
ALA A 109
 None
 1.26A 3ou6C-2fv0A:
undetectable		 3ou6C-2fv0A:
22.05
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.
2iuc ALKALINE PHOSPHATASE

(Antarctic
bacterium TAB5) 		PF00245
(Alk_phosphatase) 		5 ALA B 167
GLY B 169
SER B 131
LEU B 215
ALA B 238
 None
 1.27A 3ou6C-2iucB:
undetectable		 3ou6C-2iucB:
21.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2iuc ALKALINE PHOSPHATASE

(Antarctic
bacterium TAB5) 		PF00245
(Alk_phosphatase) 		5 ALA B 167
GLY B 169
SER B 132
LEU B 215
ALA B 238
 None
 1.24A 3ou6C-2iucB:
undetectable		 3ou6C-2iucB:
21.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2j0a BETA-1,3-N-ACETYLGLU
COSAMINYLTRANSFERASE
MANIC FRINGE

(Mus musculus) 		PF02434
(Fringe) 		5 ALA A 215
GLY A 217
SER A 218
LEU A 119
ALA A 208
 None
 1.22A 3ou6C-2j0aA:
undetectable		 3ou6C-2j0aA:
22.56
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.
2jah CLAVULANIC ACID
DEHYDROGENASE

(Streptomyces
clavuligerus) 		PF00106
(adh_short) 		5 ALA A  92
GLY A 118
MET A 122
ASP A 113
ALA A  15
 NDP  A1248 (-3.5A)
None
None
None
None
 1.31A 3ou6C-2jahA:
6.0		 3ou6C-2jahA:
26.10
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.
2jbm NICOTINATE-NUCLEOTID
E PYROPHOSPHORYLASE

(Homo sapiens) 		PF01729
(QRPTase_C)
PF02749
(QRPTase_N) 		5 LEU A  69
TRP A  49
GLY A 102
LEU A 100
ALA A  47
 None
 1.29A 3ou6C-2jbmA:
undetectable		 3ou6C-2jbmA:
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.
2ox4 PUTATIVE MANDELATE
RACEMASE

(Zymomonas
mobilis) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 GLU A  37
ALA A  38
GLY A  92
LEU A  53
ALA A  41
 None
 1.16A 3ou6C-2ox4A:
undetectable		 3ou6C-2ox4A:
19.22
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.
2pcq PUTATIVE
DIHYDRODIPICOLINATE
SYNTHASE

(Thermus
thermophilus) 		PF00701
(DHDPS) 		5 LEU A  36
GLU A  83
GLY A  68
LEU A  92
ALA A  86
 None
 1.25A 3ou6C-2pcqA:
undetectable		 3ou6C-2pcqA:
23.08
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.
2qyt 2-DEHYDROPANTOATE
2-REDUCTASE

(Porphyromonas
gingivalis) 		PF02558
(ApbA)
PF08546
(ApbA_C) 		5 LEU A  65
GLU A  47
ALA A  48
GLY A  53
ALA A  44
 None
 1.30A 3ou6C-2qytA:
4.7		 3ou6C-2qytA:
23.89
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.
2r4i UNCHARACTERIZED
PROTEIN

(Cytophaga
hutchinsonii) 		PF14534
(DUF4440) 		5 TYR A  53
GLU A  88
ALA A  59
GLY A  56
SER A  55
 IPA  A 127 (-4.6A)
None
None
None
None
 1.23A 3ou6C-2r4iA:
undetectable		 3ou6C-2r4iA:
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.
2uy3 ENDOCHITINASE

(Saccharomyces
cerevisiae) 		PF00704
(Glyco_hydro_18) 		5 TYR A 214
ALA A 254
GLY A 256
SER A 257
ALA A 290
 H33  A1311 (-4.7A)
None
None
None
None
 1.14A 3ou6C-2uy3A:
undetectable		 3ou6C-2uy3A:
20.27
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.
2v7b BENZOATE-COENZYME A
LIGASE

(Paraburkholderia
xenovorans) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		5 LEU A 116
TYR A 112
ALA A 126
LEU A 148
ALA A 129
 None
 1.23A 3ou6C-2v7bA:
undetectable		 3ou6C-2v7bA:
17.89
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.
2vsa MOSQUITOCIDAL TOXIN

(Lysinibacillus
sphaericus) 		PF05588
(Botulinum_HA-17)
PF14200
(RicinB_lectin_2) 		5 LEU A 359
GLY A 376
SER A 323
LEU A 361
TRP A 338
 None
 1.29A 3ou6C-2vsaA:
undetectable		 3ou6C-2vsaA:
12.41
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.
2w9m POLYMERASE X

(Deinococcus
radiodurans) 		PF14520
(HHH_5)
PF14716
(HHH_8) 		5 LEU A 420
GLU A 487
GLY A 399
SER A 400
ASP A 421
 None
 1.31A 3ou6C-2w9mA:
undetectable		 3ou6C-2w9mA:
20.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2x26 PERIPLASMIC
ALIPHATIC
SULPHONATES-BINDING
PROTEIN

(Escherichia
coli) 		PF09084
(NMT1) 		5 GLU A  71
ALA A  91
GLY A  95
ASP A  97
LEU A  98
 None
 1.22A 3ou6C-2x26A:
undetectable		 3ou6C-2x26A:
23.27
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.
2yys PROLINE
IMINOPEPTIDASE-RELAT
ED PROTEIN

(Thermus
thermophilus) 		PF12697
(Abhydrolase_6) 		5 GLU A  12
ALA A  13
GLY A  62
ASP A  59
LEU A  15
 None
 1.23A 3ou6C-2yysA:
undetectable		 3ou6C-2yysA:
24.51
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.
2z2n VIRGINIAMYCIN B
LYASE

(Staphylococcus
aureus) 		no annotation 5 LEU A 196
ALA A 153
GLY A 149
SER A 150
LEU A 154
 None
 1.01A 3ou6C-2z2nA:
undetectable		 3ou6C-2z2nA:
18.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2z37 CHITINASE

(Brassica juncea) 		PF00182
(Glyco_hydro_19) 		5 TYR A 258
ALA A 289
SER A 266
MET A 264
LEU A 282
 None
 1.11A 3ou6C-2z37A:
undetectable		 3ou6C-2z37A:
21.34
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.
2zec TRYPTASE BETA 2

(Homo sapiens) 		PF00089
(Trypsin) 		5 LEU A  33
ALA A  57
TRP A 229
GLY A  46
ALA A 101
 None
 1.21A 3ou6C-2zecA:
undetectable		 3ou6C-2zecA:
20.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3a5k TYROSINE-PROTEIN
PHOSPHATASE
NON-RECEPTOR TYPE 1

(Homo sapiens) 		PF00102
(Y_phosphatase) 		5 LEU A 227
GLU A 276
ALA A 273
LEU A 232
ALA A 189
 None
 1.30A 3ou6C-3a5kA:
undetectable		 3ou6C-3a5kA:
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.
3afl OLIGO ALGINATE LYASE

(Agrobacterium
fabrum) 		PF07940
(Hepar_II_III)
PF16332
(DUF4962) 		5 ALA A 376
SER A 382
ASP A 387
LEU A 388
ALA A 318
 None
 1.07A 3ou6C-3aflA:
undetectable		 3ou6C-3aflA:
14.95
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.
3asu SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE SDR

(Escherichia
coli) 		PF00106
(adh_short) 		5 ALA A  82
GLY A 109
MET A 113
ASP A 104
ALA A   8
 None
 1.24A 3ou6C-3asuA:
6.1		 3ou6C-3asuA:
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.
3dla GLUTAMINE-DEPENDENT
NAD(+) SYNTHETASE

(Mycobacterium
tuberculosis) 		PF00795
(CN_hydrolase)
PF02540
(NAD_synthase) 		5 ALA A 198
SER A 186
MET A 179
LEU A 171
ALA A  16
 None
 1.20A 3ou6C-3dlaA:
3.5		 3ou6C-3dlaA:
16.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3e23 UNCHARACTERIZED
PROTEIN RPA2492

(Rhodopseudomonas
palustris) 		PF08241
(Methyltransf_11) 		5 LEU A  14
TYR A  17
GLU A  49
GLY A  73
SER A  74
 SAM  A 221 (-4.4A)
SAM  A 221 (-3.8A)
None
SAM  A 221 (-3.2A)
SAM  A 221 (-4.6A)
 0.75A 3ou6C-3e23A:
19.1		 3ou6C-3e23A:
27.03
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.
3e48 PUTATIVE
NUCLEOSIDE-DIPHOSPHA
TE-SUGAR EPIMERASE

(Staphylococcus
aureus) 		PF13460
(NAD_binding_10) 		5 TYR A 171
ALA A 141
GLY A 199
ASP A 176
ALA A 108
 None
 1.30A 3ou6C-3e48A:
4.5		 3ou6C-3e48A:
19.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3h7n NUCLEOPORIN NUP120

(Saccharomyces
cerevisiae) 		PF11715
(Nup160) 		5 LEU A 205
TYR A 204
GLY A 181
LEU A 183
TRP A 246
 None
 1.29A 3ou6C-3h7nA:
undetectable		 3ou6C-3h7nA:
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.
3ico 6-PHOSPHOGLUCONOLACT
ONASE

(Mycobacterium
tuberculosis) 		PF01182
(Glucosamine_iso) 		5 GLU A  72
TRP A  69
SER A 176
ASP A 174
LEU A 116
 None
 1.23A 3ou6C-3icoA:
undetectable		 3ou6C-3icoA:
23.57
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.
3if9 GLYCINE OXIDASE

(Bacillus
subtilis) 		PF01266
(DAO) 		5 LEU A 220
GLU A 225
GLY A 264
LEU A 301
ALA A 259
 None
None
None
None
GOA  A 370 ( 4.0A)
 1.20A 3ou6C-3if9A:
2.9		 3ou6C-3if9A:
22.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3iup PUTATIVE
NADPH:QUINONE
OXIDOREDUCTASE

(Cupriavidus
pinatubonensis) 		no annotation 5 LEU A 284
TYR A 285
GLY A 248
LEU A 252
ALA A 180
 None
NDP  A 401 (-4.0A)
None
None
NDP  A 401 ( 4.1A)
 1.29A 3ou6C-3iupA:
2.9		 3ou6C-3iupA:
19.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kci PROBABLE E3
UBIQUITIN-PROTEIN
LIGASE HERC2

(Homo sapiens) 		PF00415
(RCC1) 		5 LEU A4132
GLU A4065
ALA A4066
GLY A4069
LEU A4071
 None
 1.30A 3ou6C-3kciA:
undetectable		 3ou6C-3kciA:
19.10
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.
3kje CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE
COMPLEX, ACCESSORY
PROTEIN COOC

(Carboxydothermus
hydrogenoformans) 		PF01656
(CbiA) 		5 LEU A 242
ALA A  17
GLY A  19
MET A  24
ALA A   4
 None
 1.31A 3ou6C-3kjeA:
undetectable		 3ou6C-3kjeA:
19.69
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.
3l6v DNA GYRASE SUBUNIT A

(Xanthomonas
campestris) 		PF03989
(DNA_gyraseA_C) 		5 ALA A 776
GLY A 824
SER A 825
LEU A 822
ALA A 793
 None
 1.27A 3ou6C-3l6vA:
undetectable		 3ou6C-3l6vA:
22.46
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.
3lke ENOYL-COA HYDRATASE

(Bacillus
halodurans) 		PF00378
(ECH_1) 		5 LEU A  28
ALA A 112
GLY A 115
MET A 120
ALA A 132
 None
 1.23A 3ou6C-3lkeA:
undetectable		 3ou6C-3lkeA:
21.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lmk METABOTROPIC
GLUTAMATE RECEPTOR 5

(Homo sapiens) 		PF01094
(ANF_receptor) 		5 TYR A 481
GLU A 320
ALA A 321
GLY A 323
LEU A 301
 None
 1.14A 3ou6C-3lmkA:
undetectable		 3ou6C-3lmkA:
17.96
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.
3mam OSMOPROTECTION
PROTEIN (PROX)

(Archaeoglobus
fulgidus) 		PF04069
(OpuAC) 		5 LEU A  42
GLY A  11
SER A  12
LEU A  52
ALA A  67
 None
 1.22A 3ou6C-3mamA:
undetectable		 3ou6C-3mamA:
23.43
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.
3n2b DIAMINOPIMELATE
DECARBOXYLASE

(Vibrio cholerae) 		PF00278
(Orn_DAP_Arg_deC)
PF02784
(Orn_Arg_deC_N) 		5 ALA A 281
GLY A 285
SER A 369
LEU A  38
ALA A  59
 None
 1.28A 3ou6C-3n2bA:
undetectable		 3ou6C-3n2bA:
20.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nz4 PHENYLALANINE
AMMONIA-LYASE

(Taxus
canadensis) 		PF00221
(Lyase_aromatic) 		5 TYR A 245
ALA A 247
SER A 241
ASP A 473
LEU A 476
 None
 1.18A 3ou6C-3nz4A:
undetectable		 3ou6C-3nz4A:
16.42
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ou6 SAM-DEPENDENT
METHYLTRANSFERASE

(Streptomyces
luridus) 		PF13649
(Methyltransf_25) 		12 LEU A  12
TYR A  15
GLU A  52
ALA A  54
TRP A  60
GLY A  76
SER A  77
MET A  80
ASP A  98
LEU A  99
ALA A 114
TRP A 116
 SAM  A 300 ( 3.9A)
SAM  A 300 ( 3.5A)
None
SAM  A 300 (-3.4A)
None
SAM  A 300 (-3.3A)
SAM  A 300 (-4.5A)
SAM  A 300 (-4.0A)
SAM  A 300 (-4.0A)
SAM  A 300 (-3.9A)
SAM  A 300 (-3.6A)
None
 0.12A 3ou6C-3ou6A:
38.1		 3ou6C-3ou6A:
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.
3oyr TRANS-ISOPRENYL
DIPHOSPHATE SYNTHASE

(Caulobacter
vibrioides) 		PF00348
(polyprenyl_synt) 		5 LEU A 323
GLU A  22
ALA A  21
LEU A  61
ALA A  23
 None
 1.14A 3ou6C-3oyrA:
undetectable		 3ou6C-3oyrA:
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.
3px2 N-METHYLTRANSFERASE

(Streptomyces
fradiae) 		PF13649
(Methyltransf_25) 		5 TYR A  14
ALA A  58
SER A  81
MET A  84
ASP A 101
 SAH  A 263 ( 3.9A)
SAH  A 263 (-3.5A)
SAH  A 263 (-4.7A)
SAH  A 263 (-4.5A)
SAH  A 263 (-3.5A)
 0.92A 3ou6C-3px2A:
17.2		 3ou6C-3px2A:
28.46
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.
3qvq PHOSPHODIESTERASE
OLEI02445

(Oleispira
antarctica) 		PF03009
(GDPD) 		5 LEU A 155
GLY A 168
SER A 148
LEU A 182
ALA A 173
 None
None
G3P  A 301 ( 4.4A)
None
None
 1.09A 3ou6C-3qvqA:
undetectable		 3ou6C-3qvqA:
22.14
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.
3r3s OXIDOREDUCTASE

(Salmonella
enterica) 		PF13561
(adh_short_C2) 		5 LEU A  81
GLY A 107
ASP A 108
LEU A 109
ALA A 133
 NAD  A 300 (-4.3A)
None
NAD  A 300 (-3.6A)
NAD  A 300 (-3.9A)
None
 1.24A 3ou6C-3r3sA:
6.3		 3ou6C-3r3sA:
23.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3v4p INTEGRIN ALPHA-4

(Homo sapiens) 		PF01839
(FG-GAP)
PF08441
(Integrin_alpha2) 		5 LEU A  25
GLU A 351
GLY A 403
SER A 402
ASP A 414
 None
None
None
None
CA  A 603 (-2.8A)
 1.22A 3ou6C-3v4pA:
undetectable		 3ou6C-3v4pA:
16.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3w9i MULTIDRUG RESISTANCE
PROTEIN MEXB

(Pseudomonas
aeruginosa) 		PF00873
(ACR_tran) 		5 LEU A 861
GLY A 679
ASP A 681
LEU A 827
ALA A 665
 None
 1.30A 3ou6C-3w9iA:
undetectable		 3ou6C-3w9iA:
12.32
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.
3wc3 ENDO-1,
4-BETA-GLUCANASE

(Eisenia fetida) 		PF00759
(Glyco_hydro_9) 		5 LEU A  58
GLU A  39
GLY A  42
ASP A  43
LEU A  44
 None
None
None
NA  A 502 (-3.3A)
None
 1.23A 3ou6C-3wc3A:
undetectable		 3ou6C-3wc3A:
18.18
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.
4b2n 70 KDA PROTEIN

(Xanthomonas sp.
35Y) 		no annotation 5 ALA A 218
GLY A 247
SER A 248
MET A 285
ALA A 222
 HEM  A 700 ( 4.9A)
None
None
None
None
 1.26A 3ou6C-4b2nA:
undetectable		 3ou6C-4b2nA:
17.36
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.
4b4o EPIMERASE FAMILY
PROTEIN SDR39U1

(Homo sapiens) 		PF01370
(Epimerase)
PF08338
(DUF1731) 		5 ALA A  55
GLY A   6
LEU A  89
ALA A 102
TRP A 103
 None
 1.24A 3ou6C-4b4oA:
2.3		 3ou6C-4b4oA:
20.71
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.
4ewp 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3

(Micrococcus
luteus) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		5 TYR A 126
ALA A 174
SER A  90
LEU A 146
ALA A  21
 None
 1.22A 3ou6C-4ewpA:
undetectable		 3ou6C-4ewpA:
23.81
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.
4fl3 TYROSINE-PROTEIN
KINASE SYK

(Homo sapiens) 		PF00017
(SH2)
PF07714
(Pkinase_Tyr) 		5 LEU A 365
TYR A 364
ALA A 421
GLY A 437
LEU A 446
 None
 1.10A 3ou6C-4fl3A:
undetectable		 3ou6C-4fl3A:
16.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4igg CATENIN ALPHA-1

(Homo sapiens) 		PF01044
(Vinculin) 		5 LEU A 318
GLY A 315
SER A 314
LEU A 382
ALA A 335
 None
 1.28A 3ou6C-4iggA:
undetectable		 3ou6C-4iggA:
15.28
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.
4jqf CST COMPLEX SUBUNIT
STN1

(Homo sapiens) 		PF09170
(STN1_2) 		5 GLU A 191
ALA A 192
GLY A 197
LEU A 199
ALA A 190
 None
 1.31A 3ou6C-4jqfA:
undetectable		 3ou6C-4jqfA:
24.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4kmr TRANSCRIPTIONAL
REGULATOR, LACI
FAMILY

(Sanguibacter
keddieii) 		PF13377
(Peripla_BP_3) 		5 LEU A 189
GLU A 237
GLY A 191
LEU A 259
ALA A 240
 None
 1.20A 3ou6C-4kmrA:
2.1		 3ou6C-4kmrA:
25.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ozv ALGINATE LYASE

(Pseudomonas
aeruginosa) 		PF05426
(Alginate_lyase) 		5 LEU A  30
GLU A 229
ALA A 226
TRP A 191
ALA A 206
 None
 0.94A 3ou6C-4ozvA:
undetectable		 3ou6C-4ozvA:
22.90
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.
4phb UNCHARACTERIZED
PROTEIN

(Ruminiclostridium
thermocellum) 		PF14262
(Cthe_2159) 		5 GLU A 120
ALA A 122
GLY A  98
SER A  74
ASP A 126
 None
 0.99A 3ou6C-4phbA:
undetectable		 3ou6C-4phbA:
19.87
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.
4ry0 PROBABLE RIBOSE ABC
TRANSPORTER,
SUBSTRATE-BINDING
PROTEIN

(Rhizobium etli) 		PF13407
(Peripla_BP_4) 		5 LEU A 306
ALA A 265
GLY A 244
SER A 245
ALA A 269
 None
 1.22A 3ou6C-4ry0A:
2.2		 3ou6C-4ry0A:
19.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4tvo MALATE DEHYDROGENASE

(Mycobacterium
tuberculosis) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 ALA A 252
GLY A 129
SER A 155
MET A 267
LEU A  87
 None
 1.27A 3ou6C-4tvoA:
4.2		 3ou6C-4tvoA:
22.32
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.
4z64 PHYTOSULFOKINE
RECEPTOR 1

(Arabidopsis
thaliana) 		PF00560
(LRR_1)
PF08263
(LRRNT_2)
PF13855
(LRR_8) 		5 LEU A 412
ALA A 382
GLY A 384
LEU A 386
ALA A 377
 None
 1.26A 3ou6C-4z64A:
undetectable		 3ou6C-4z64A:
15.25
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.
4zaa FDC1

(Aspergillus
niger) 		PF01977
(UbiD) 		5 GLU A 233
ALA A 234
TRP A 166
GLY A 238
LEU A 245
 MN  A 603 ( 2.7A)
None
None
None
None
 1.26A 3ou6C-4zaaA:
undetectable		 3ou6C-4zaaA:
19.87
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.
5aff SYMPORTIN 1

(Chaetomium
thermophilum) 		no annotation 5 LEU A 630
GLU A 600
ALA A 601
LEU A 583
ALA A 596
 None
 1.21A 3ou6C-5affA:
undetectable		 3ou6C-5affA:
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.
5b7i CRISPR-ASSOCIATED
NUCLEASE/HELICASE
CAS3 SUBTYPE
I-F/YPEST

(Pseudomonas
aeruginosa) 		no annotation 5 LEU A 154
ALA A 119
GLY A 214
LEU A 216
ALA A 357
 None
 1.20A 3ou6C-5b7iA:
undetectable		 3ou6C-5b7iA:
12.15
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.
5dbo TRANSLATION
INITIATION FACTOR
EIF-2B-LIKE PROTEIN

(Chaetomium
thermophilum) 		PF01008
(IF-2B) 		5 LEU A 368
GLU A 269
GLY A 358
LEU A 391
ALA A 268
 None
 1.23A 3ou6C-5dboA:
4.5		 3ou6C-5dboA:
18.53
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.
5dm3 L-GLUTAMINE
SYNTHETASE

(Chromohalobacter
salexigens) 		PF00120
(Gln-synt_C) 		5 ALA A 239
TRP A  96
SER A 152
LEU A 148
ALA A 234
 None
 1.09A 3ou6C-5dm3A:
undetectable		 3ou6C-5dm3A:
18.71
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.
5fzp DISPASE
AUTOLYSIS-INDUCING
PROTEIN

(Streptomyces
mobaraensis) 		no annotation 5 ALA A  95
GLY A  92
ASP A  51
LEU A  50
ALA A  97
 None
 1.30A 3ou6C-5fzpA:
undetectable		 3ou6C-5fzpA:
23.46
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.
5g0q BETA-GLUCURONIDASE

(Acidobacterium
capsulatum) 		PF03662
(Glyco_hydro_79n) 		5 LEU A 307
ALA A 394
GLY A 469
LEU A 356
ALA A 383
 None
 0.91A 3ou6C-5g0qA:
undetectable		 3ou6C-5g0qA:
19.25
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.
5g0q BETA-GLUCURONIDASE

(Acidobacterium
capsulatum) 		PF03662
(Glyco_hydro_79n) 		5 LEU A 307
GLY A 469
SER A 468
LEU A 356
ALA A 383
 None
 1.22A 3ou6C-5g0qA:
undetectable		 3ou6C-5g0qA:
19.25
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.
5gmx CARBOXYLESTERASE

(uncultured
bacterium) 		PF00144
(Beta-lactamase) 		5 TYR A 361
GLY A  37
ASP A  47
LEU A  48
ALA A  24
 None
 1.10A 3ou6C-5gmxA:
undetectable		 3ou6C-5gmxA:
22.02
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.
5h02 GLYCINE SARCOSINE
N-METHYLTRANSFERASE

(Methanohalophilus
portucalensis) 		PF13649
(Methyltransf_25) 		5 ALA A  67
GLY A  89
SER A  90
MET A  93
ASP A 114
 SAH  A 301 (-3.9A)
SAH  A 301 (-3.4A)
SAH  A 301 ( 4.9A)
SAH  A 301 (-3.9A)
SAH  A 301 (-3.7A)
 0.49A 3ou6C-5h02A:
17.1		 3ou6C-5h02A:
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.
5hb1 NUCLEOPORIN NUP170

(Chaetomium
thermophilum) 		PF03177
(Nucleoporin_C) 		5 TYR A 905
GLU A 867
ALA A 865
SER A 907
LEU A 875
 None
 1.19A 3ou6C-5hb1A:
undetectable		 3ou6C-5hb1A:
12.15
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.
5hxs SODIUM,CALCIUM
EXCHANGER

(Methanocaldococcus
jannaschii) 		PF01699
(Na_Ca_ex) 		5 LEU A 254
ALA A 244
GLY A 248
SER A 249
ALA A 239
 None
 1.11A 3ou6C-5hxsA:
undetectable		 3ou6C-5hxsA:
22.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5iz5 CYTOSOLIC
PHOSPHOLIPASE A2
DELTA

(Homo sapiens) 		no annotation 5 LEU B 782
GLY B 340
SER B 337
LEU B 381
ALA B 368
 None
 1.24A 3ou6C-5iz5B:
undetectable		 3ou6C-5iz5B:
14.66
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.
5je3 METHYL TRANSFERASE

(Burkholderia
glumae) 		PF13847
(Methyltransf_31) 		5 ALA A  47
SER A  71
MET A  74
ASP A  95
ALA A 111
 SAH  A 301 (-3.2A)
SAH  A 301 ( 4.8A)
SAH  A 301 ( 4.5A)
SAH  A 301 (-3.7A)
SAH  A 301 (-3.8A)
 0.68A 3ou6C-5je3A:
16.0		 3ou6C-5je3A:
23.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5k1s OXIDOREDUCTASE,
ZINC-BINDING
DEHYDROGENASE FAMILY

(Myxococcus
xanthus) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 LEU A 181
GLU A 241
GLY A 177
SER A 176
ALA A 239
 None
 1.13A 3ou6C-5k1sA:
6.8		 3ou6C-5k1sA:
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.
5lc5 NADH DEHYDROGENASE
[UBIQUINONE]
IRON-SULFUR PROTEIN
7, MITOCHONDRIAL
NADH DEHYDROGENASE
[UBIQUINONE]
IRON-SULFUR PROTEIN
2, MITOCHONDRIAL

(Bos taurus;
Bos taurus) 		PF01058
(Oxidored_q6)
PF00346
(Complex1_49kDa) 		5 LEU D 106
ALA B  53
GLY D 426
LEU D  83
ALA B  89
 None
SF4  B 201 (-3.3A)
None
None
None
 1.24A 3ou6C-5lc5D:
undetectable		 3ou6C-5lc5D:
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.
5m6u PHOSPHATIDYLINOSITOL
4,5-BISPHOSPHATE
3-KINASE CATALYTIC
SUBUNIT DELTA
ISOFORM
PHOSPHATIDYLINOSITOL
3-KINASE REGULATORY
SUBUNIT ALPHA

(Homo sapiens;
Homo sapiens) 		PF00454
(PI3_PI4_kinase)
PF00613
(PI3Ka)
PF00792
(PI3K_C2)
PF00794
(PI3K_rbd)
PF02192
(PI3K_p85B)
PF16454
(PI3K_P85_iSH2) 		5 GLU B 485
ALA B 483
ASP B 548
LEU B 545
ALA A  77
 None
 1.29A 3ou6C-5m6uB:
undetectable		 3ou6C-5m6uB:
14.93
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.
5m95 DIVALENT METAL
CATION TRANSPORTER
MNTH

(Staphylococcus
capitis) 		PF01566
(Nramp) 		5 LEU A 323
ALA A 126
GLY A 130
SER A 131
LEU A 385
 None
 1.10A 3ou6C-5m95A:
undetectable		 3ou6C-5m95A:
19.20
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.
5mfb YIII(DQ)4CQI

(synthetic
construct) 		PF00514
(Arm) 		5 ALA A 157
SER A 150
ASP A 147
LEU A 146
ALA A 120
 None
 1.13A 3ou6C-5mfbA:
undetectable		 3ou6C-5mfbA:
22.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mfb YIII(DQ)4CQI

(synthetic
construct) 		PF00514
(Arm) 		5 ALA A 199
SER A 192
ASP A 189
LEU A 188
ALA A 162
 None
 1.10A 3ou6C-5mfbA:
undetectable		 3ou6C-5mfbA:
22.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5n03 GLUTACONATE
COA-TRANSFERASE
FAMILY, SUBUNIT B

(Myxococcus
xanthus) 		no annotation 5 LEU D  77
TYR D  76
GLY D  58
SER D  59
ALA D  32
 None
 1.27A 3ou6C-5n03D:
undetectable		 3ou6C-5n03D:
25.29
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.
5t38 EVDMO1

(Micromonospora
carbonacea) 		PF13847
(Methyltransf_31) 		5 LEU A 188
GLU A  60
GLY A  85
ASP A 111
ALA A 129
 SAH  A 301 ( 4.1A)
None
SAH  A 301 (-3.4A)
SAH  A 301 (-2.9A)
SAH  A 301 (-3.5A)
 0.84A 3ou6C-5t38A:
14.4		 3ou6C-5t38A:
27.54
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.
5thm ESTERASE-6

(Drosophila
melanogaster) 		PF00135
(COesterase) 		5 ALA A 231
GLY A 235
SER A 237
LEU A 249
ALA A 227
 None
None
MLY  A 267 ( 3.8A)
MLY  A 250 ( 3.7A)
None
 1.14A 3ou6C-5thmA:
undetectable		 3ou6C-5thmA:
19.21
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.
5vn5 2,2',3-TRIHYDROXY-3'
-METHOXY-5,5'-DICARB
OXYBIPHENYL
META-CLEAVAGE
COMPOUND HYDROLASE

(Sphingobium sp.
SYK-6) 		PF04909
(Amidohydro_2) 		5 GLU A 198
ALA A 180
GLY A 182
SER A 183
ALA A 201
 None
 1.29A 3ou6C-5vn5A:
undetectable		 3ou6C-5vn5A:
20.25
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.
5xfl CATENIN ALPHA-2

(Mus musculus) 		no annotation 5 LEU A 316
GLY A 313
SER A 312
LEU A 380
ALA A 333
 None
 1.30A 3ou6C-5xflA:
undetectable		 3ou6C-5xflA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xmj FUMARATE REDUCTASE
FLAVOPROTEIN SUBUNIT

(Desulfovibrio
gigas) 		no annotation 5 LEU A 579
ALA A 536
GLY A 538
MET A 251
ASP A 541
 None
 1.02A 3ou6C-5xmjA:
undetectable		 3ou6C-5xmjA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xn6 OS07G0580900 PROTEIN
OS02G0668100 PROTEIN

(Oryza sativa;
Oryza sativa) 		PF00348
(polyprenyl_synt)
PF00348
(polyprenyl_synt) 		5 ALA C 152
GLY C 156
SER C 157
ASP A 116
ALA A 127
 None
 1.29A 3ou6C-5xn6C:
undetectable		 3ou6C-5xn6C:
23.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xn6 OS07G0580900 PROTEIN
OS02G0668100 PROTEIN

(Oryza sativa;
Oryza sativa) 		PF00348
(polyprenyl_synt)
PF00348
(polyprenyl_synt) 		5 GLU C 150
ALA C 152
GLY C 156
SER C 157
ASP A 116
 None
 1.26A 3ou6C-5xn6C:
undetectable		 3ou6C-5xn6C:
23.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6b4h NUCLEOPORIN GLE1

(Chaetomium
thermophilum) 		no annotation 5 TYR A 484
ALA A 491
SER A 486
LEU A 492
ALA A 451
 None
 1.21A 3ou6C-6b4hA:
undetectable		 3ou6C-6b4hA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6df3 -

(-) 		no annotation 5 GLU H 206
ALA H 205
GLY H 142
LEU H 156
ALA H 168
 None
 1.17A 3ou6C-6df3H:
undetectable		 3ou6C-6df3H:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6dzs HOMOSERINE
DEHYDROGENASE

(Mycolicibacterium
hassiacum) 		no annotation 5 LEU A 277
ALA A 241
GLY A 245
LEU A 274
ALA A 236
 None
 1.28A 3ou6C-6dzsA:
3.2		 3ou6C-6dzsA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6g0c UBIQUITINATING/DEUBI
QUITINATING ENZYME
SDEA

(Legionella
pneumophila) 		no annotation 5 ALA A 299
GLY A 434
SER A 435
LEU A 306
ALA A 787
 None
 1.24A 3ou6C-6g0cA:
undetectable		 3ou6C-6g0cA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6gu8 -

(-) 		no annotation 5 ALA A 262
GLY A 255
SER A 278
LEU A 133
ALA A 227
 None
EDO  A 505 ( 4.9A)
None
None
None
 1.09A 3ou6C-6gu8A:
undetectable		 3ou6C-6gu8A:
undetectable