SIMILAR PATTERNS OF AMINO ACIDS FOR 4UCK_A_SAMA2409

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.
1g68 BETA-LACTAMASE PSE-4

(Pseudomonas
aeruginosa) 		PF13354
(Beta-lactamase2) 		5 THR A  69
GLY A 242
GLY A 240
GLY A 172
ALA A 270
 None
 0.82A 4uckA-1g68A:
undetectable		 4uckA-1g68A:
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.
1l1e MYCOLIC ACID
SYNTHASE

(Mycobacterium
tuberculosis) 		PF02353
(CMAS) 		5 GLY A  72
GLY A  74
GLY A  76
LEU A  95
ALA A 138
 SAH  A 900 (-3.1A)
SAH  A 900 (-3.4A)
None
SAH  A 900 (-4.1A)
SAH  A 900 (-3.4A)
 0.91A 4uckA-1l1eA:
6.6		 4uckA-1l1eA:
22.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1l3i PRECORRIN-6Y
METHYLTRANSFERASE/PU
TATIVE DECARBOXYLASE

(Methanothermobacter
thermautotrophicus) 		PF13847
(Methyltransf_31) 		5 THR A  17
GLY A  41
GLY A  43
GLY A  45
ALA A  91
 SAH  A 801 (-3.7A)
SAH  A 801 (-3.4A)
SAH  A 801 (-3.2A)
SAH  A 801 (-4.0A)
SAH  A 801 (-3.2A)
 0.61A 4uckA-1l3iA:
7.6		 4uckA-1l3iA:
17.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1lnz SPO0B-ASSOCIATED
GTP-BINDING PROTEIN

(Bacillus
subtilis) 		PF01018
(GTP1_OBG)
PF01926
(MMR_HSR1) 		5 GLY A  41
GLY A  16
GLY A 123
ALA A  66
ALA A  82
 None
 0.95A 4uckA-1lnzA:
undetectable		 4uckA-1lnzA:
21.61
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.
1odi PURINE NUCLEOSIDE
PHOSPHORYLASE

(Thermus
thermophilus) 		PF01048
(PNP_UDP_1) 		5 GLY A  66
GLU A 181
GLY A  64
GLY A  21
SER A  69
 None
ADN  A1237 (-3.0A)
None
SO4  A1236 (-3.1A)
None
 0.97A 4uckA-1odiA:
undetectable		 4uckA-1odiA:
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.
1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA

(Paracoccus
denitrificans) 		PF00115
(COX1) 		6 GLY A 153
GLU A 174
GLY A 159
GLY A 161
ASN A  88
SER A 178
 None
 1.33A 4uckA-1qleA:
undetectable		 4uckA-1qleA:
20.51
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.
1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE III

(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		PF00115
(COX1)
PF00510
(COX3) 		6 GLY A 153
GLU A 174
GLY A 159
GLY A 161
ASN A  88
THR C  39
 None
 1.36A 4uckA-1qleA:
undetectable		 4uckA-1qleA:
20.51
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.
1qs0 2-OXOISOVALERATE
DEHYDROGENASE
BETA-SUBUNIT

(Pseudomonas
putida) 		PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		5 GLY B  30
GLY B  34
GLY B  37
THR B  68
ALA B  58
 None
 0.95A 4uckA-1qs0B:
undetectable		 4uckA-1qs0B:
21.48
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.
1sgv TRNA PSEUDOURIDINE
SYNTHASE B

(Mycobacterium
tuberculosis) 		PF01509
(TruB_N)
PF09142
(TruB_C)
PF16198
(TruB_C_2) 		5 THR A  32
GLY A   7
GLY A   5
ALA A 231
ALA A  56
 None
 0.76A 4uckA-1sgvA:
undetectable		 4uckA-1sgvA:
23.38
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.
1shz GUANINE
NUCLEOTIDE-BINDING
PROTEIN
GALPHA(13):GALPHA(I1
) CHIMERA

(Mus musculus;
Rattus
norvegicus) 		PF00503
(G-alpha) 		6 GLY A  60
GLY A  57
GLY A 225
SER A  59
ALA A 348
THR A 349
 GDP  A 475 (-3.2A)
ALF  A 378 (-3.3A)
ALF  A 378 (-3.2A)
GDP  A 475 (-3.4A)
GDP  A 475 (-3.5A)
GDP  A 475 (-3.8A)
 1.35A 4uckA-1shzA:
undetectable		 4uckA-1shzA:
20.67
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.
1sus CAFFEOYL-COA
O-METHYLTRANSFERASE

(Medicago sativa) 		PF01596
(Methyltransf_3) 		5 THR A  63
GLY A  87
GLY A  91
ALA A 140
ALA A 164
 SAH  A 301 ( 2.8A)
SAH  A 301 (-3.4A)
None
SAH  A 301 (-3.9A)
SAH  A 301 ( 3.7A)
 0.82A 4uckA-1susA:
8.1		 4uckA-1susA:
21.29
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.
1tnd TRANSDUCIN

(Bos taurus) 		PF00503
(G-alpha) 		6 GLY A  41
GLY A  38
GLY A 199
SER A  40
ALA A 322
THR A 323
 GSP  A 351 (-3.3A)
GSP  A 351 ( 3.8A)
GSP  A 351 (-3.6A)
GSP  A 351 (-3.2A)
GSP  A 351 (-3.5A)
GSP  A 351 (-3.7A)
 1.42A 4uckA-1tndA:
undetectable		 4uckA-1tndA:
21.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1tpy METHOXY MYCOLIC ACID
SYNTHASE 2

(Mycobacterium
tuberculosis) 		PF02353
(CMAS) 		5 GLY A  72
GLY A  74
GLY A  76
LEU A  95
ALA A 138
 SAH  A1900 (-3.2A)
SAH  A1900 (-3.3A)
None
SAH  A1900 (-4.3A)
SAH  A1900 (-3.1A)
 0.96A 4uckA-1tpyA:
6.6		 4uckA-1tpyA:
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.
2ewy BETA-SECRETASE 2

(Homo sapiens) 		PF00026
(Asp) 		6 GLY A 243
GLY A  50
GLY A 136
ASN A  53
ALA A 347
THR A 348
 DBO  A1001 (-4.2A)
DBO  A1001 (-3.7A)
None
None
None
None
 1.14A 4uckA-2ewyA:
undetectable		 4uckA-2ewyA:
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.
2g1s RENIN

(Homo sapiens) 		PF00026
(Asp) 		6 GLY A 223
GLY A  35
GLY A 124
ALA A 312
THR A 313
ALA A 224
 4IG  A 885 (-3.9A)
4IG  A 885 (-3.5A)
None
None
None
4IG  A 885 ( 4.7A)
 1.24A 4uckA-2g1sA:
undetectable		 4uckA-2g1sA:
21.71
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.
2g1s RENIN

(Homo sapiens) 		PF00026
(Asp) 		6 GLY A 223
GLY A  35
GLY A 124
ASN A  38
ALA A 312
THR A 313
 4IG  A 885 (-3.9A)
4IG  A 885 (-3.5A)
None
None
None
None
 1.31A 4uckA-2g1sA:
undetectable		 4uckA-2g1sA:
21.71
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.
2gd2 PROBABLE
ALPHA-METHYLACYL-COA
RACEMASE MCR

(Mycobacterium
tuberculosis) 		PF02515
(CoA_transf_3) 		5 GLY A 219
GLY A 213
GLY A 143
LEU A 217
ALA A 221
 None
 0.95A 4uckA-2gd2A:
undetectable		 4uckA-2gd2A:
19.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hyp HYPOTHETICAL PROTEIN
RV0805

(Mycobacterium
tuberculosis) 		PF00149
(Metallophos) 		5 THR A 134
GLY A 206
GLY A  62
GLY A  96
SER A  20
 None
 0.97A 4uckA-2hypA:
undetectable		 4uckA-2hypA:
19.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2i0k OXIDOREDUCTASE

(Brevibacterium
sterolicum) 		PF01565
(FAD_binding_4)
PF09129
(Chol_subst-bind) 		5 THR A 500
GLY A 203
GLY A 480
LEU A 185
ALA A 187
 None
None
None
None
FAD  A 700 (-3.5A)
 0.91A 4uckA-2i0kA:
undetectable		 4uckA-2i0kA:
21.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ik8 GUANINE
NUCLEOTIDE-BINDING
PROTEIN G(I),
ALPHA-1 SUBUNIT

(Homo sapiens) 		PF00503
(G-alpha) 		6 GLY A  45
GLY A  42
GLY A 203
SER A  44
ALA A 326
THR A 327
 GDP  A 401 (-3.3A)
ALF  A 355 (-3.3A)
ALF  A 355 (-3.3A)
GDP  A 401 (-3.6A)
GDP  A 401 (-3.2A)
GDP  A 401 (-3.3A)
 1.40A 4uckA-2ik8A:
undetectable		 4uckA-2ik8A:
21.38
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.
2r66 GLYCOSYL
TRANSFERASE, GROUP 1

(Halothermothrix
orenii) 		PF00534
(Glycos_transf_1)
PF00862
(Sucrose_synth) 		6 THR A 388
GLY A 372
GLY A 392
GLY A 391
ASN A 390
ALA A 374
 None
 1.31A 4uckA-2r66A:
2.1		 4uckA-2r66A:
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.
2vdv TRNA
(GUANINE-N(7)-)-METH
YLTRANSFERASE

(Saccharomyces
cerevisiae) 		PF02390
(Methyltransf_4) 		5 THR E 259
GLY E 103
GLY E 105
GLY E 107
ALA E 162
 SAM  E1287 (-2.8A)
SAM  E1287 (-3.1A)
SAM  E1287 (-3.6A)
None
SAM  E1287 (-3.9A)
 0.77A 4uckA-2vdvE:
4.9		 4uckA-2vdvE:
19.85
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.
2wa2 NON-STRUCTURAL
PROTEIN 5

(Modoc virus) 		PF01728
(FtsJ) 		5 GLY A  82
GLY A  84
GLY A  86
LEU A 106
THR A 134
 SAM  A1248 (-3.3A)
SAM  A1248 (-3.4A)
SAM  A1248 (-4.4A)
SAM  A1248 (-4.1A)
SAM  A1248 (-3.8A)
 0.65A 4uckA-2wa2A:
9.3		 4uckA-2wa2A:
21.21
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.
2wa2 NON-STRUCTURAL
PROTEIN 5

(Modoc virus) 		PF01728
(FtsJ) 		5 GLY A  82
GLY A  86
TRP A  88
LEU A 106
THR A 134
 SAM  A1248 (-3.3A)
SAM  A1248 (-4.4A)
SAM  A1248 (-3.7A)
SAM  A1248 (-4.1A)
SAM  A1248 (-3.8A)
 0.93A 4uckA-2wa2A:
9.3		 4uckA-2wa2A:
21.21
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.
2yys PROLINE
IMINOPEPTIDASE-RELAT
ED PROTEIN

(Thermus
thermophilus) 		PF12697
(Abhydrolase_6) 		6 GLY A  62
GLY A  64
GLY A  37
SER A  66
LEU A  67
ALA A  13
 None
 1.42A 4uckA-2yysA:
undetectable		 4uckA-2yysA:
20.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bb7 INTERPAIN A

(Prevotella
intermedia) 		PF01640
(Peptidase_C10)
PF13734
(Inhibitor_I69) 		6 GLY A 153
GLY A 241
GLY A 237
ASN A 239
THR A 159
ALA A 154
 None
 1.46A 4uckA-3bb7A:
undetectable		 4uckA-3bb7A:
20.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bmw CYCLOMALTODEXTRIN
GLUCANOTRANSFERASE

(Thermoanaerobacterium
thermosulfurigenes) 		PF00128
(Alpha-amylase)
PF00686
(CBM_20)
PF01833
(TIG) 		5 GLY A 485
GLU A 486
GLY A 466
ASN A 467
ALA A 484
 None
 0.97A 4uckA-3bmwA:
undetectable		 4uckA-3bmwA:
21.90
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.
3bs8 GLUTAMATE-1-SEMIALDE
HYDE 2,1-AMINOMUTASE

(Bacillus
subtilis) 		PF00202
(Aminotran_3) 		5 GLY A 214
GLU A 400
GLY A 401
ALA A 372
THR A 371
 None
 0.66A 4uckA-3bs8A:
undetectable		 4uckA-3bs8A:
22.95
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.
3bus METHYLTRANSFERASE

(Lechevalieria
aerocolonigenes) 		PF08241
(Methyltransf_11) 		5 GLY A  69
GLY A  71
GLY A  73
SER A  91
ALA A 120
 SAH  A 274 (-3.1A)
SAH  A 274 (-3.4A)
None
SAH  A 274 (-3.0A)
SAH  A 274 (-3.5A)
 0.86A 4uckA-3busA:
5.8		 4uckA-3busA:
21.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3c3y O-METHYLTRANSFERASE

(Mesembryanthemum
crystallinum) 		PF01596
(Methyltransf_3) 		5 THR A  54
GLY A  78
GLY A  82
ALA A 131
ALA A 155
 SAH  A 464 (-3.5A)
SAH  A 464 (-3.7A)
SAH  A 464 ( 4.6A)
SAH  A 464 (-3.5A)
SAH  A 464 (-3.7A)
 0.80A 4uckA-3c3yA:
8.2		 4uckA-3c3yA:
18.35
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.
3c7k GUANINE
NUCLEOTIDE-BINDING
PROTEIN G(O) SUBUNIT
ALPHA

(Mus musculus) 		PF00503
(G-alpha) 		6 GLY A  45
GLY A  42
GLY A 204
SER A  44
ALA A 326
THR A 327
 GDP  A 361 (-2.8A)
ALF  A 365 (-3.0A)
ALF  A 365 (-3.2A)
GDP  A 361 (-4.0A)
GDP  A 361 (-3.4A)
GDP  A 361 (-3.4A)
 1.30A 4uckA-3c7kA:
undetectable		 4uckA-3c7kA:
22.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ckk TRNA
(GUANINE-N(7)-)-METH
YLTRANSFERASE

(Homo sapiens) 		PF02390
(Methyltransf_4) 		5 THR A 208
GLY A  54
GLY A  56
GLY A  58
ALA A 111
 SAM  A 301 (-2.8A)
GOL  A 302 ( 3.3A)
SAM  A 301 (-3.5A)
None
SAM  A 301 (-3.7A)
 0.93A 4uckA-3ckkA:
5.4		 4uckA-3ckkA:
18.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cx6 GUANINE
NUCLEOTIDE-BINDING
PROTEIN ALPHA-13
SUBUNIT

(Mus musculus) 		PF00503
(G-alpha) 		6 GLY A  60
GLY A  57
GLY A 225
SER A  59
ALA A 349
THR A 348
 GDP  A 775 (-3.2A)
GDP  A 775 ( 4.2A)
None
GDP  A 775 (-3.4A)
GDP  A 775 (-3.2A)
GDP  A 775 (-3.8A)
 1.43A 4uckA-3cx6A:
undetectable		 4uckA-3cx6A:
20.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3f6r FLAVODOXIN

(Desulfovibrio
desulfuricans) 		PF00258
(Flavodoxin_1) 		5 GLY A  94
GLU A 127
GLY A 128
SER A  93
ALA A  59
 FMN  A 149 (-2.9A)
None
None
FMN  A 149 (-3.8A)
FMN  A 149 (-3.7A)
 0.80A 4uckA-3f6rA:
undetectable		 4uckA-3f6rA:
18.43
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.
3gju PUTATIVE
AMINOTRANSFERASE

(Mesorhizobium
japonicum) 		PF00202
(Aminotran_3) 		6 GLY A 120
GLY A 157
SER A 119
LEU A 118
ALA A 288
ALA A 123
 PLP  A 460 (-3.2A)
None
PLP  A 460 (-3.6A)
None
LLP  A 289 ( 2.8A)
None
 1.34A 4uckA-3gjuA:
undetectable		 4uckA-3gjuA:
22.04
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.
3gms PUTATIVE
NADPH:QUINONE
REDUCTASE

(Bacillus
thuringiensis) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 GLY A 245
GLY A 221
ASN A 249
SER A 244
LEU A 243
 None
 0.96A 4uckA-3gmsA:
3.9		 4uckA-3gmsA:
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.
3gu3 METHYLTRANSFERASE

(Bacillus cereus) 		PF13847
(Methyltransf_31) 		5 GLY A  47
GLY A  49
GLY A  51
ALA A  98
THR A  99
 SAH  A 401 (-3.8A)
SAH  A 401 (-3.3A)
None
SAH  A 401 (-3.3A)
SAH  A 401 ( 4.0A)
 0.66A 4uckA-3gu3A:
7.1		 4uckA-3gu3A:
23.36
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.
3igz COFACTOR-INDEPENDENT
PHOSPHOGLYCERATE
MUTASE

(Leishmania
mexicana) 		PF01676
(Metalloenzyme)
PF06415
(iPGM_N) 		5 GLY B 199
GLY B 220
SER B 198
ALA B 235
ALA B 161
 None
 0.80A 4uckA-3igzB:
3.9		 4uckA-3igzB:
22.78
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.
3ihs PHOSPHOCARRIER
PROTEIN HPR

(Bacillus
anthracis) 		PF00381
(PTS-HPr) 		5 GLY A  58
GLY A  56
GLY A  13
ASN A  12
SER A  59
 None
 0.86A 4uckA-3ihsA:
undetectable		 4uckA-3ihsA:
14.57
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.
3iwa FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULPHID
E OXIDOREDUCTASE

(Desulfovibrio
vulgaris) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		6 GLY A  14
GLY A 318
GLY A 322
ASN A 324
ALA A  10
ALA A 119
 None
 1.21A 4uckA-3iwaA:
undetectable		 4uckA-3iwaA:
23.15
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.
3j09 COPPER-EXPORTING
P-TYPE ATPASE A

(Archaeoglobus
fulgidus) 		PF00122
(E1-E2_ATPase)
PF00403
(HMA)
PF00702
(Hydrolase) 		5 GLY A 619
GLY A 617
GLY A 427
ALA A 215
ALA A 623
 None
 0.95A 4uckA-3j09A:
undetectable		 4uckA-3j09A:
20.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kaq FLAVODOXIN

(Desulfovibrio
desulfuricans) 		PF00258
(Flavodoxin_1) 		5 GLY A  94
GLU A 127
GLY A 128
SER A  93
ALA A  59
 FMN  A 150 (-3.3A)
None
None
FMN  A 150 (-3.8A)
FMN  A 150 (-3.6A)
 0.84A 4uckA-3kaqA:
undetectable		 4uckA-3kaqA:
14.57
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.
3l9x GLUTATHIONE-REGULATE
D POTASSIUM-EFFLUX
SYSTEM PROTEIN KEFC,
LINKER, ANCILLARY
PROTEIN KEFF

(Escherichia
coli) 		PF02254
(TrkA_N)
PF02525
(Flavodoxin_2) 		6 THR A 414
GLY A 406
GLY A 408
ALA A 450
THR A 451
ALA A 405
 None
None
SO4  A1190 (-3.5A)
None
None
None
 1.37A 4uckA-3l9xA:
undetectable		 4uckA-3l9xA:
22.15
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.
3mdu N-FORMIMINO-L-GLUTAM
ATE IMINOHYDROLASE

(Pseudomonas
aeruginosa) 		PF01979
(Amidohydro_1) 		5 GLY A 367
GLY A 316
GLY A 289
LEU A 365
ALA A 369
 None
 0.95A 4uckA-3mduA:
undetectable		 4uckA-3mduA:
19.51
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.
3mq2 16S RRNA
METHYLTRANSFERASE

(Streptoalloteichus
tenebrarius) 		PF02390
(Methyltransf_4) 		5 THR A 191
GLY A  32
GLY A  34
GLY A  36
ALA A  87
 SAH  A 216 (-2.7A)
SAH  A 216 (-3.5A)
SAH  A 216 (-3.4A)
None
SAH  A 216 (-3.5A)
 0.64A 4uckA-3mq2A:
6.0		 4uckA-3mq2A:
19.14
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.
3nvl 2,3-BISPHOSPHOGLYCER
ATE-INDEPENDENT
PHOSPHOGLYCERATE
MUTASE

(Trypanosoma
brucei) 		PF01676
(Metalloenzyme)
PF06415
(iPGM_N) 		5 GLY A 198
GLY A 219
SER A 197
ALA A 234
ALA A 160
 None
 0.94A 4uckA-3nvlA:
3.8		 4uckA-3nvlA:
21.49
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.
3omn CYTOCHROME C
OXIDASE, AA3 TYPE,
SUBUNIT I

(Rhodobacter
sphaeroides) 		PF00115
(COX1) 		6 GLY A 161
GLU A 182
GLY A 167
GLY A 169
ASN A  96
SER A 186
 None
 1.25A 4uckA-3omnA:
undetectable		 4uckA-3omnA:
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.
3rko NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT N

(Escherichia
coli) 		no annotation 5 GLY N 385
GLY N 391
GLY N 394
LEU N 381
ALA N 384
 None
 0.91A 4uckA-3rkoN:
undetectable		 4uckA-3rkoN:
23.15
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.
3tkk PREDICTED
ACETAMIDASE/FORMAMID
ASE

(Caldanaerobacter
subterraneus) 		PF03069
(FmdA_AmdA) 		5 THR A 282
GLY A 153
GLY A 150
LEU A 180
THR A  34
 None
 0.91A 4uckA-3tkkA:
undetectable		 4uckA-3tkkA:
21.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tr6 O-METHYLTRANSFERASE

(Coxiella
burnetii) 		PF01596
(Methyltransf_3) 		5 THR A  45
GLY A  69
GLY A  73
ALA A 122
ALA A 145
 SAH  A 224 (-3.6A)
SAH  A 224 (-3.9A)
None
SAH  A 224 (-3.8A)
SAH  A 224 (-3.5A)
 0.92A 4uckA-3tr6A:
7.8		 4uckA-3tr6A:
21.93
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.
3uav PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE

(Bacillus cereus) 		PF01048
(PNP_UDP_1) 		5 GLY A  65
GLU A 181
GLY A  63
GLY A  20
SER A  68
 None
SO4  A 236 ( 4.4A)
None
SO4  A 236 (-3.3A)
None
 0.93A 4uckA-3uavA:
undetectable		 4uckA-3uavA:
19.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wfa ALPHA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron) 		PF10566
(Glyco_hydro_97)
PF14508
(GH97_N)
PF14509
(GH97_C) 		6 THR A 544
GLY A 718
GLY A 716
GLY A 657
THR A 697
ALA A 584
 None
 1.43A 4uckA-3wfaA:
undetectable		 4uckA-3wfaA:
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.
3x43 O-UREIDO-L-SERINE
SYNTHASE

(Streptomyces
lavendulae) 		PF00291
(PALP) 		6 THR A 300
GLY A 263
GLY A 294
ALA A 271
THR A 272
ALA A 247
 None
 1.44A 4uckA-3x43A:
undetectable		 4uckA-3x43A:
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.
4btg MAJOR INNER PROTEIN
P1

(Pseudomonas
virus phi6) 		no annotation 5 GLY A 687
GLY A 682
GLY A 728
TRP A 726
ALA A 688
 None
 0.91A 4uckA-4btgA:
undetectable		 4uckA-4btgA:
19.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4c7v TRANSKETOLASE

(Lactobacillus
salivarius) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		6 THR A 427
GLY A 128
GLY A 420
TRP A 375
ALA A 173
ALA A 130
 None
 1.35A 4uckA-4c7vA:
undetectable		 4uckA-4c7vA:
20.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4cp8 ALLOPHANATE
HYDROLASE

(Pseudomonas sp.
ADP) 		PF01425
(Amidase) 		5 THR A 390
GLY A 190
GLY A 188
SER A 225
ALA A 238
 None
None
MLI  A1466 (-4.0A)
None
None
 0.91A 4uckA-4cp8A:
undetectable		 4uckA-4cp8A:
19.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4dng UNCHARACTERIZED
ALDEHYDE
DEHYDROGENASE ALDY

(Bacillus
subtilis) 		PF00171
(Aldedh) 		5 GLY A  96
GLY A 327
ASN A 361
THR A 102
ALA A  91
 None
 0.93A 4uckA-4dngA:
2.4		 4uckA-4dngA:
21.17
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.
4dzr PROTEIN-(GLUTAMINE-N
5)
METHYLTRANSFERASE,
RELEASE
FACTOR-SPECIFIC

(Alicyclobacillus
acidocaldarius) 		PF05175
(MTS) 		5 GLY A 140
GLY A 102
SER A 139
ALA A 157
ALA A 143
 ACT  A 402 ( 4.0A)
GOL  A 403 (-3.8A)
None
ACT  A 402 ( 4.6A)
ACT  A 402 ( 4.5A)
 0.93A 4uckA-4dzrA:
5.8		 4uckA-4dzrA:
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.
4ekd GUANINE
NUCLEOTIDE-BINDING
PROTEIN G(Q) SUBUNIT
ALPHA

(Mus musculus) 		PF00503
(G-alpha) 		6 GLY A  51
GLY A  48
GLY A 208
SER A  50
ALA A 331
THR A 332
 GDP  A 401 (-3.2A)
ALF  A 402 (-2.9A)
ALF  A 402 (-3.1A)
GDP  A 401 (-3.9A)
GDP  A 401 (-3.2A)
GDP  A 401 (-3.6A)
 1.41A 4uckA-4ekdA:
undetectable		 4uckA-4ekdA:
21.78
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.
4gbf PHIKZ131

(Pseudomonas
virus phiKZ) 		no annotation 6 THR A 562
GLY A 727
GLY A 687
GLY A 619
ASN A 561
ALA A 413
 None
 1.46A 4uckA-4gbfA:
undetectable		 4uckA-4gbfA:
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.
4hsu LYSINE-SPECIFIC
HISTONE DEMETHYLASE
1B

(Homo sapiens) 		PF01593
(Amino_oxidase)
PF04433
(SWIRM)
PF07496
(zf-CW) 		5 GLY A 812
GLY A 794
SER A 811
LEU A 810
ALA A 396
 None
FAD  A 901 (-3.2A)
None
None
None
 0.86A 4uckA-4hsuA:
undetectable		 4uckA-4hsuA:
17.75
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.
4htf S-ADENOSYLMETHIONINE
-DEPENDENT
METHYLTRANSFERASE

(Escherichia
coli) 		PF13847
(Methyltransf_31) 		5 GLY B  52
GLY B  54
GLY B  56
LEU B  74
ALA B 102
 SAM  B 301 (-3.5A)
SAM  B 301 (-3.4A)
None
SAM  B 301 (-4.2A)
SAM  B 301 (-3.7A)
 0.58A 4uckA-4htfB:
8.5		 4uckA-4htfB:
25.12
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.
4hxy PLM1

(Streptomyces
sp. HK803) 		PF08659
(KR) 		5 GLY A 191
GLY A 194
GLY A 198
THR A 248
ALA A 274
 NDP  A 501 (-3.5A)
NDP  A 501 (-3.4A)
None
NDP  A 501 ( 4.5A)
NDP  A 501 (-3.8A)
 0.89A 4uckA-4hxyA:
undetectable		 4uckA-4hxyA:
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.
4i3u ALDEHYDE
DEHYDROGENASE (NAD+)

(Sinorhizobium
meliloti) 		PF00171
(Aldedh) 		5 GLY A 460
GLY A 256
GLY A 257
ASN A 258
LEU A 253
 None
 0.95A 4uckA-4i3uA:
2.9		 4uckA-4i3uA:
21.48
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.
4i59 CYCLOHEXYLAMINE
OXIDASE

(Microbacterium
oxydans) 		PF01593
(Amino_oxidase) 		5 GLY A 421
GLY A 201
GLY A 371
ASN A 373
ALA A 418
 None
 0.85A 4uckA-4i59A:
undetectable		 4uckA-4i59A:
19.54
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.
4iit PHENYLACETATE-COA
OXYGENASE SUBUNIT
PAAC

(Klebsiella
pneumoniae) 		PF05138
(PaaA_PaaC) 		5 GLY C 210
GLY C 148
GLY C 150
SER C 209
LEU C 206
 None
 0.87A 4uckA-4iitC:
undetectable		 4uckA-4iitC:
22.43
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.
4ine PROTEIN PMT-2

(Caenorhabditis
elegans) 		PF08241
(Methyltransf_11) 		5 GLY A 232
GLY A 234
GLY A 236
LEU A 255
ALA A 282
 SAH  A 501 (-3.6A)
SAH  A 501 (-3.6A)
None
SAH  A 501 (-4.3A)
SAH  A 501 (-3.6A)
 0.84A 4uckA-4ineA:
6.8		 4uckA-4ineA:
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.
4k9q BENZOYLFORMATE
DECARBOXYLASE

(Polynucleobacter
necessarius) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		5 THR A 447
GLY A  56
GLY A 413
THR A  84
ALA A 406
 None
 0.92A 4uckA-4k9qA:
undetectable		 4uckA-4k9qA:
22.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4kri PHOSPHOLETHANOLAMINE
N-METHYLTRANSFERASE
2

(Haemonchus
contortus) 		PF08241
(Methyltransf_11) 		6 GLY A 228
GLY A 230
GLY A 232
ASN A 198
LEU A 251
ALA A 278
 SAH  A 701 (-3.5A)
SAH  A 701 (-3.5A)
None
None
SAH  A 701 (-4.4A)
SAH  A 701 (-3.7A)
 1.48A 4uckA-4kriA:
7.0		 4uckA-4kriA:
22.78
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.
4ks9 MALONYL-COA
DECARBOXYLASE

(Cupriavidus
metallidurans) 		PF05292
(MCD)
PF17408
(MCD_N) 		5 GLY A 400
GLY A 403
GLY A 461
ASN A 462
ALA A 406
 None
 0.92A 4uckA-4ks9A:
undetectable		 4uckA-4ks9A:
21.49
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.
4m7w PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE

(Leptotrichia
buccalis) 		PF01048
(PNP_UDP_1) 		5 GLY A  66
GLU A 182
GLY A  64
GLY A  21
SER A  69
 None
PO4  A 400 ( 4.4A)
None
PO4  A 400 (-3.2A)
None
 0.95A 4uckA-4m7wA:
undetectable		 4uckA-4m7wA:
20.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4nec PUTATIVE
SAM-DEPENDENT
METHYLTRANSFERASE

(Streptomyces
lasaliensis) 		PF13649
(Methyltransf_25) 		5 GLY A  47
GLY A  49
GLY A  51
LEU A  69
ALA A  95
 SAH  A 401 (-3.9A)
SAH  A 401 (-3.6A)
None
SAH  A 401 (-3.7A)
SAH  A 401 (-3.2A)
 0.61A 4uckA-4necA:
6.9		 4uckA-4necA:
20.28
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.
4r2w URIDINE
PHOSPHORYLASE

(Shewanella
oneidensis) 		PF01048
(PNP_UDP_1) 		6 GLY A  67
GLU A 195
GLY A  65
GLY A  23
SER A  70
ALA A 116
 None
GOL  A 303 (-2.9A)
None
SO4  A 302 (-3.2A)
None
None
 1.26A 4uckA-4r2wA:
undetectable		 4uckA-4r2wA:
20.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4ucl RNA-DIRECTED RNA
POLYMERASE L

(Human
metapneumovirus) 		no annotation 7 GLY A1696
GLU A1697
GLY A1698
GLY A1700
LEU A1720
THR A1757
ALA A1780
 None
 0.95A 4uckA-4uclA:
57.5		 4uckA-4uclA:
99.76
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4ucl RNA-DIRECTED RNA
POLYMERASE L

(Human
metapneumovirus) 		no annotation 7 GLY A1696
GLU A1697
GLY A1698
GLY A1700
SER A1719
LEU A1720
THR A1757
 None
 1.14A 4uckA-4uclA:
57.5		 4uckA-4uclA:
99.76
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4ucl RNA-DIRECTED RNA
POLYMERASE L

(Human
metapneumovirus) 		no annotation 10 THR A1670
GLY A1696
GLY A1698
GLY A1700
ASN A1701
TRP A1702
LEU A1720
ALA A1756
THR A1757
ALA A1780
 None
 0.53A 4uckA-4uclA:
57.5		 4uckA-4uclA:
99.76
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4ucl RNA-DIRECTED RNA
POLYMERASE L

(Human
metapneumovirus) 		no annotation 10 THR A1670
GLY A1696
GLY A1698
GLY A1700
ASN A1701
TRP A1702
SER A1719
LEU A1720
ALA A1756
THR A1757
 None
 0.79A 4uckA-4uclA:
57.5		 4uckA-4uclA:
99.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4um8 INTEGRIN ALPHA-V

(Homo sapiens) 		PF01839
(FG-GAP)
PF08441
(Integrin_alpha2) 		5 GLY A 175
GLY A 173
GLY A 223
SER A 176
ALA A 149
 None
 0.93A 4uckA-4um8A:
undetectable		 4uckA-4um8A:
21.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4wk4 INTEGRIN ALPHA-5

(Homo sapiens) 		PF01839
(FG-GAP) 		5 GLY A 184
GLY A 182
GLY A 232
SER A 185
ALA A 158
 None
 0.95A 4uckA-4wk4A:
undetectable		 4uckA-4wk4A:
19.70
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.
4zgv FERREDOXIN RECEPTOR

(Pectobacterium
atrosepticum) 		PF07715
(Plug) 		6 THR A 670
GLY A 120
GLY A 668
ASN A 669
SER A 117
THR A  87
 None
None
None
BOG  A 905 (-4.1A)
None
None
 1.29A 4uckA-4zgvA:
undetectable		 4uckA-4zgvA:
18.39
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.
5epe SAM-DEPENDENT
METHYLTRANSFERASE

(Thiobacillus
denitrificans) 		PF13847
(Methyltransf_31) 		5 GLY A  44
GLY A  46
GLY A  48
LEU A  67
ALA A  95
 SAH  A 301 (-3.6A)
SAH  A 301 (-3.4A)
None
SAH  A 301 (-3.8A)
SAH  A 301 (-3.6A)
 0.94A 4uckA-5epeA:
4.0		 4uckA-5epeA:
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.
5fcr COMPLEMENT FACTOR D

(Mus musculus) 		PF00089
(Trypsin) 		5 GLY A  43
GLY A 140
GLY A 142
SER A 197
ALA A  31
 None
 0.92A 4uckA-5fcrA:
undetectable		 4uckA-5fcrA:
17.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hjp OXYSTEROLS RECEPTOR
LXR-BETA

(Homo sapiens) 		PF00104
(Hormone_recep) 		6 GLU B 455
GLY B 464
GLY B 466
SER B 454
LEU B 449
THR B 272
 None
None
None
None
668  B 501 (-4.9A)
668  B 501 (-4.5A)
 1.42A 4uckA-5hjpB:
undetectable		 4uckA-5hjpB:
19.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5kva CAFFEOYL-COA
O-METHYLTRANSFERASE

(Sorghum bicolor) 		PF01596
(Methyltransf_3) 		5 THR A  77
GLY A 101
GLY A 105
ALA A 154
ALA A 178
 SAM  A 301 (-3.5A)
SAM  A 301 (-3.4A)
SAM  A 301 ( 4.8A)
SAM  A 301 (-3.7A)
SAM  A 301 (-3.7A)
 0.90A 4uckA-5kvaA:
8.3		 4uckA-5kvaA:
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.
5l3d LYSINE-SPECIFIC
HISTONE DEMETHYLASE
1A

(Homo sapiens) 		PF01593
(Amino_oxidase)
PF04433
(SWIRM) 		5 GLY A 818
GLY A 800
SER A 817
LEU A 816
ALA A 292
 None
FAD  A 901 (-3.2A)
None
None
None
 0.95A 4uckA-5l3dA:
undetectable		 4uckA-5l3dA:
17.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5lhv URIDINE
PHOSPHORYLASE

(Vibrio cholerae) 		PF01048
(PNP_UDP_1) 		6 GLY A  69
GLU A 197
GLY A  67
GLY A  25
SER A  72
ALA A 118
 None
URI  A 303 (-2.7A)
NA  A 307 ( 4.0A)
SO4  A 301 (-3.3A)
NA  A 307 (-2.9A)
None
 1.27A 4uckA-5lhvA:
undetectable		 4uckA-5lhvA:
19.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5log PUTATIVE
O-METHYLTRANSFERASE

(Myxococcus
xanthus) 		PF01596
(Methyltransf_3) 		5 GLY A  67
GLY A  71
LEU A  92
ALA A 120
ALA A 143
 SAH  A1001 (-3.5A)
None
SAH  A1001 (-4.1A)
SAH  A1001 (-3.4A)
SAH  A1001 (-3.7A)
 0.73A 4uckA-5logA:
7.7		 4uckA-5logA:
21.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5m45 ACETONE CARBOXYLASE
BETA SUBUNIT

(Xanthobacter
autotrophicus) 		PF01968
(Hydantoinase_A)
PF05378
(Hydant_A_N) 		6 GLY B 353
GLY B 351
GLY B 311
SER B 354
THR B 387
ALA B 372
 None
None
AMP  B 801 (-3.5A)
None
None
None
 1.40A 4uckA-5m45B:
undetectable		 4uckA-5m45B:
20.28
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.
5min QUINOPROTEIN GLUCOSE
DEHYDROGENASE B

(Acinetobacter
calcoaceticus) 		no annotation 5 GLY A  81
GLY A  98
GLY A  78
ASN A  77
ALA A  83
 None
 0.88A 4uckA-5minA:
undetectable		 4uckA-5minA:
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.
5mq6 PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE-LIKE
PROTEIN

(Thermothelomyces
thermophila) 		PF07992
(Pyr_redox_2) 		5 GLY A 204
GLY A 206
LEU A  67
ALA A  69
ALA A  65
 None
 0.91A 4uckA-5mq6A:
undetectable		 4uckA-5mq6A:
19.60
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.
5ny0 L. REUTERIS SRRP
BINDING REGION

(Lactobacillus
reuteri) 		no annotation 5 GLY A 347
GLY A 319
ASN A 318
ALA A 447
ALA A 408
 None
 0.95A 4uckA-5ny0A:
undetectable		 4uckA-5ny0A:
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.
5o3z SORBITOL-6-PHOSPHATE
DEHYDROGENASE

(Erwinia
amylovora) 		no annotation 5 GLY A   9
GLY A  11
LEU A  34
ALA A  62
THR A  63
 None
 0.69A 4uckA-5o3zA:
5.5		 4uckA-5o3zA:
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.
5o3z SORBITOL-6-PHOSPHATE
DEHYDROGENASE

(Erwinia
amylovora) 		no annotation 5 GLY A   9
LEU A  34
ALA A  62
THR A  63
ALA A  89
 None
 0.92A 4uckA-5o3zA:
5.5		 4uckA-5o3zA:
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.
5o3z SORBITOL-6-PHOSPHATE
DEHYDROGENASE

(Erwinia
amylovora) 		no annotation 5 GLY A  10
LEU A  34
ALA A  62
THR A  63
ALA A  89
 None
 0.89A 4uckA-5o3zA:
5.5		 4uckA-5o3zA:
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.
5szs SPIKE GLYCOPROTEIN

(Human
coronavirus
NL63) 		PF01600
(Corona_S1)
PF01601
(Corona_S2) 		5 GLU A 375
GLY A 388
TRP A 235
ALA A 379
THR A 381
 None
None
None
None
NAG  A1405 ( 3.7A)
 0.97A 4uckA-5szsA:
undetectable		 4uckA-5szsA:
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.
5v6c HEMOLYSIN-RELATED
PROTEIN

(Vibrio cholerae) 		no annotation 5 THR A 831
GLY A 827
GLY A 952
SER A 891
ALA A 922
 None
 0.93A 4uckA-5v6cA:
undetectable		 4uckA-5v6cA:
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.
5wp4 PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE
1

(Arabidopsis
thaliana) 		no annotation 5 GLY A 290
GLY A 292
GLY A 294
LEU A 313
THR A 340
 SAH  A 703 (-4.0A)
SAH  A 703 ( 3.7A)
None
SAH  A 703 (-4.1A)
SAH  A 703 ( 4.3A)
 0.83A 4uckA-5wp4A:
7.1		 4uckA-5wp4A:
20.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5wp5 PHOSPHOMETHYLETHANOL
AMINE
N-METHYLTRANSFERASE
2

(Arabidopsis
thaliana) 		no annotation 5 GLY A 290
GLY A 292
GLY A 294
LEU A 313
THR A 340
 SAH  A 501 (-3.8A)
SAH  A 501 (-3.6A)
None
SAH  A 501 (-3.9A)
SAH  A 501 ( 4.5A)
 0.80A 4uckA-5wp5A:
7.2		 4uckA-5wp5A:
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.
5wuf PUTATIVE MEMBRANE
PROTEIN

(Colwellia
psychrerythraea) 		PF03458
(UPF0126) 		5 GLY A  20
GLY A 132
SER A  19
LEU A  18
ALA A  38
 None
 0.88A 4uckA-5wufA:
undetectable		 4uckA-5wufA:
21.38
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.
5x7f PUTATIVE
O-METHYLTRANSFERASE
RV1220C

(Mycobacterium
tuberculosis) 		PF01596
(Methyltransf_3) 		5 GLY A  66
GLY A  68
GLY A  70
ALA A 120
ALA A 139
 SAM  A 301 (-3.5A)
SAM  A 301 (-3.4A)
SAM  A 301 ( 4.5A)
SAM  A 301 (-3.5A)
SAM  A 301 (-3.5A)
 0.61A 4uckA-5x7fA:
7.7		 4uckA-5x7fA:
18.31
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.
13pk 3-PHOSPHOGLYCERATE
KINASE

(Trypanosoma
brucei) 		PF00162
(PGK) 		3 SER A 380
ASP A 165
ASP A  37
 None
 0.74A 4uckA-13pkA:
2.1		 4uckA-13pkA:
22.47
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.
1ap8 TRANSLATION
INITIATION FACTOR
EIF4E

(Saccharomyces
cerevisiae) 		PF01652
(IF4E) 		3 SER A 210
ASP A  99
ASP A 171
 None
 0.81A 4uckA-1ap8A:
undetectable		 4uckA-1ap8A:
19.13
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.
1b04 PROTEIN (DNA LIGASE)

(Geobacillus
stearothermophilus) 		PF01653
(DNA_ligase_aden) 		3 SER A 213
ASP A 143
ASP A 207
 None
 0.79A 4uckA-1b04A:
undetectable		 4uckA-1b04A:
22.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1b0k PROTEIN (ACONITASE)

(Sus scrofa) 		PF00330
(Aconitase)
PF00694
(Aconitase_C) 		3 SER A 643
ASP A  67
ASP A 185
 FLC  A 756 (-2.8A)
None
None
 0.74A 4uckA-1b0kA:
undetectable		 4uckA-1b0kA:
20.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1cg2 CARBOXYPEPTIDASE G2

(Pseudomonas sp.
RS-16) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		3 SER A 111
ASP A 206
ASP A 141
 None
None
ZN  A 500 (-2.4A)
 0.82A 4uckA-1cg2A:
undetectable		 4uckA-1cg2A:
22.99
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.
1clw TAILSPIKE PROTEIN

(Salmonella
virus P22) 		PF09251
(PhageP22-tail) 		3 SER A 521
ASP A 531
ASP A 517
 None
 0.80A 4uckA-1clwA:
undetectable		 4uckA-1clwA:
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.
1e33 ARYLSULFATASE A

(Homo sapiens) 		PF00884
(Sulfatase)
PF14707
(Sulfatase_C) 		3 SER P 418
ASP P  30
ASP P 407
 None
MG  P 603 (-3.2A)
None
 0.81A 4uckA-1e33P:
undetectable		 4uckA-1e33P:
20.11
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.
1flc HAEMAGGLUTININ-ESTER
ASE-FUSION
GLYCOPROTEIN

(Influenza C
virus) 		PF02710
(Hema_HEFG)
PF03996
(Hema_esterase) 		3 SER A 290
ASP A 247
ASP A 257
 None
 0.78A 4uckA-1flcA:
undetectable		 4uckA-1flcA:
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.
1fnn CELL DIVISION
CONTROL PROTEIN 6

(Pyrobaculum
aerophilum) 		PF09079
(Cdc6_C)
PF13401
(AAA_22) 		3 SER A 366
ASP A 199
ASP A 217
 None
 0.70A 4uckA-1fnnA:
undetectable		 4uckA-1fnnA:
23.25
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.
1gji C-REL PROTO-ONCOGENE
PROTEIN

(Gallus gallus) 		PF00554
(RHD_DNA_bind)
PF16179
(RHD_dimer) 		3 SER A 266
ASP A 234
ASP A 213
 None
 0.74A 4uckA-1gjiA:
undetectable		 4uckA-1gjiA:
21.38
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.
1hr7 MITOCHONDRIAL
PROCESSING PEPTIDASE
ALPHA SUBUNIT

(Saccharomyces
cerevisiae) 		PF00675
(Peptidase_M16)
PF05193
(Peptidase_M16_C) 		3 SER A  33
ASP A  47
ASP A 391
 None
 0.79A 4uckA-1hr7A:
undetectable		 4uckA-1hr7A:
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.
1i6q LACTOFERRIN

(Camelus
dromedarius) 		PF00405
(Transferrin) 		3 SER A 122
ASP A 302
ASP A  60
 CO3  A 692 (-4.1A)
None
None
 0.77A 4uckA-1i6qA:
undetectable		 4uckA-1i6qA:
19.51
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.
1j71 ASPARTIC PROTEINASE

(Candida
tropicalis) 		PF00026
(Asp) 		3 SER A 329
ASP A 312
ASP A   2
 None
EOH  A 573 ( 4.5A)
None
 0.77A 4uckA-1j71A:
undetectable		 4uckA-1j71A:
23.13
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.
1kcw CERULOPLASMIN

(Homo sapiens) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		3 SER A 172
ASP A 128
ASP A 165
 None
 0.83A 4uckA-1kcwA:
undetectable		 4uckA-1kcwA:
17.05
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.
1knl ENDO-1,4-BETA-XYLANA
SE A

(Streptomyces
lividans) 		PF00652
(Ricin_B_lectin) 		3 SER A  13
ASP A  21
ASP A  34
 None
GOL  A 531 (-4.1A)
None
 0.79A 4uckA-1knlA:
undetectable		 4uckA-1knlA:
12.66
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.
1laj CAPSID PROTEIN

(Tomato aspermy
virus) 		PF00760
(Cucumo_coat) 		3 SER A 119
ASP A  74
ASP A 196
 None
 0.82A 4uckA-1lajA:
undetectable		 4uckA-1lajA:
19.32
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.
1mio NITROGENASE
MOLYBDENUM IRON
PROTEIN (BETA CHAIN)

(Clostridium
pasteurianum) 		PF00148
(Oxidored_nitro) 		3 SER B 366
ASP B 322
ASP B 355
 None
 0.76A 4uckA-1mioB:
undetectable		 4uckA-1mioB:
22.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1mpo MALTOPORIN

(Escherichia
coli) 		PF02264
(LamB) 		3 SER A 333
ASP A 237
ASP A 300
 None
 0.80A 4uckA-1mpoA:
undetectable		 4uckA-1mpoA:
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.
1n7d LOW-DENSITY
LIPOPROTEIN RECEPTOR

(Homo sapiens) 		PF00057
(Ldl_recept_a)
PF00058
(Ldl_recept_b)
PF07645
(EGF_CA)
PF14670
(FXa_inhibition) 		3 SER A 185
ASP A 601
ASP A 200
 None
None
CA  A1003 (-2.6A)
 0.66A 4uckA-1n7dA:
undetectable		 4uckA-1n7dA:
18.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1n8p CYSTATHIONINE
GAMMA-LYASE

(Saccharomyces
cerevisiae) 		PF01053
(Cys_Met_Meta_PP) 		3 SER A 340
ASP A 274
ASP A 383
 None
 0.51A 4uckA-1n8pA:
undetectable		 4uckA-1n8pA:
23.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1o94 ELECTRON TRANSFER
FLAVOPROTEIN
BETA-SUBUNIT

(Methylophilus
methylotrophus) 		PF01012
(ETF) 		3 SER C 123
ASP C  70
ASP C  39
 None
None
AMP  C1236 (-2.6A)
 0.74A 4uckA-1o94C:
undetectable		 4uckA-1o94C:
21.17
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.
1obb ALPHA-GLUCOSIDASE

(Thermotoga
maritima) 		PF02056
(Glyco_hydro_4)
PF11975
(Glyco_hydro_4C) 		3 SER A 143
ASP A  39
ASP A  72
 None
NAD  A 500 (-2.7A)
None
 0.72A 4uckA-1obbA:
3.0		 4uckA-1obbA:
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.
1q15 CARA

(Pectobacterium
carotovorum) 		PF00733
(Asn_synthase)
PF09147
(DUF1933) 		3 SER A  58
ASP A 239
ASP A 233
 None
 0.69A 4uckA-1q15A:
undetectable		 4uckA-1q15A:
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.
1r6a GENOME POLYPROTEIN

(Dengue virus) 		PF01728
(FtsJ) 		3 SER A  56
ASP A 131
ASP A 146
 SAH  A 887 ( 2.8A)
SAH  A 887 ( 3.3A)
SAH  A 887 (-3.9A)
 0.70A 4uckA-1r6aA:
9.0		 4uckA-1r6aA:
18.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1r6v SUBTILISIN-LIKE
SERINE PROTEASE

(Fervidobacterium
pennivorans) 		PF00082
(Peptidase_S8) 		3 SER A 202
ASP A 254
ASP A 170
 None
 0.81A 4uckA-1r6vA:
undetectable		 4uckA-1r6vA:
19.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1rkv HOMOSERINE KINASE

(Pseudomonas
aeruginosa) 		PF12710
(HAD) 		3 SER A 153
ASP A  38
ASP A  91
 MG  A 401 ( 3.9A)
None
PO4  A 320 (-4.6A)
 0.65A 4uckA-1rkvA:
undetectable		 4uckA-1rkvA:
18.57
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.
1ryn PROTEIN CRS2

(Zea mays) 		PF01195
(Pept_tRNA_hydro) 		3 SER A  97
ASP A 163
ASP A  94
 SER  A  97 ( 0.0A)
ASP  A 163 ( 0.6A)
ASP  A  94 ( 0.6A)
 0.78A 4uckA-1rynA:
undetectable		 4uckA-1rynA:
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.
1ryo SEROTRANSFERRIN

(Homo sapiens) 		PF00405
(Transferrin) 		3 SER A 125
ASP A  47
ASP A  69
 OXL  A 328 ( 4.6A)
None
None
 0.73A 4uckA-1ryoA:
undetectable		 4uckA-1ryoA:
21.38
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.
1tt7 YHFP

(Bacillus
subtilis) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		3 SER A  91
ASP A 223
ASP A 272
 None
 0.79A 4uckA-1tt7A:
undetectable		 4uckA-1tt7A:
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.
1udq RIBONUCLEASE PH

(Aquifex
aeolicus) 		PF01138
(RNase_PH)
PF03725
(RNase_PH_C) 		3 SER A 198
ASP A 139
ASP A 157
 None
 0.79A 4uckA-1udqA:
undetectable		 4uckA-1udqA:
19.95
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.
1vko INOSITOL-3-PHOSPHATE
SYNTHASE

(Caenorhabditis
elegans) 		PF01658
(Inos-1-P_synth)
PF07994
(NAD_binding_5) 		3 SER A 367
ASP A 438
ASP A 312
 None
None
NAD  A 601 (-3.7A)
 0.75A 4uckA-1vkoA:
undetectable		 4uckA-1vkoA:
20.14
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.
1wad CYTOCHROME C3

(Desulfovibrio
gigas) 		PF02085
(Cytochrom_CIII) 		3 SER A  64
ASP A  11
ASP A  59
 None
CA  A 116 ( 3.3A)
None
 0.80A 4uckA-1wadA:
undetectable		 4uckA-1wadA:
16.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wom SIGMA FACTOR SIGB
REGULATION PROTEIN
RSBQ

(Bacillus
subtilis) 		PF12697
(Abhydrolase_6) 		3 SER A 198
ASP A  64
ASP A  72
 None
 0.81A 4uckA-1womA:
undetectable		 4uckA-1womA:
20.47
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.
1xfk FORMIMIDOYLGLUTAMASE

(Vibrio cholerae) 		PF00491
(Arginase) 		3 SER A 176
ASP A 306
ASP A 256
 None
 0.63A 4uckA-1xfkA:
undetectable		 4uckA-1xfkA:
22.48
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.
1yew PARTICULATE METHANE
MONOOXYGENASE, B
SUBUNIT

(Methylococcus
capsulatus) 		PF04744
(Monooxygenase_B) 		3 SER A 412
ASP A 406
ASP A 288
 None
 0.68A 4uckA-1yewA:
undetectable		 4uckA-1yewA:
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.
2aaj MALONATE
SEMIALDEHYDE
DECARBOXYLASE

(Pseudomonas
pavonaceae) 		PF14552
(Tautomerase_2) 		3 SER A  72
ASP A  21
ASP A  37
 None
 0.60A 4uckA-2aajA:
undetectable		 4uckA-2aajA:
14.91
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.
2bbv PROTEIN (BLACK
BEETLE VIRUS CAPSID
PROTEIN)

(Black beetle
virus) 		PF01829
(Peptidase_A6) 		3 SER A 272
ASP A 295
ASP A 221
 None
None
CA  A 364 (-3.1A)
 0.70A 4uckA-2bbvA:
undetectable		 4uckA-2bbvA:
21.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2c3o PYRUVATE-FERREDOXIN
OXIDOREDUCTASE

(Desulfovibrio
africanus) 		PF01558
(POR)
PF01855
(POR_N)
PF02775
(TPP_enzyme_C)
PF10371
(EKR)
PF13484
(Fer4_16)
PF17147
(PFOR_II) 		3 SER A 371
ASP A 397
ASP A 652
 None
 0.72A 4uckA-2c3oA:
undetectable		 4uckA-2c3oA:
15.15
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.
2dj2 PROTEIN
DISULFIDE-ISOMERASE
A4

(Mus musculus) 		PF00085
(Thioredoxin) 		3 SER A   2
ASP A  25
ASP A  19
 None
 0.79A 4uckA-2dj2A:
undetectable		 4uckA-2dj2A:
14.22
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.
2dup VESICULAR
INTEGRAL-MEMBRANE
PROTEIN VIP36

(Canis lupus) 		PF03388
(Lectin_leg-like) 		3 SER A 270
ASP A 205
ASP A 212
 None
 0.61A 4uckA-2dupA:
undetectable		 4uckA-2dupA:
21.05
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.
2e0w GAMMA-GLUTAMYLTRANSP
EPTIDASE

(Escherichia
coli) 		PF01019
(G_glu_transpept) 		3 SER A 145
ASP A 240
ASP A 266
 None
 0.74A 4uckA-2e0wA:
undetectable		 4uckA-2e0wA:
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.
2e5v L-ASPARTATE OXIDASE

(Sulfurisphaera
tokodaii) 		PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C) 		3 SER A  47
ASP A 316
ASP A  60
 None
 0.80A 4uckA-2e5vA:
undetectable		 4uckA-2e5vA:
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.
2eta TRANSIENT RECEPTOR
POTENTIAL CATION
CHANNEL SUBFAMILY V
MEMBER 2

(Rattus
norvegicus) 		PF12796
(Ank_2) 		3 SER A 146
ASP A  78
ASP A 108
 None
 0.79A 4uckA-2etaA:
undetectable		 4uckA-2etaA:
23.36
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.
2i0e PROTEIN KINASE
C-BETA II

(Homo sapiens) 		PF00069
(Pkinase)
PF00433
(Pkinase_C) 		3 SER A 552
ASP A 523
ASP A 506
 None
 0.79A 4uckA-2i0eA:
undetectable		 4uckA-2i0eA:
20.96
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.
2jwp MALECTIN

(Xenopus laevis) 		PF11721
(Malectin) 		3 SER A  53
ASP A 116
ASP A 128
 None
 0.78A 4uckA-2jwpA:
undetectable		 4uckA-2jwpA:
16.46
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.
2o57 PUTATIVE SARCOSINE
DIMETHYLGLYCINE
METHYLTRANSFERASE

(Galdieria
sulphuraria) 		PF08241
(Methyltransf_11) 		3 SER A  63
ASP A  28
ASP A 158
 None
 0.77A 4uckA-2o57A:
5.6		 4uckA-2o57A:
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.
2oas 4-HYDROXYBUTYRATE
COENZYME A
TRANSFERASE

(Shewanella
oneidensis) 		PF02550
(AcetylCoA_hydro)
PF13336
(AcetylCoA_hyd_C) 		3 SER A 128
ASP A 237
ASP A 276
 None
 0.65A 4uckA-2oasA:
undetectable		 4uckA-2oasA:
23.28
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.
2obv S-ADENOSYLMETHIONINE
SYNTHETASE ISOFORM
TYPE-1

(Homo sapiens) 		PF00438
(S-AdoMet_synt_N)
PF02772
(S-AdoMet_synt_M)
PF02773
(S-AdoMet_synt_C) 		3 SER A  73
ASP A  35
ASP A 286
 None
 0.60A 4uckA-2obvA:
undetectable		 4uckA-2obvA:
22.25
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.
2odt INOSITOL-TETRAKISPHO
SPHATE 1-KINASE

(Homo sapiens) 		PF05770
(Ins134_P3_kin) 		3 SER X 214
ASP X 259
ASP X 281
 None
 0.73A 4uckA-2odtX:
undetectable		 4uckA-2odtX:
20.67
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.
2oy0 METHYLTRANSFERASE

(West Nile virus) 		PF01728
(FtsJ) 		3 SER A  56
ASP A 131
ASP A 146
 SAH  A 301 (-3.0A)
SAH  A 301 (-3.2A)
SAH  A 301 (-4.2A)
 0.62A 4uckA-2oy0A:
9.4		 4uckA-2oy0A:
19.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ozz HYPOTHETICAL PROTEIN
YHFZ

(Shigella
flexneri) 		PF14503
(YhfZ_C) 		3 SER A  75
ASP A 138
ASP A 120
 None
 0.79A 4uckA-2ozzA:
undetectable		 4uckA-2ozzA:
20.26
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.
2pvs PANCREATIC
LIPASE-RELATED
PROTEIN 2

(Homo sapiens) 		PF00151
(Lipase)
PF01477
(PLAT) 		3 SER A 152
ASP A  34
ASP A  79
 None
 0.80A 4uckA-2pvsA:
undetectable		 4uckA-2pvsA:
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.
2px5 GENOME POLYPROTEIN
[CONTAINS: CAPSID
PROTEIN C (CORE
PROTEIN)
ENVELOPE PROTEIN M
(MATRIX PROTEIN)
MAJOR ENVELOPE
PROTEIN E
NON-STRUCTURAL
PROTEIN 1 (NS1)
NON-STRUCTURAL
PROTEIN 2A (NS2A)
FLAVIVIRIN PROTEASE
NS2B REGULATORY
SUBUNIT
FLAVIVIRIN PROTEASE
NS3 CATALYTIC
SUBUNIT
NON-STRUCTURAL
PROTEIN 4A (NS4A)
NON-STRUCTURAL
PROTEIN 4B (NS4B)
RNA-DIRECTED RNA
POLYMERASE (EC
2.7.7.48) (NS5)]

(Murray Valley
encephalitis
virus) 		PF01728
(FtsJ) 		3 SER A  56
ASP A 131
ASP A 146
 SAH  A 500 (-2.5A)
SAH  A 500 (-3.5A)
SAH  A 500 (-3.6A)
 0.66A 4uckA-2px5A:
8.6		 4uckA-2px5A:
20.47
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.
2qe8 UNCHARACTERIZED
PROTEIN

(Trichormus
variabilis) 		PF03022
(MRJP) 		3 SER A 105
ASP A 123
ASP A  74
 GOL  A 349 (-2.7A)
UNL  A 344 (-3.7A)
GOL  A 349 ( 4.9A)
 0.78A 4uckA-2qe8A:
undetectable		 4uckA-2qe8A:
21.48
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.
2qza SECRETED EFFECTOR
PROTEIN

(Salmonella
enterica) 		PF13599
(Pentapeptide_4)
PF13979
(SopA_C)
PF13981
(SopA) 		3 SER A 236
ASP A 196
ASP A 201
 None
 0.78A 4uckA-2qzaA:
undetectable		 4uckA-2qzaA:
20.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2rag DIPEPTIDASE

(Caulobacter
vibrioides) 		PF01244
(Peptidase_M19) 		3 SER A 161
ASP A 236
ASP A 226
 None
 0.79A 4uckA-2ragA:
undetectable		 4uckA-2ragA:
21.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2rcc RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE
SUBUNIT BETA

(Bacillus
halodurans) 		PF00268
(Ribonuc_red_sm) 		3 SER A 124
ASP A 181
ASP A 218
 None
 0.75A 4uckA-2rccA:
undetectable		 4uckA-2rccA:
21.89
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.
2rk9 GLYOXALASE/BLEOMYCIN
RESISTANCE
PROTEIN/DIOXYGENASE

(Vibrio
splendidus) 		no annotation 3 SER A 107
ASP A  83
ASP A 135
 None
 0.83A 4uckA-2rk9A:
undetectable		 4uckA-2rk9A:
17.75
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.
2vfa HYPOXANTHINE-GUANINE
-XANTHINE
PHOSPHORIBOSYLTRANSF
ERASE,
HYPOXANTHINE-GUANINE
PHOSPHORIBOSYLTRANSF
ERASE

(Plasmodium
falciparum;
Homo sapiens) 		PF00156
(Pribosyltran) 		3 SER A 200
ASP A  60
ASP A  85
 None
 0.80A 4uckA-2vfaA:
2.3		 4uckA-2vfaA:
21.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vpw THIOSULFATE
REDUCTASE

(Thermus
thermophilus) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4) 		3 SER A 105
ASP A 466
ASP A 477
 None
MGD  A1765 (-2.8A)
None
 0.76A 4uckA-2vpwA:
undetectable		 4uckA-2vpwA:
20.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2x05 EXO-BETA-D-GLUCOSAMI
NIDASE

(Amycolatopsis
orientalis) 		PF00703
(Glyco_hydro_2)
PF02837
(Glyco_hydro_2_N) 		3 SER A 540
ASP A 473
ASP A 469
 None
None
X05  A1900 (-3.2A)
 0.82A 4uckA-2x05A:
undetectable		 4uckA-2x05A:
17.17
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.
2yfu CARBOHYDRATE BINDING
FAMILY 6

(Ruminiclostridium
thermocellum) 		no annotation 3 SER A 125
ASP A  30
ASP A  36
 None
None
GOL  A1142 (-2.8A)
 0.68A 4uckA-2yfuA:
undetectable		 4uckA-2yfuA:
18.80
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.
2zc2 DNAD-LIKE
REPLICATION PROTEIN

(Streptococcus
mutans) 		PF07261
(DnaB_2) 		3 SER A 163
ASP A 153
ASP A 157
 None
 0.76A 4uckA-2zc2A:
undetectable		 4uckA-2zc2A:
13.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zyi LIPASE, PUTATIVE

(Archaeoglobus
fulgidus) 		PF00561
(Abhydrolase_1) 		3 SER A 148
ASP A  61
ASP A 108
 None
 0.77A 4uckA-2zyiA:
undetectable		 4uckA-2zyiA:
21.05
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.
3axi OLIGO-1,6-GLUCOSIDAS
E IMA1

(Saccharomyces
cerevisiae) 		PF00128
(Alpha-amylase) 		3 SER A 588
ASP A 519
ASP A 555
 None
 0.81A 4uckA-3axiA:
undetectable		 4uckA-3axiA:
22.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bg0 NUCLEOPORIN NUP145

(Saccharomyces
cerevisiae) 		PF12110
(Nup96) 		3 SER B 213
ASP B 186
ASP B 219
 None
 0.45A 4uckA-3bg0B:
undetectable		 4uckA-3bg0B:
22.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bji PROTO-ONCOGENE VAV

(Homo sapiens) 		PF00130
(C1_1)
PF00169
(PH)
PF00621
(RhoGEF) 		3 SER A 291
ASP A 211
ASP A 324
 None
 0.81A 4uckA-3bjiA:
undetectable		 4uckA-3bjiA:
21.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3buz IOTA TOXIN COMPONENT
IA

(Clostridium
perfringens) 		PF03496
(ADPrib_exo_Tox) 		3 SER A 229
ASP A 212
ASP A 221
 None
 0.81A 4uckA-3buzA:
undetectable		 4uckA-3buzA:
24.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cn7 CARBOXYLESTERASE

(Pseudomonas
aeruginosa) 		PF02230
(Abhydrolase_2) 		3 SER A  65
ASP A 145
ASP A  79
 None
 0.82A 4uckA-3cn7A:
undetectable		 4uckA-3cn7A:
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.
3crj TRANSCRIPTION
REGULATOR

(Haloarcula
marismortui) 		PF00440
(TetR_N)
PF13977
(TetR_C_6) 		3 SER A 159
ASP A 144
ASP A 152
 None
 0.71A 4uckA-3crjA:
undetectable		 4uckA-3crjA:
19.66
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.
3d3f YVGN PROTEIN

(Bacillus
subtilis) 		PF00248
(Aldo_ket_red) 		3 SER A 213
ASP A   7
ASP A 244
 NDP  A   1 ( 4.9A)
None
None
 0.78A 4uckA-3d3fA:
undetectable		 4uckA-3d3fA:
21.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dz1 DIHYDRODIPICOLINATE
SYNTHASE

(Rhodopseudomonas
palustris) 		PF00701
(DHDPS) 		3 SER A 275
ASP A  57
ASP A  21
 None
 0.70A 4uckA-3dz1A:
undetectable		 4uckA-3dz1A:
21.93
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.
3e3m TRANSCRIPTIONAL
REGULATOR, LACI
FAMILY

(Ruegeria
pomeroyi) 		PF13377
(Peripla_BP_3) 		3 SER A  89
ASP A 257
ASP A 302
 None
 0.72A 4uckA-3e3mA:
undetectable		 4uckA-3e3mA:
23.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3eb8 CYSTEINE
PROTEASE-LIKE VIRA

(Shigella
flexneri) 		PF06872
(EspG) 		3 SER A 346
ASP A 214
ASP A 189
 None
 0.75A 4uckA-3eb8A:
undetectable		 4uckA-3eb8A:
21.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3eh7 4-HYDROXYBUTYRATE
COA-TRANSFERASE

(Porphyromonas
gingivalis) 		PF02550
(AcetylCoA_hydro)
PF13336
(AcetylCoA_hyd_C) 		3 SER A 134
ASP A 243
ASP A 282
 None
 0.61A 4uckA-3eh7A:
undetectable		 4uckA-3eh7A:
22.93
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.
3evc RNA-DIRECTED RNA
POLYMERASE NS5

(Yellow fever
virus) 		PF01728
(FtsJ) 		3 SER A  56
ASP A 131
ASP A 146
 SAH  A 901 (-2.6A)
SAH  A 901 (-3.7A)
SAH  A 901 (-3.8A)
 0.78A 4uckA-3evcA:
9.3		 4uckA-3evcA:
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.
3gcz POLYPROTEIN

(Yokose virus) 		PF01728
(FtsJ) 		3 SER A  56
ASP A 131
ASP A 146
 SAM  A4633 (-2.7A)
SAM  A4633 (-3.7A)
SAM  A4633 (-3.7A)
 0.78A 4uckA-3gczA:
9.6		 4uckA-3gczA:
21.26
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.
3gdo UNCHARACTERIZED
OXIDOREDUCTASE YVAA

(Bacillus
subtilis) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		3 SER A 305
ASP A 192
ASP A 262
 None
 0.77A 4uckA-3gdoA:
2.5		 4uckA-3gdoA:
21.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gnu 25 KDA PROTEIN
ELICITOR

(Pythium
aphanidermatum) 		PF05630
(NPP1) 		3 SER P 126
ASP P 191
ASP P 104
 None
 0.80A 4uckA-3gnuP:
undetectable		 4uckA-3gnuP:
18.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hgo 12-OXOPHYTODIENOATE
REDUCTASE 3

(Solanum
lycopersicum) 		PF00724
(Oxidored_FMN) 		3 SER A 254
ASP A 205
ASP A 198
 None
 0.81A 4uckA-3hgoA:
undetectable		 4uckA-3hgoA:
22.35
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.
3hkz DNA-DIRECTED RNA
POLYMERASE SUBUNIT
A'

(Sulfolobus
solfataricus) 		PF00623
(RNA_pol_Rpb1_2)
PF04983
(RNA_pol_Rpb1_3)
PF04997
(RNA_pol_Rpb1_1)
PF04998
(RNA_pol_Rpb1_5)
PF05000
(RNA_pol_Rpb1_4) 		3 SER A 287
ASP A  46
ASP A 234
 None
 0.79A 4uckA-3hkzA:
undetectable		 4uckA-3hkzA:
18.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hpf MUCONATE
CYCLOISOMERASE

(Oceanobacillus
iheyensis) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 SER A 268
ASP A 384
ASP A 322
 None
 0.82A 4uckA-3hpfA:
undetectable		 4uckA-3hpfA:
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.
3hr6 PUTATIVE
SURFACE-ANCHORED
FIMBRIAL SUBUNIT

(Corynebacterium
diphtheriae) 		no annotation 3 SER A  88
ASP A 335
ASP A 341
 None
 0.57A 4uckA-3hr6A:
undetectable		 4uckA-3hr6A:
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.
3hvd PROTECTIVE ANTIGEN

(Bacillus
anthracis) 		PF03495
(Binary_toxB)
PF17475
(Binary_toxB_2)
PF17476
(Binary_toxB_3) 		3 SER A 296
ASP A 608
ASP A 599
 None
 0.77A 4uckA-3hvdA:
undetectable		 4uckA-3hvdA:
22.36
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.
3i0w 8-OXOGUANINE-DNA-GLY
COSYLASE

(Clostridium
acetobutylicum) 		PF00730
(HhH-GPD)
PF07934
(OGG_N) 		3 SER A 121
ASP A  80
ASP A 114
 None
None
EDO  A 292 (-4.0A)
 0.80A 4uckA-3i0wA:
undetectable		 4uckA-3i0wA:
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.
3ik4 MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN

(Herpetosiphon
aurantiacus) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 SER A 148
ASP A 168
ASP A 141
 None
 0.73A 4uckA-3ik4A:
undetectable		 4uckA-3ik4A:
23.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jro FUSION PROTEIN OF
PROTEIN TRANSPORT
PROTEIN SEC13 AND
NUCLEOPORIN NUP145

(Saccharomyces
cerevisiae) 		PF00400
(WD40)
PF12110
(Nup96) 		3 SER A1214
ASP A1187
ASP A1220
 None
 0.51A 4uckA-3jroA:
undetectable		 4uckA-3jroA:
20.26
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.
3kog PUTATIVE
PORE-FORMING TOXIN

(Bacteroides
vulgatus) 		PF12985
(DUF3869) 		3 SER A 131
ASP A 183
ASP A 240
 None
 0.58A 4uckA-3kogA:
undetectable		 4uckA-3kogA:
19.43
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.
3krs TRIOSEPHOSPHATE
ISOMERASE

(Cryptosporidium
parvum) 		PF00121
(TIM) 		3 SER A  65
ASP A 158
ASP A  91
 None
 0.74A 4uckA-3krsA:
undetectable		 4uckA-3krsA:
21.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3l2k EHPF

(Pantoea
agglomerans) 		PF00501
(AMP-binding) 		3 SER A 280
ASP A 345
ASP A 349
 None
 0.82A 4uckA-3l2kA:
undetectable		 4uckA-3l2kA:
20.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lkz NON-STRUCTURAL
PROTEIN 5

(West Nile virus) 		PF01728
(FtsJ) 		3 SER A  56
ASP A 131
ASP A 146
 SFG  A 301 (-2.6A)
SFG  A 301 (-3.1A)
SFG  A 301 (-3.8A)
 0.56A 4uckA-3lkzA:
8.8		 4uckA-3lkzA:
19.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ll3 GLUCONATE KINASE

(Lactobacillus
acidophilus) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		3 SER A 404
ASP A 310
ASP A 320
 ATP  A1760 ( 4.7A)
None
None
 0.53A 4uckA-3ll3A:
undetectable		 4uckA-3ll3A:
23.95
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.
3lte RESPONSE REGULATOR

(Bermanella
marisrubri) 		PF00072
(Response_reg) 		3 SER A 132
ASP A  74
ASP A 125
 None
 0.83A 4uckA-3lteA:
undetectable		 4uckA-3lteA:
16.87
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.
3lvv GLUTAMATE--CYSTEINE
LIGASE

(Saccharomyces
cerevisiae) 		PF03074
(GCS) 		3 SER A 628
ASP A 256
ASP A 229
 None
 0.80A 4uckA-3lvvA:
undetectable		 4uckA-3lvvA:
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.
3n6x PUTATIVE
GLUTATHIONYLSPERMIDI
NE SYNTHASE

(Methylobacillus
flagellatus) 		PF14403
(CP_ATPgrasp_2) 		3 SER A 349
ASP A 147
ASP A 319
 None
 0.80A 4uckA-3n6xA:
undetectable		 4uckA-3n6xA:
21.70
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.
3nur AMIDOHYDROLASE

(Staphylococcus
aureus) 		PF04909
(Amidohydro_2) 		3 SER A 285
ASP A 173
ASP A 242
 None
 0.79A 4uckA-3nurA:
undetectable		 4uckA-3nurA:
22.80
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.
3oit OS07G0271500 PROTEIN

(Oryza sativa) 		PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C) 		3 SER A 340
ASP A 286
ASP A 327
 None
 0.62A 4uckA-3oitA:
undetectable		 4uckA-3oitA:
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.
3pfq PROTEIN KINASE C
BETA TYPE

(Rattus
norvegicus) 		PF00069
(Pkinase)
PF00130
(C1_1)
PF00168
(C2)
PF00433
(Pkinase_C) 		3 SER A 552
ASP A 523
ASP A 506
 None
 0.82A 4uckA-3pfqA:
undetectable		 4uckA-3pfqA:
21.19
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.
3pgv HALOACID
DEHALOGENASE-LIKE
HYDROLASE

(Klebsiella
pneumoniae) 		PF08282
(Hydrolase_3) 		3 SER A 190
ASP A 240
ASP A 218
 None
None
CA  A 267 ( 4.5A)
 0.74A 4uckA-3pgvA:
undetectable		 4uckA-3pgvA:
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.
3pu6 UNCHARACTERIZED
PROTEIN

(Wolinella
succinogenes) 		no annotation 3 SER A 131
ASP A  40
ASP A  15
 None
 0.81A 4uckA-3pu6A:
undetectable		 4uckA-3pu6A:
18.27