SIMILAR PATTERNS OF AMINO ACIDS FOR 1UTD_V_TRPV81

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.
1a5l UREASE (BETA
SUBUNIT)
UREASE (ALPHA
SUBUNIT)

(Klebsiella
aerogenes;
Klebsiella
aerogenes) 		PF00699
(Urease_beta)
PF00449
(Urease_alpha)
PF01979
(Amidohydro_1) 		5 GLY C  40
GLY C  56
HIS B  39
ALA C  99
ILE C 112
 None
 1.01A 1utdL-1a5lC:
undetectable
1utdV-1a5lC:
undetectable		 1utdL-1a5lC:
9.36
1utdV-1a5lC:
9.36
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.
1f6d UDP-N-ACETYLGLUCOSAM
INE 2-EPIMERASE

(Escherichia
coli) 		PF02350
(Epimerase_2) 		5 GLY A 357
SER A 299
GLY A 292
ALA A 297
ILE A 293
 None
CL  A1379 ( 4.6A)
UDP  A1377 (-3.1A)
None
None
 1.13A 1utdL-1f6dA:
undetectable
1utdV-1f6dA:
undetectable		 1utdL-1f6dA:
12.35
1utdV-1f6dA:
12.35
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.
1h3q SEDLIN

(Mus musculus) 		PF04628
(Sedlin_N) 		5 GLY A  11
HIS A  12
THR A  77
HIS A  80
ILE A   9
 None
 1.01A 1utdL-1h3qA:
undetectable
1utdV-1h3qA:
undetectable		 1utdL-1h3qA:
19.12
1utdV-1h3qA:
19.12
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.
1l5j ACONITATE HYDRATASE
2

(Escherichia
coli) 		PF00330
(Aconitase)
PF06434
(Aconitase_2_N)
PF11791
(Aconitase_B_N) 		5 THR A 417
SER A 245
GLY A 412
ALA A 510
THR A 500
 TRA  A 866 (-4.0A)
TRA  A 866 (-2.6A)
None
None
None
 1.10A 1utdL-1l5jA:
undetectable
1utdV-1l5jA:
undetectable		 1utdL-1l5jA:
7.07
1utdV-1l5jA:
7.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1n94 PROTEIN
FARNESYLTRANSFERASE
BETA SUBUNIT

(Rattus
norvegicus) 		PF00432
(Prenyltrans) 		5 GLY B 348
HIS B  80
THR B 363
HIS B  78
ILE B 107
 None
 1.14A 1utdL-1n94B:
undetectable
1utdV-1n94B:
undetectable		 1utdL-1n94B:
11.59
1utdV-1n94B:
11.59
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.
1tnu GERANYLGERANYL
TRANSFERASE TYPE I
BETA SUBUNIT

(Rattus
norvegicus) 		PF00432
(Prenyltrans) 		5 GLY B 262
GLY B 209
HIS B 219
THR B 223
ILE B 248
 None
None
MGM  B 379 (-3.7A)
None
None
 0.97A 1utdL-1tnuB:
undetectable
1utdV-1tnuB:
undetectable		 1utdL-1tnuB:
12.68
1utdV-1tnuB:
12.68
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.
1wd3 ALPHA-L-ARABINOFURAN
OSIDASE B

(Aspergillus
kawachii) 		PF05270
(AbfB)
PF09206
(ArabFuran-catal) 		5 GLY A 193
GLY A 296
ALA A 197
HIS A 194
ILE A 291
 None
 0.74A 1utdL-1wd3A:
0.2
1utdV-1wd3A:
0.2		 1utdL-1wd3A:
9.13
1utdV-1wd3A:
9.13
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.
1x1e 2-DEOXY-D-GLUCONATE
3-DEHYDROGENASE

(Thermus
thermophilus) 		PF13561
(adh_short_C2) 		5 GLY A  70
GLY A 122
HIS A  72
ALA A 113
ILE A 167
 None
 1.13A 1utdL-1x1eA:
undetectable
1utdV-1x1eA:
undetectable		 1utdL-1x1eA:
13.97
1utdV-1x1eA:
13.97
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.
1yy5 FMS1 PROTEIN

(Saccharomyces
cerevisiae) 		PF01593
(Amino_oxidase) 		5 SER A 495
GLY A  15
ALA A  23
THR A 252
ILE A  13
 None
FAD  A 803 (-3.2A)
None
FAD  A 803 (-4.6A)
None
 1.03A 1utdL-1yy5A:
undetectable
1utdV-1yy5A:
undetectable		 1utdL-1yy5A:
9.73
1utdV-1yy5A:
9.73
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.
1zuw GLUTAMATE RACEMASE 1

(Bacillus
subtilis) 		PF01177
(Asp_Glu_race) 		5 GLY A 184
THR A 186
HIS A 187
THR A 121
THR A 118
 None
DGL  A1301 (-3.1A)
DGL  A1301 (-4.2A)
None
DGL  A1301 (-3.5A)
 1.05A 1utdL-1zuwA:
undetectable
1utdV-1zuwA:
undetectable		 1utdL-1zuwA:
13.97
1utdV-1zuwA:
13.97
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.
2b24 NAPHTHALENE
DIOXYGENASE LARGE
SUBUNIT

(Rhodococcus sp.
NCIMB 12038) 		PF00355
(Rieske)
PF00848
(Ring_hydroxyl_A) 		5 GLY A 250
HIS A 249
HIS A 247
THR A 245
ILE A 243
 None
 0.99A 1utdL-2b24A:
undetectable
1utdV-2b24A:
undetectable		 1utdL-2b24A:
9.29
1utdV-2b24A:
9.29
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.
2b42 XYLANASE INHIBITOR-I

(Triticum
aestivum) 		PF14541
(TAXi_C)
PF14543
(TAXi_N) 		5 GLY A 119
THR A 100
HIS A  21
ALA A 141
ILE A  18
 None
 1.02A 1utdL-2b42A:
undetectable
1utdV-2b42A:
undetectable		 1utdL-2b42A:
10.50
1utdV-2b42A:
10.50
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.
2c79 GLYCOSIDE HYDROLASE,
FAMILY
11:CLOSTRIDIUM
CELLULOSOME ENZYME,
DOCKERIN TYPE
I:POLYSACCHARIDE

(Ruminiclostridium
thermocellum) 		PF01522
(Polysacc_deac_1) 		5 GLY A 533
GLY A 537
THR A 659
HIS A 534
THR A 510
 None
 1.01A 1utdL-2c79A:
undetectable
1utdV-2c79A:
undetectable		 1utdL-2c79A:
14.85
1utdV-2c79A:
14.85
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.
2d2x 2-DEOXY-SCYLLO-INOSO
SE SYNTHASE

(Bacillus
circulans) 		PF01761
(DHQ_synthase) 		5 GLY A 104
THR A 106
THR A 129
THR A 128
ILE A  49
 GOL  A 607 (-4.1A)
CO  A 603 (-4.0A)
GOL  A 607 (-3.3A)
None
None
 1.11A 1utdL-2d2xA:
undetectable
1utdV-2d2xA:
undetectable		 1utdL-2d2xA:
12.47
1utdV-2d2xA:
12.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2det TRNA-SPECIFIC
2-THIOURIDYLASE MNMA

(Escherichia
coli) 		PF03054
(tRNA_Me_trans) 		5 GLY A  14
THR A 189
SER A  18
ALA A  22
ILE A  67
 SO4  A5001 (-4.0A)
None
SO4  A5001 (-2.7A)
None
None
 0.95A 1utdL-2detA:
undetectable
1utdV-2detA:
undetectable		 1utdL-2detA:
11.89
1utdV-2detA:
11.89
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.
2dw4 LYSINE-SPECIFIC
HISTONE DEMETHYLASE
1

(Homo sapiens) 		PF01593
(Amino_oxidase)
PF04433
(SWIRM) 		5 SER A 817
GLY A 285
ALA A 293
THR A 624
ILE A 283
 None
FAD  A1001 (-3.2A)
None
FAD  A1001 (-4.9A)
None
 0.94A 1utdL-2dw4A:
undetectable
1utdV-2dw4A:
undetectable		 1utdL-2dw4A:
8.15
1utdV-2dw4A:
8.15
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.
2dwu GLUTAMATE RACEMASE

(Bacillus
anthracis) 		PF01177
(Asp_Glu_race) 		5 GLY A 187
THR A 189
ALA A  80
THR A 124
THR A 121
 None
DGL  A 278 (-3.0A)
None
None
DGL  A 278 (-3.6A)
 0.97A 1utdL-2dwuA:
undetectable
1utdV-2dwuA:
undetectable		 1utdL-2dwuA:
16.50
1utdV-2dwuA:
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.
2dwu GLUTAMATE RACEMASE

(Bacillus
anthracis) 		PF01177
(Asp_Glu_race) 		5 GLY A 187
THR A 189
HIS A 190
THR A 124
THR A 121
 None
DGL  A 278 (-3.0A)
DGL  A 278 ( 4.5A)
None
DGL  A 278 (-3.6A)
 1.04A 1utdL-2dwuA:
undetectable
1utdV-2dwuA:
undetectable		 1utdL-2dwuA:
16.50
1utdV-2dwuA:
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.
2fff PENICILLIN-BINDING
PROTEIN 1B

(Streptococcus
pneumoniae) 		PF00905
(Transpeptidase) 		5 GLY B 677
ALA B 688
THR B 417
HIS B 682
ILE B 676
 None
None
None
NI  B 901 (-2.8A)
None
 1.03A 1utdL-2fffB:
undetectable
1utdV-2fffB:
undetectable		 1utdL-2fffB:
11.03
1utdV-2fffB:
11.03
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.
2fja ADENYLYLSULFATE
REDUCTASE, SUBUNIT A
ADENYLYLSULFATE
REDUCTASE, SUBUNIT B

(Archaeoglobus
fulgidus;
Archaeoglobus
fulgidus) 		PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C)
PF12139
(APS-reductase_C)
PF13187
(Fer4_9) 		5 GLY A 456
GLY A 118
HIS A 115
ALA B 832
ILE B 837
 None
 1.04A 1utdL-2fjaA:
undetectable
1utdV-2fjaA:
undetectable		 1utdL-2fjaA:
7.47
1utdV-2fjaA:
7.47
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.
2gbx BIPHENYL
2,3-DIOXYGENASE
ALPHA SUBUNIT

(Sphingobium
yanoikuyae) 		PF00355
(Rieske)
PF00848
(Ring_hydroxyl_A) 		5 GLY A 162
GLY A 249
HIS A 248
HIS A 246
THR A 244
 None
 1.14A 1utdL-2gbxA:
undetectable
1utdV-2gbxA:
undetectable		 1utdL-2gbxA:
10.21
1utdV-2gbxA:
10.21
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.
2gtx METHIONINE
AMINOPEPTIDASE

(Escherichia
coli) 		PF00557
(Peptidase_M24) 		5 GLY A 172
GLY A 107
HIS A 106
THR A 202
THR A 237
 None
None
None
MN  A   1 ( 3.7A)
None
 0.94A 1utdL-2gtxA:
undetectable
1utdV-2gtxA:
undetectable		 1utdL-2gtxA:
18.59
1utdV-2gtxA:
18.59
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.
2gzm GLUTAMATE RACEMASE

(Bacillus
anthracis) 		PF01177
(Asp_Glu_race) 		5 GLY A 184
THR A 186
ALA A  77
THR A 121
THR A 118
 None
DGL  A 501 (-3.0A)
None
None
DGL  A 501 (-3.6A)
 0.99A 1utdL-2gzmA:
undetectable
1utdV-2gzmA:
undetectable		 1utdL-2gzmA:
13.75
1utdV-2gzmA:
13.75
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.
2gzm GLUTAMATE RACEMASE

(Bacillus
anthracis) 		PF01177
(Asp_Glu_race) 		5 GLY A 184
THR A 186
HIS A 187
THR A 121
THR A 118
 None
DGL  A 501 (-3.0A)
DGL  A 501 (-4.4A)
None
DGL  A 501 (-3.6A)
 1.05A 1utdL-2gzmA:
undetectable
1utdV-2gzmA:
undetectable		 1utdL-2gzmA:
13.75
1utdV-2gzmA:
13.75
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.
2jfq GLUTAMATE RACEMASE

(Staphylococcus
aureus) 		PF01177
(Asp_Glu_race) 		5 GLY A 183
THR A 185
ALA A  75
THR A 119
THR A 116
 None
DGL  A1267 (-2.8A)
None
None
DGL  A1267 (-3.7A)
 0.98A 1utdL-2jfqA:
undetectable
1utdV-2jfqA:
undetectable		 1utdL-2jfqA:
16.22
1utdV-2jfqA:
16.22
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.
2jfq GLUTAMATE RACEMASE

(Staphylococcus
aureus) 		PF01177
(Asp_Glu_race) 		5 GLY A 183
THR A 185
HIS A 186
THR A 119
THR A 116
 None
DGL  A1267 (-2.8A)
DGL  A1267 (-4.4A)
None
DGL  A1267 (-3.7A)
 1.05A 1utdL-2jfqA:
undetectable
1utdV-2jfqA:
undetectable		 1utdL-2jfqA:
16.22
1utdV-2jfqA:
16.22
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.
2o2c GLUCOSE-6-PHOSPHATE
ISOMERASE,
GLYCOSOMAL

(Trypanosoma
brucei) 		PF00342
(PGI) 		5 HIS A 230
ALA A 273
THR A 252
HIS A 199
ILE A 203
 None
 0.97A 1utdL-2o2cA:
undetectable
1utdV-2o2cA:
undetectable		 1utdL-2o2cA:
9.57
1utdV-2o2cA:
9.57
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.
2p1r LIPID KINASE YEGS

(Salmonella
enterica) 		PF00781
(DAGK_cat) 		5 GLY A  13
THR A  40
GLY A  68
ALA A  63
ILE A  70
 None
None
None
None
NA  A 300 (-4.9A)
 1.12A 1utdL-2p1rA:
2.2
1utdV-2p1rA:
2.3		 1utdL-2p1rA:
13.38
1utdV-2p1rA:
13.38
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.
2qcv PUTATIVE
5-DEHYDRO-2-DEOXYGLU
CONOKINASE

(Bacillus
halodurans) 		PF00294
(PfkB) 		5 GLY A  72
HIS A  71
ALA A  19
THR A  98
ILE A  66
 None
 0.98A 1utdL-2qcvA:
undetectable
1utdV-2qcvA:
undetectable		 1utdL-2qcvA:
15.70
1utdV-2qcvA:
15.70
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.
2rkb SERINE
DEHYDRATASE-LIKE

(Homo sapiens) 		PF00291
(PALP) 		5 GLY A 203
GLY A 174
ALA A 275
THR A 201
HIS A 205
 None
PLP  A 400 ( 3.3A)
PLP  A 400 ( 4.0A)
None
None
 1.08A 1utdL-2rkbA:
undetectable
1utdV-2rkbA:
undetectable		 1utdL-2rkbA:
12.38
1utdV-2rkbA:
12.38
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.
2vvt GLUTAMATE RACEMASE

(Enterococcus
faecalis) 		PF01177
(Asp_Glu_race) 		5 GLY A 184
THR A 186
ALA A  77
THR A 121
THR A 118
 None
DGL  A1270 (-3.0A)
None
None
DGL  A1270 (-3.6A)
 0.98A 1utdL-2vvtA:
undetectable
1utdV-2vvtA:
undetectable		 1utdL-2vvtA:
12.76
1utdV-2vvtA:
12.76
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.
2vvt GLUTAMATE RACEMASE

(Enterococcus
faecalis) 		PF01177
(Asp_Glu_race) 		5 GLY A 184
THR A 186
HIS A 187
THR A 121
THR A 118
 None
DGL  A1270 (-3.0A)
I24  A1269 (-3.9A)
None
DGL  A1270 (-3.6A)
 1.06A 1utdL-2vvtA:
undetectable
1utdV-2vvtA:
undetectable		 1utdL-2vvtA:
12.76
1utdV-2vvtA:
12.76
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.
2w4i GLUTAMATE RACEMASE

(Helicobacter
pylori) 		PF01177
(Asp_Glu_race) 		5 GLY A 180
THR A 182
HIS A 183
THR A 119
THR A 116
 None
DGL  A1256 (-3.1A)
DGL  A1256 ( 4.5A)
None
DGL  A1256 (-3.5A)
 1.07A 1utdL-2w4iA:
undetectable
1utdV-2w4iA:
undetectable		 1utdL-2w4iA:
14.79
1utdV-2w4iA:
14.79
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.
2y8u CHITIN DEACETYLASE

(Aspergillus
nidulans) 		PF01522
(Polysacc_deac_1) 		5 GLY A  91
GLY A  95
THR A 223
HIS A  92
THR A  69
 None
 0.97A 1utdL-2y8uA:
undetectable
1utdV-2y8uA:
undetectable		 1utdL-2y8uA:
14.60
1utdV-2y8uA:
14.60
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.
2yv1 SUCCINYL-COA LIGASE
[ADP-FORMING]
SUBUNIT ALPHA

(Methanocaldococcus
jannaschii) 		PF00549
(Ligase_CoA)
PF02629
(CoA_binding) 		5 GLY A 160
THR A 163
GLY A 131
THR A 129
ILE A 125
 None
 1.14A 1utdL-2yv1A:
undetectable
1utdV-2yv1A:
undetectable		 1utdL-2yv1A:
13.90
1utdV-2yv1A:
13.90
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.
3b9g IAG-NUCLEOSIDE
HYDROLASE

(Trypanosoma
vivax) 		PF01156
(IU_nuc_hydro) 		5 THR A 295
GLY A 166
ALA A 194
THR A 284
ILE A 187
 None
 1.03A 1utdL-3b9gA:
undetectable
1utdV-3b9gA:
undetectable		 1utdL-3b9gA:
13.11
1utdV-3b9gA:
13.11
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.
3bbl REGULATORY PROTEIN
OF LACI FAMILY

(Chloroflexus
aggregans) 		PF13377
(Peripla_BP_3) 		5 GLY A 227
GLY A 281
ALA A 262
THR A 253
ILE A 279
 None
 1.11A 1utdL-3bblA:
undetectable
1utdV-3bblA:
undetectable		 1utdL-3bblA:
14.08
1utdV-3bblA:
14.08
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.
3bil PROBABLE LACI-FAMILY
TRANSCRIPTIONAL
REGULATOR

(Corynebacterium
glutamicum) 		PF13407
(Peripla_BP_4) 		5 GLY A 187
THR A 243
GLY A 274
ALA A 174
ILE A 291
 None
 1.05A 1utdL-3bilA:
undetectable
1utdV-3bilA:
undetectable		 1utdL-3bilA:
12.79
1utdV-3bilA:
12.79
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.
3cb5 FACT COMPLEX SUBUNIT
SPT16

(Schizosaccharomyces
pombe) 		PF00557
(Peptidase_M24)
PF14826
(FACT-Spt16_Nlob) 		5 GLY A 295
ALA A 187
THR A 426
THR A 414
ILE A 184
 None
 0.98A 1utdL-3cb5A:
undetectable
1utdV-3cb5A:
undetectable		 1utdL-3cb5A:
9.95
1utdV-3cb5A:
9.95
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.
3d8x THIOREDOXIN
REDUCTASE 1

(Saccharomyces
cerevisiae) 		PF07992
(Pyr_redox_2) 		5 GLY A 220
GLY A 138
ALA A 216
THR A 133
ILE A 139
 None
 1.01A 1utdL-3d8xA:
undetectable
1utdV-3d8xA:
undetectable		 1utdL-3d8xA:
13.12
1utdV-3d8xA:
13.12
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.
3fmq METHIONINE
AMINOPEPTIDASE 2

(Encephalitozoon
cuniculi) 		PF00557
(Peptidase_M24) 		5 GLY A 332
GLY A 251
ALA A 107
THR A 247
ILE A 204
 None
 0.93A 1utdL-3fmqA:
undetectable
1utdV-3fmqA:
undetectable		 1utdL-3fmqA:
13.14
1utdV-3fmqA:
13.14
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.
3iwj PUTATIVE
AMINOALDEHYDE
DEHYDROGENASE

(Pisum sativum) 		PF00171
(Aldedh) 		5 GLY A 396
GLY A 363
ALA A 352
THR A 378
ILE A 359
 None
 0.93A 1utdL-3iwjA:
undetectable
1utdV-3iwjA:
undetectable		 1utdL-3iwjA:
10.54
1utdV-3iwjA:
10.54
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.
3iwk AMINOALDEHYDE
DEHYDROGENASE

(Pisum sativum) 		PF00171
(Aldedh) 		5 GLY A 396
GLY A 363
ALA A 352
THR A 378
ILE A 359
 None
 0.93A 1utdL-3iwkA:
undetectable
1utdV-3iwkA:
undetectable		 1utdL-3iwkA:
10.34
1utdV-3iwkA:
10.34
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.
3la4 UREASE

(Canavalia
ensiformis) 		PF00449
(Urease_alpha)
PF00547
(Urease_gamma)
PF00699
(Urease_beta)
PF01979
(Amidohydro_1) 		5 GLY A 310
GLY A 326
HIS A 170
ALA A 370
ILE A 385
 None
 0.90A 1utdL-3la4A:
undetectable
1utdV-3la4A:
undetectable		 1utdL-3la4A:
6.68
1utdV-3la4A:
6.68
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.
3oev PROTEASOME COMPONENT
C1

(Saccharomyces
cerevisiae) 		PF00227
(Proteasome)
PF10584
(Proteasome_A_N) 		5 GLY F  75
GLY F 219
HIS F  73
ALA F 146
HIS F 221
 None
 1.09A 1utdL-3oevF:
undetectable
1utdV-3oevF:
undetectable		 1utdL-3oevF:
18.58
1utdV-3oevF:
18.58
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.
3oth CALG1

(Micromonospora
echinospora) 		PF00201
(UDPGT)
PF03033
(Glyco_transf_28) 		5 GLY A 296
GLY A 333
HIS A 335
ALA A 326
THR A 301
 None
 1.12A 1utdL-3othA:
undetectable
1utdV-3othA:
undetectable		 1utdL-3othA:
9.18
1utdV-3othA:
9.18
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.
3out GLUTAMATE RACEMASE

(Francisella
tularensis) 		PF01177
(Asp_Glu_race) 		5 GLY A 182
THR A 184
HIS A 185
THR A 119
THR A 116
 None
DGL  A 266 (-3.3A)
DGL  A 266 ( 4.8A)
None
DGL  A 266 ( 3.8A)
 1.06A 1utdL-3outA:
undetectable
1utdV-3outA:
undetectable		 1utdL-3outA:
12.83
1utdV-3outA:
12.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pnz PHOSPHOTRIESTERASE
FAMILY PROTEIN

(Listeria
monocytogenes) 		PF02126
(PTE) 		5 GLY A 158
GLY A 214
HIS A 187
ALA A 194
ILE A 213
 None
None
ZN  A 334 ( 3.2A)
None
None
 1.14A 1utdL-3pnzA:
undetectable
1utdV-3pnzA:
undetectable		 1utdL-3pnzA:
13.33
1utdV-3pnzA:
13.33
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.
3s7z PUTATIVE ASPARTATE
RACEMASE

(Salmonella
enterica) 		PF01177
(Asp_Glu_race) 		5 GLY A 192
THR A 194
ALA A  86
THR A 127
THR A 124
 None
SIN  A 300 (-3.3A)
None
None
SIN  A 300 (-4.0A)
 1.00A 1utdL-3s7zA:
undetectable
1utdV-3s7zA:
undetectable		 1utdL-3s7zA:
12.92
1utdV-3s7zA:
12.92
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.
3tox SHORT CHAIN
DEHYDROGENASE

(Sinorhizobium
meliloti) 		PF13561
(adh_short_C2) 		5 GLY A  94
SER A 120
ALA A 124
THR A  14
ILE A  12
 NAP  A 601 (-3.2A)
None
None
None
None
 1.02A 1utdL-3toxA:
undetectable
1utdV-3toxA:
undetectable		 1utdL-3toxA:
15.71
1utdV-3toxA:
15.71
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.
3vpy FHA
DOMAIN-CONTAINING
PROTEIN DDL

(Arabidopsis
thaliana) 		PF00498
(FHA) 		5 GLY A 120
THR A  96
HIS A  62
THR A  53
ILE A  51
 None
 0.85A 1utdL-3vpyA:
undetectable
1utdV-3vpyA:
undetectable		 1utdL-3vpyA:
26.74
1utdV-3vpyA:
26.74
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3zte TRYPTOPHAN OPERON
RNA-BINDING
ATTENUATION PROTEIN
(TRAP)

(Bacillus
licheniformis) 		PF02081
(TrpBP) 		6 GLY A  23
HIS A  34
THR A  49
HIS A  51
THR A  52
ILE A  55
 TRP  A  80 (-3.5A)
TRP  A  80 ( 4.9A)
TRP  A  80 (-2.8A)
None
TRP  A  80 (-3.6A)
TRP  A  80 ( 4.6A)
 0.33A 1utdL-3zteA:
14.4
1utdV-3zteA:
14.1		 1utdL-3zteA:
78.21
1utdV-3zteA:
78.21
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3zzl TRANSCRIPTION
ATTENUATION PROTEIN
MTRB

(Bacillus
halodurans) 		PF02081
(TrpBP) 		6 GLY A  23
HIS A  34
ALA A  46
THR A  49
HIS A  51
THR A  52
 TRP  A  81 (-3.5A)
TRP  A  81 ( 4.7A)
TRP  A  81 ( 3.7A)
TRP  A  81 ( 2.9A)
None
TRP  A  81 (-3.7A)
 0.40A 1utdL-3zzlA:
12.7
1utdV-3zzlA:
13.0		 1utdL-3zzlA:
71.43
1utdV-3zzlA:
71.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3zzl TRANSCRIPTION
ATTENUATION PROTEIN
MTRB

(Bacillus
halodurans) 		PF02081
(TrpBP) 		5 HIS A  33
HIS A  34
ALA A  46
THR A  49
THR A  52
 None
TRP  A  81 ( 4.7A)
TRP  A  81 ( 3.7A)
TRP  A  81 ( 2.9A)
TRP  A  81 (-3.7A)
 0.84A 1utdL-3zzlA:
12.7
1utdV-3zzlA:
13.0		 1utdL-3zzlA:
71.43
1utdV-3zzlA:
71.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3zzq TRANSCRIPTION
ATTENUATION PROTEIN
MTRB

(Bacillus
subtilis) 		PF02081
(TrpBP) 		6 GLY A  23
HIS A  34
ALA A  46
THR A  49
THR A  52
ILE A  55
 TRP  A  81 (-3.4A)
TRP  A  81 ( 4.9A)
TRP  A  81 ( 3.7A)
TRP  A  81 ( 2.9A)
TRP  A  81 (-3.8A)
TRP  A  81 ( 4.4A)
 0.23A 1utdL-3zzqA:
13.2
1utdV-3zzqA:
13.5		 1utdL-3zzqA:
80.00
1utdV-3zzqA:
80.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3zzq TRANSCRIPTION
ATTENUATION PROTEIN
MTRB

(Bacillus
subtilis) 		PF02081
(TrpBP) 		5 HIS A  51
ALA A  46
THR A  49
THR A  52
ILE A  55
 None
TRP  A  81 ( 3.7A)
TRP  A  81 ( 2.9A)
TRP  A  81 (-3.8A)
TRP  A  81 ( 4.4A)
 1.12A 1utdL-3zzqA:
13.2
1utdV-3zzqA:
13.5		 1utdL-3zzqA:
80.00
1utdV-3zzqA:
80.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3zzs TRANSCRIPTION
ATTENUATION PROTEIN
MTRB

(Geobacillus
stearothermophilus) 		PF02081
(TrpBP) 		7 GLY A  23
HIS A  34
ALA A  46
THR A  49
HIS A  51
THR A  52
ILE A  55
 TRP  A1072 (-3.5A)
TRP  A1072 ( 4.7A)
TRP  A1072 ( 3.8A)
TRP  A1072 (-2.9A)
None
TRP  A1072 (-3.8A)
TRP  A1072 ( 4.4A)
 0.22A 1utdL-3zzsA:
13.2
1utdV-3zzsA:
13.4		 1utdL-3zzsA:
100.00
1utdV-3zzsA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3zzs TRANSCRIPTION
ATTENUATION PROTEIN
MTRB

(Geobacillus
stearothermophilus) 		PF02081
(TrpBP) 		5 HIS A  33
HIS A  34
ALA A  46
THR A  49
THR A  52
 None
TRP  A1072 ( 4.7A)
TRP  A1072 ( 3.8A)
TRP  A1072 (-2.9A)
TRP  A1072 (-3.8A)
 0.84A 1utdL-3zzsA:
13.2
1utdV-3zzsA:
13.4		 1utdL-3zzsA:
100.00
1utdV-3zzsA:
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.
4a0m BETAINE ALDEHYDE
DEHYDROGENASE,
CHLOROPLASTIC

(Spinacia
oleracea) 		PF00171
(Aldedh) 		5 GLY A 393
GLY A 360
ALA A 349
THR A 375
ILE A 356
 None
 1.02A 1utdL-4a0mA:
undetectable
1utdV-4a0mA:
undetectable		 1utdL-4a0mA:
9.68
1utdV-4a0mA:
9.68
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4b27 TRANSCRIPTION
ATTENUATION PROTEIN
MTRB

(Bacillus
subtilis) 		PF02081
(TrpBP) 		7 GLY A  23
HIS A  34
ALA A  46
THR A  49
HIS A  51
THR A  52
ILE A  55
 GLY  A  23 (-0.0A)
HIS  A  34 ( 1.0A)
ALA  A  46 ( 0.0A)
THR  A  49 (-0.8A)
HIS  A  51 ( 1.0A)
THR  A  52 (-0.8A)
ILE  A  55 ( 0.6A)
 0.31A 1utdL-4b27A:
12.8
1utdV-4b27A:
13.0		 1utdL-4b27A:
76.32
1utdV-4b27A:
76.32
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4b27 TRANSCRIPTION
ATTENUATION PROTEIN
MTRB

(Bacillus
subtilis) 		PF02081
(TrpBP) 		5 HIS A  33
HIS A  34
ALA A  46
THR A  49
THR A  52
 HIS  A  33 ( 1.0A)
HIS  A  34 ( 1.0A)
ALA  A  46 ( 0.0A)
THR  A  49 (-0.8A)
THR  A  52 (-0.8A)
 0.84A 1utdL-4b27A:
12.8
1utdV-4b27A:
13.0		 1utdL-4b27A:
76.32
1utdV-4b27A:
76.32
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.
4cnk L-AMINO ACID OXIDASE

(Streptococcus
cristatus) 		PF03486
(HI0933_like) 		5 GLY A  26
ALA A  18
THR A  29
THR A   6
ILE A 159
 None
 0.79A 1utdL-4cnkA:
undetectable
1utdV-4cnkA:
undetectable		 1utdL-4cnkA:
12.76
1utdV-4cnkA:
12.76
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.
4dal PUTATIVE ALDEHYDE
DEHYDROGENASE

(Sinorhizobium
meliloti) 		PF00171
(Aldedh) 		5 GLY A 381
GLY A 350
ALA A 338
THR A 363
ILE A 346
 GOL  A 600 (-4.6A)
None
None
None
None
 0.98A 1utdL-4dalA:
undetectable
1utdV-4dalA:
undetectable		 1utdL-4dalA:
9.83
1utdV-4dalA:
9.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fo7 METHIONINE
AMINOPEPTIDASE

(Pseudomonas
aeruginosa) 		PF00557
(Peptidase_M24) 		5 GLY A 171
GLY A 106
HIS A 105
THR A 201
THR A 236
 None
None
None
MN  A 301 ( 3.8A)
None
 0.97A 1utdL-4fo7A:
undetectable
1utdV-4fo7A:
undetectable		 1utdL-4fo7A:
15.30
1utdV-4fo7A:
15.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fuk METHIONINE
AMINOPEPTIDASE

(Trypanosoma
brucei) 		PF00557
(Peptidase_M24) 		5 GLY A 286
GLY A 221
HIS A 220
THR A 316
THR A 351
 None
None
None
ZN  A 401 ( 3.6A)
None
 1.03A 1utdL-4fukA:
undetectable
1utdV-4fukA:
undetectable		 1utdL-4fukA:
11.94
1utdV-4fukA:
11.94
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.
4hsu LYSINE-SPECIFIC
HISTONE DEMETHYLASE
1B

(Homo sapiens) 		PF01593
(Amino_oxidase)
PF04433
(SWIRM)
PF07496
(zf-CW) 		5 SER A 811
GLY A 389
ALA A 397
THR A 626
ILE A 387
 None
FAD  A 901 (-3.3A)
None
None
None
 1.00A 1utdL-4hsuA:
undetectable
1utdV-4hsuA:
undetectable		 1utdL-4hsuA:
7.64
1utdV-4hsuA:
7.64
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.
4hxx METHIONINE
AMINOPEPTIDASE 1

(Homo sapiens) 		PF00557
(Peptidase_M24) 		5 GLY A 304
GLY A 239
HIS A 238
THR A 334
THR A 369
 None
None
None
CO  A 401 ( 3.6A)
None
 1.01A 1utdL-4hxxA:
undetectable
1utdV-4hxxA:
undetectable		 1utdL-4hxxA:
11.80
1utdV-4hxxA:
11.80
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.
4i6m ACTIN-LIKE PROTEIN
ARP9

(Saccharomyces
cerevisiae) 		PF00022
(Actin) 		5 THR B 169
GLY B 191
THR B 340
THR B 339
ILE B 194
 None
 1.09A 1utdL-4i6mB:
undetectable
1utdV-4i6mB:
undetectable		 1utdL-4i6mB:
11.93
1utdV-4i6mB:
11.93
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.
4i8p AMINOALDEHYDE
DEHYDROGENASE 1

(Zea mays) 		PF00171
(Aldedh) 		5 GLY A 398
GLY A 365
ALA A 354
THR A 380
ILE A 361
 None
 0.97A 1utdL-4i8pA:
undetectable
1utdV-4i8pA:
undetectable		 1utdL-4i8pA:
9.81
1utdV-4i8pA:
9.81
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.
4i8q PUTATIVE BETAINE
ALDEHYDE
DEHYROGENASE

(Solanum
lycopersicum) 		PF00171
(Aldedh) 		5 GLY A 397
GLY A 364
ALA A 353
THR A 379
ILE A 360
 None
 0.94A 1utdL-4i8qA:
undetectable
1utdV-4i8qA:
undetectable		 1utdL-4i8qA:
9.01
1utdV-4i8qA:
9.01
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.
4iu6 METHIONINE
AMINOPEPTIDASE 1

(Homo sapiens) 		PF00557
(Peptidase_M24) 		5 GLY A 304
GLY A 239
HIS A 238
THR A 334
THR A 369
 None
None
None
CO  A 401 (-3.5A)
None
 1.00A 1utdL-4iu6A:
undetectable
1utdV-4iu6A:
undetectable		 1utdL-4iu6A:
12.50
1utdV-4iu6A:
12.50
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.
4jre IMMUNOGLOBULIN
GAMMA-2A, HEAVY
CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		5 SER B  77
GLY B  33
ALA B  79
THR B  53
ILE B  51
 None
 1.08A 1utdL-4jreB:
undetectable
1utdV-4jreB:
undetectable		 1utdL-4jreB:
15.89
1utdV-4jreB:
15.89
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.
4kpr THIOREDOXIN
REDUCTASE 1,
CYTOPLASMIC

(Rattus
norvegicus) 		no annotation 5 GLY E 470
HIS E 472
THR E 481
THR E 480
ILE E 469
 None
 1.12A 1utdL-4kprE:
undetectable
1utdV-4kprE:
undetectable		 1utdL-4kprE:
9.64
1utdV-4kprE:
9.64
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.
4m7g TRYPSIN-LIKE
PROTEASE

(Saccharopolyspora
erythraea) 		PF00089
(Trypsin) 		5 GLY A 206
THR A 174
GLY A 191
ALA A 119
ILE A 190
 None
 0.97A 1utdL-4m7gA:
undetectable
1utdV-4m7gA:
undetectable		 1utdL-4m7gA:
17.16
1utdV-4m7gA:
17.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mzy NICOTINATE
PHOSPHORIBOSYLTRANSF
ERASE

(Enterococcus
faecalis) 		PF04095
(NAPRTase) 		5 GLY A 192
GLY A 174
THR A 186
THR A 175
ILE A 320
 None
 1.03A 1utdL-4mzyA:
undetectable
1utdV-4mzyA:
undetectable		 1utdL-4mzyA:
13.27
1utdV-4mzyA:
13.27
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.
4ook METHIONINE
AMINOPEPTIDASE 2

(Mycobacterium
tuberculosis) 		PF00557
(Peptidase_M24) 		5 GLY A 206
GLY A 141
HIS A 140
THR A 236
THR A 271
 None
NA  A 305 (-3.2A)
None
CO  A 302 (-3.4A)
NA  A 305 ( 3.9A)
 0.93A 1utdL-4ookA:
undetectable
1utdV-4ookA:
undetectable		 1utdL-4ookA:
13.69
1utdV-4ookA:
13.69
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.
4ov4 2-ISOPROPYLMALATE
SYNTHASE

(Leptospira
biflexa) 		PF00682
(HMGL-like) 		5 SER A 219
GLY A 213
ALA A 217
THR A 244
HIS A 209
 None
None
None
None
ZN  A 401 ( 3.4A)
 1.11A 1utdL-4ov4A:
undetectable
1utdV-4ov4A:
undetectable		 1utdL-4ov4A:
11.11
1utdV-4ov4A:
11.11
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.
4ufc GH95

(Bacteroides
ovatus) 		PF14498
(Glyco_hyd_65N_2) 		5 GLY A  50
ALA A  46
THR A 143
THR A 158
ILE A 167
 None
 1.14A 1utdL-4ufcA:
undetectable
1utdV-4ufcA:
undetectable		 1utdL-4ufcA:
6.66
1utdV-4ufcA:
6.66
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.
4ure CYCLOHEXANOL
DEHYDROGENASE

(Aromatoleum
aromaticum) 		PF13561
(adh_short_C2) 		5 GLY A 161
SER A 141
GLY A 148
THR A 156
ILE A 149
 None
 1.04A 1utdL-4ureA:
undetectable
1utdV-4ureA:
undetectable		 1utdL-4ureA:
17.32
1utdV-4ureA:
17.32
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.
4xgn 3-HYDROXYACYL-COA
DEHYDROGENASE

(Burkholderia
thailandensis) 		PF00106
(adh_short) 		5 THR A 169
SER A 142
GLY A 164
ALA A 144
THR A 115
 None
 1.14A 1utdL-4xgnA:
undetectable
1utdV-4xgnA:
undetectable		 1utdL-4xgnA:
13.85
1utdV-4xgnA:
13.85
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.
4yra L-THREONINE
3-DEHYDROGENASE,
MITOCHONDRIAL

(Mus musculus) 		PF01370
(Epimerase) 		5 GLY A 172
THR A 193
SER A 330
ALA A 326
THR A 236
 None
 1.01A 1utdL-4yraA:
undetectable
1utdV-4yraA:
undetectable		 1utdL-4yraA:
12.91
1utdV-4yraA:
12.91
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.
4zwl BETAINE-ALDEHYDE
DEHYDROGENASE

(Staphylococcus
aureus) 		PF00171
(Aldedh) 		5 GLY A 393
GLY A 358
ALA A 347
THR A 375
ILE A 354
 None
 0.96A 1utdL-4zwlA:
undetectable
1utdV-4zwlA:
undetectable		 1utdL-4zwlA:
9.48
1utdV-4zwlA:
9.48
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.
5a62 PUTATIVE ALPHA/BETA
HYDROLASE FOLD
PROTEIN

(Candidatus
Nitrososphaera
gargensis) 		PF00561
(Abhydrolase_1) 		5 GLY A  33
GLY A 101
HIS A  98
HIS A  61
ILE A 103
 None
 1.13A 1utdL-5a62A:
undetectable
1utdV-5a62A:
undetectable		 1utdL-5a62A:
17.15
1utdV-5a62A:
17.15
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5eex TRANSCRIPTION
ATTENUATION PROTEIN
MTRB

(Geobacillus
stearothermophilus) 		PF02081
(TrpBP) 		7 GLY A  23
HIS A  34
ALA A  46
THR A  49
HIS A  51
THR A  52
ILE A  55
 None
 0.24A 1utdL-5eexA:
14.9
1utdV-5eexA:
15.3		 1utdL-5eexA:
100.00
1utdV-5eexA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5eex TRANSCRIPTION
ATTENUATION PROTEIN
MTRB

(Geobacillus
stearothermophilus) 		PF02081
(TrpBP) 		5 HIS A  33
HIS A  34
ALA A  46
THR A  49
THR A  52
 None
 0.85A 1utdL-5eexA:
14.9
1utdV-5eexA:
15.3		 1utdL-5eexA:
100.00
1utdV-5eexA:
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.
5hj7 GLUTAMATE RACEMASE

(Mycobacterium
tuberculosis) 		PF01177
(Asp_Glu_race) 		5 GLY A 184
THR A 186
HIS A 187
THR A 122
THR A 119
 None
DGL  A 301 (-2.9A)
DGL  A 301 ( 4.4A)
None
DGL  A 301 (-3.6A)
 1.08A 1utdL-5hj7A:
undetectable
1utdV-5hj7A:
undetectable		 1utdL-5hj7A:
16.27
1utdV-5hj7A:
16.27
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.
5ijw GLUTAMATE RACEMASE

(Mycolicibacterium
smegmatis) 		PF01177
(Asp_Glu_race) 		5 GLY A 185
THR A 187
HIS A 188
THR A 123
THR A 120
 None
DGL  A 301 (-3.0A)
DGL  A 301 (-4.4A)
None
DGL  A 301 (-3.5A)
 1.08A 1utdL-5ijwA:
undetectable
1utdV-5ijwA:
undetectable		 1utdL-5ijwA:
14.49
1utdV-5ijwA:
14.49
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.
5irb RTX-ADHESIN

(Marinomonas
primoryensis) 		no annotation 5 GLY A 225
THR A 238
GLY A 215
ALA A 265
ILE A 193
 None
 1.12A 1utdL-5irbA:
1.9
1utdV-5irbA:
1.9		 1utdL-5irbA:
13.40
1utdV-5irbA:
13.40
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.
5kov CAPSID POLYPROTEIN
VP90
PL-2 SCFV CHAIN

(Mamastrovirus
1;
Mus musculus) 		PF12226
(Astro_capsid_p)
PF07686
(V-set) 		5 GLY C 101
SER A 463
GLY C  49
HIS C  35
THR A 461
 None
 0.94A 1utdL-5kovC:
undetectable
1utdV-5kovC:
undetectable		 1utdL-5kovC:
15.16
1utdV-5kovC:
15.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5l3d LYSINE-SPECIFIC
HISTONE DEMETHYLASE
1A

(Homo sapiens) 		PF01593
(Amino_oxidase)
PF04433
(SWIRM) 		5 SER A 817
GLY A 285
ALA A 293
THR A 624
ILE A 283
 None
FAD  A 901 (-3.3A)
None
None
None
 0.97A 1utdL-5l3dA:
undetectable
1utdV-5l3dA:
undetectable		 1utdL-5l3dA:
6.27
1utdV-5l3dA:
6.27
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.
5lgc ARCE4A

(Arthrobacter
sp. AW19M34-1) 		PF01522
(Polysacc_deac_1) 		6 GLY A  76
GLY A  80
THR A 199
HIS A  77
THR A  54
ILE A 118
 None
 1.05A 1utdL-5lgcA:
undetectable
1utdV-5lgcA:
undetectable		 1utdL-5lgcA:
17.89
1utdV-5lgcA:
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.
5u6f LPXTG-MOTIF CELL
WALL ANCHOR DOMAIN
PROTEIN

(Mobiluncus
mulieris) 		no annotation 5 GLY A  22
THR A  20
GLY A 225
THR A 278
ILE A 269
 None
 0.91A 1utdL-5u6fA:
2.2
1utdV-5u6fA:
1.9		 1utdL-5u6fA:
undetectable
1utdV-5u6fA:
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.
5w16 GLUTAMATE RACEMASE

(Thermus
thermophilus) 		no annotation 5 GLY A 175
THR A 177
HIS A 178
THR A 119
THR A 116
 None
DGL  A 301 (-2.9A)
DGL  A 301 ( 3.9A)
None
DGL  A 301 (-3.5A)
 1.10A 1utdL-5w16A:
undetectable
1utdV-5w16A:
undetectable		 1utdL-5w16A:
undetectable
1utdV-5w16A:
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.
5x5t ALPHA-KETOGLUTARIC
SEMIALDEHYDE
DEHYDROGENASE

(Azospirillum
brasilense) 		PF00171
(Aldedh) 		5 GLY A 387
GLY A 356
ALA A 345
THR A 369
ILE A 352
 None
 0.92A 1utdL-5x5tA:
undetectable
1utdV-5x5tA:
undetectable		 1utdL-5x5tA:
10.44
1utdV-5x5tA:
10.44
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.
5xge UNCHARACTERIZED
PROTEIN PA0861

(Pseudomonas
aeruginosa) 		no annotation 5 GLY A 780
GLY A 755
HIS A 756
HIS A 753
THR A 762
 None
 1.14A 1utdL-5xgeA:
undetectable
1utdV-5xgeA:
undetectable		 1utdL-5xgeA:
undetectable
1utdV-5xgeA:
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.
5yap SCYLLO-INOSITOL
DEHYDROGENASE WITH
L-GLUCOSE
DEHYDROGENASE
ACTIVITY

(Paracoccus
laeviglucosivorans) 		no annotation 5 GLY A 248
THR A 246
GLY A 269
HIS A 158
ILE A 153
 None
 1.01A 1utdL-5yapA:
undetectable
1utdV-5yapA:
undetectable		 1utdL-5yapA:
undetectable
1utdV-5yapA:
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.
5ygr DIAMINOPROPIONATE
AMMONIA LYASE

(Salmonella
enterica) 		no annotation 5 GLY A 126
ALA A 133
THR A 122
THR A 124
ILE A 159
 PO4  A 504 (-4.5A)
None
None
PO4  A 504 (-3.6A)
None
 1.04A 1utdL-5ygrA:
undetectable
1utdV-5ygrA:
undetectable		 1utdL-5ygrA:
undetectable
1utdV-5ygrA:
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.
5zln TOLL-LIKE RECEPTOR 9

(Mus musculus) 		no annotation 5 SER A 149
GLY A 134
HIS A 152
THR A 153
ILE A 135
 None
 1.12A 1utdL-5zlnA:
undetectable
1utdV-5zlnA:
undetectable		 1utdL-5zlnA:
undetectable
1utdV-5zlnA:
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.
6bn2 ACETYL-COA
ACETYLTRANSFERASE

(Elizabethkingia
anophelis) 		no annotation 5 GLY A 351
SER A 355
GLY A  30
ALA A 255
ILE A  34
 None
 1.06A 1utdL-6bn2A:
undetectable
1utdV-6bn2A:
undetectable		 1utdL-6bn2A:
undetectable
1utdV-6bn2A:
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.
6fc0 EUKARYOTIC
TRANSLATION
INITIATION FACTOR
4E-LIKE PROTEIN

(Chaetomium
thermophilum) 		no annotation 5 GLY A 123
THR A 182
ALA A 239
HIS A 233
THR A 234
 None
 1.00A 1utdL-6fc0A:
undetectable
1utdV-6fc0A:
undetectable		 1utdL-6fc0A:
undetectable
1utdV-6fc0A:
undetectable