SIMILAR PATTERNS OF AMINO ACIDS FOR 2UYQ_A_SAMA1311

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.
1cyn PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
B

(Homo sapiens) 		PF00160
(Pro_isomerase) 		4 ALA A  48
GLY A  50
ASP A  17
ARG A  27
 None
 0.85A 2uyqA-1cynA:
undetectable		 2uyqA-1cynA:
18.97
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.
1epz DTDP-6-DEOXY-D-XYLO-
4-HEXULOSE
3,5-EPIMERASE

(Methanothermobacter
thermautotrophicus) 		PF00908
(dTDP_sugar_isom) 		6 ALA A 119
GLY A 121
VAL A  85
ASP A  88
LEU A  89
ARG A  90
 None
 1.33A 2uyqA-1epzA:
undetectable		 2uyqA-1epzA:
19.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1f0k UDP-N-ACETYLGLUCOSAM
INE-N-ACETYLMURAMYL-
(PENTAPEPTIDE)
PYROPHOSPHORYL-UNDEC
APRENOL
N-ACETYLGLUCOSAMINE
TRANSFERASE

(Escherichia
coli) 		PF03033
(Glyco_transf_28)
PF04101
(Glyco_tran_28_C) 		5 ALA A 272
GLY A 274
ASP A 166
LEU A 168
ARG A 164
 None
 1.22A 2uyqA-1f0kA:
2.2		 2uyqA-1f0kA:
22.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1f0x D-LACTATE
DEHYDROGENASE

(Escherichia
coli) 		PF01565
(FAD_binding_4)
PF09330
(Lact-deh-memb) 		5 ALA A  76
GLY A 153
VAL A 151
ASP A 105
LEU A 102
 FAD  A 600 (-3.4A)
FAD  A 600 ( 3.8A)
None
None
None
 1.39A 2uyqA-1f0xA:
undetectable		 2uyqA-1f0xA:
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.
1fc4 2-AMINO-3-KETOBUTYRA
TE CONENZYME A
LIGASE

(Escherichia
coli) 		PF00155
(Aminotran_1_2) 		4 ALA A 214
GLY A 182
ASP A 211
VAL A 209
 None
 0.86A 2uyqA-1fc4A:
2.1		 2uyqA-1fc4A:
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.
1fep FERRIC ENTEROBACTIN
RECEPTOR

(Escherichia
coli) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		4 ALA A 661
GLY A 673
ASP A 618
ARG A 616
 None
 0.63A 2uyqA-1fepA:
undetectable		 2uyqA-1fepA:
18.90
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.
1fp2 ISOFLAVONE
O-METHYLTRANSFERASE

(Medicago sativa) 		PF00891
(Methyltransf_2)
PF08100
(Dimerisation) 		4 GLY A 198
ASP A 219
VAL A 223
ASP A 239
 SAH  A1699 ( 3.9A)
SAH  A1699 (-2.9A)
None
SAH  A1699 (-3.8A)
 0.71A 2uyqA-1fp2A:
10.3		 2uyqA-1fp2A:
18.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1fpq ISOLIQUIRITIGENIN
2'-O-METHYLTRANSFERA
SE

(Medicago sativa) 		PF00891
(Methyltransf_2)
PF08100
(Dimerisation) 		4 GLY A 219
ASP A 240
VAL A 244
ASP A 260
 None
SAM  A1699 (-2.9A)
SAM  A1699 (-4.7A)
SAM  A1699 (-3.8A)
 0.60A 2uyqA-1fpqA:
11.2		 2uyqA-1fpqA:
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.
1h6d PRECURSOR FORM OF
GLUCOSE-FRUCTOSE
OXIDOREDUCTASE

(Zymomonas
mobilis) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		4 ALA A 410
VAL A 187
ASP A 404
ARG A 275
 None
 0.83A 2uyqA-1h6dA:
undetectable		 2uyqA-1h6dA:
21.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1hvc HIV-1 PROTEASE

(Human
immunodeficiency
virus 1) 		PF00077
(RVP) 		4 GLY A  27
ASP A  25
ASP A  29
ARG A   8
 A79  A 800 (-3.0A)
A79  A 800 (-2.7A)
A79  A 800 (-2.8A)
A79  A 800 (-3.6A)
 0.78A 2uyqA-1hvcA:
undetectable		 2uyqA-1hvcA:
20.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1hvc HIV-1 PROTEASE

(Human
immunodeficiency
virus 1) 		PF00077
(RVP) 		4 GLY A  27
ASP A  25
ASP A  29
ARG A   8
 A79  A 800 (-3.0A)
A79  A 800 (-2.8A)
A79  A 800 (-2.7A)
A79  A 800 (-3.4A)
 0.81A 2uyqA-1hvcA:
undetectable		 2uyqA-1hvcA:
20.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1jmz AMINE DEHYDROGENASE

(Pseudomonas
putida) 		no annotation 5 ALA B  57
GLY B  69
ASP B  73
LEU B  72
ARG B 349
 None
 1.22A 2uyqA-1jmzB:
undetectable		 2uyqA-1jmzB:
23.16
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.
1kr5 PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Homo sapiens) 		PF01135
(PCMT) 		4 GLY A  87
ASP A 109
ASP A 141
ARG A 143
 SAH  A 300 (-3.6A)
SAH  A 300 (-2.9A)
SAH  A 300 (-3.7A)
SAH  A 300 (-4.6A)
 0.65A 2uyqA-1kr5A:
8.5		 2uyqA-1kr5A:
21.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1kyw CAFFEIC ACID
3-O-METHYLTRANSFERAS
E

(Medicago sativa) 		PF00891
(Methyltransf_2)
PF08100
(Dimerisation) 		4 GLY A 210
ASP A 231
VAL A 235
ASP A 251
 None
 0.66A 2uyqA-1kywA:
10.2		 2uyqA-1kywA:
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.
1lrk UDP-GLUCOSE
4-EPIMERASE

(Escherichia
coli) 		PF16363
(GDP_Man_Dehyd) 		4 GLY A  10
ASP A  31
ASP A  58
ARG A  60
 NAD  A 340 (-3.3A)
NAD  A 340 (-2.7A)
NAD  A 340 (-3.0A)
NAD  A 340 ( 4.7A)
 0.85A 2uyqA-1lrkA:
4.8		 2uyqA-1lrkA:
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.
1oy5 TRNA
(GUANINE-N(1)-)-METH
YLTRANSFERASE

(Aquifex
aeolicus) 		PF01746
(tRNA_m1G_MT) 		4 GLY A 142
ASP A  42
LEU A  43
ARG A  44
 None
 0.75A 2uyqA-1oy5A:
undetectable		 2uyqA-1oy5A:
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.
1qhb HALOPEROXIDASE

(Corallina
officinalis) 		PF01569
(PAP2) 		4 ALA A 486
GLY A 484
VAL A 394
LEU A 560
 None
PO4  A3000 ( 3.8A)
None
None
 0.82A 2uyqA-1qhbA:
undetectable		 2uyqA-1qhbA:
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.
1qqf PROTEIN (COMPLEMENT
C3DG)

(Rattus
norvegicus) 		PF07678
(A2M_comp)
PF10569
(Thiol-ester_cl) 		4 ALA A1024
ASP A1029
LEU A1028
ARG A1042
 None
 0.80A 2uyqA-1qqfA:
undetectable		 2uyqA-1qqfA:
22.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qu2 ISOLEUCYL-TRNA
SYNTHETASE

(Staphylococcus
aureus) 		PF00133
(tRNA-synt_1)
PF06827
(zf-FPG_IleRS)
PF08264
(Anticodon_1) 		4 ALA A 870
GLY A 874
ASP A 875
ASP A 866
 None
 0.69A 2uyqA-1qu2A:
undetectable		 2uyqA-1qu2A:
17.02
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.
1r8y GLYCINE
N-METHYLTRANSFERASE

(Mus musculus) 		PF13847
(Methyltransf_31) 		4 GLY A 184
ASP A 219
LEU A 218
ARG A 239
 None
 0.75A 2uyqA-1r8yA:
8.6		 2uyqA-1r8yA:
21.24
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.
1r9j TRANSKETOLASE

(Leishmania
mexicana) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		4 ALA A 263
GLY A  25
VAL A  19
ASP A 269
 None
 0.81A 2uyqA-1r9jA:
3.2		 2uyqA-1r9jA:
18.21
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.
1sji CALSEQUESTRIN,
CARDIAC MUSCLE
ISOFORM

(Canis lupus) 		PF01216
(Calsequestrin) 		5 GLY A 108
VAL A 114
ASP A 291
LEU A 233
ARG A 232
 None
 1.21A 2uyqA-1sjiA:
undetectable		 2uyqA-1sjiA:
20.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1sny SNIFFER CG10964-PA

(Drosophila
melanogaster) 		PF00106
(adh_short) 		4 ALA A  91
ASP A  61
LEU A  62
ARG A  63
 NAP  A 400 (-3.7A)
NAP  A 400 (-3.7A)
NAP  A 400 (-3.9A)
NAP  A 400 (-4.9A)
 0.82A 2uyqA-1snyA:
5.7		 2uyqA-1snyA:
21.47
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.
1sus CAFFEOYL-COA
O-METHYLTRANSFERASE

(Medicago sativa) 		PF01596
(Methyltransf_3) 		4 ALA A 140
GLY A 138
ASP A 145
LEU A 144
 SAH  A 301 (-3.9A)
None
None
None
 0.75A 2uyqA-1susA:
10.6		 2uyqA-1susA:
23.80
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.
1tlf LAC REPRESSOR

(Escherichia
coli) 		PF13377
(Peripla_BP_3) 		4 ASP A 275
VAL A 324
ASP A 292
ARG A 294
 None
 0.61A 2uyqA-1tlfA:
undetectable		 2uyqA-1tlfA:
24.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1u0q IMMUNOGLOBULIN HEAVY
CHAIN VARIABLE
DOMAIN

(Lama glama) 		PF07686
(V-set) 		4 ALA A  14
GLY A  16
ASP A  85
LEU A  84
 None
 0.80A 2uyqA-1u0qA:
undetectable		 2uyqA-1u0qA:
15.97
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.
1um2 ENDONUCLEASE PI-SCEI

(Saccharomyces
cerevisiae) 		PF05203
(Hom_end_hint)
PF05204
(Hom_end) 		4 ALA A 294
GLY A 296
ASP A 314
ARG A 316
 None
 0.78A 2uyqA-1um2A:
undetectable		 2uyqA-1um2A:
22.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1umb 2-OXO ACID
DEHYDROGENASE BETA
SUBUNIT

(Thermus
thermophilus) 		PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		5 ALA B 246
ASP B 243
ASP B 235
LEU B 234
ARG B 199
 None
 1.30A 2uyqA-1umbB:
3.2		 2uyqA-1umbB:
23.88
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.
1v26 LONG-CHAIN-FATTY-ACI
D-COA SYNTHETASE

(Thermus
thermophilus) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		4 ALA A 420
GLY A 384
VAL A 376
ASP A 423
 None
 0.84A 2uyqA-1v26A:
undetectable		 2uyqA-1v26A:
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.
1ve3 HYPOTHETICAL PROTEIN
PH0226

(Pyrococcus
horikoshii) 		PF13649
(Methyltransf_25) 		5 ALA A  46
GLY A  48
ASP A  67
ASP A  93
ARG A  95
 SAM  A 302 (-3.4A)
SAM  A 302 (-3.6A)
SAM  A 302 (-2.8A)
SAM  A 302 (-3.4A)
None
 0.59A 2uyqA-1ve3A:
12.2		 2uyqA-1ve3A:
19.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ve4 ATP
PHOSPHORIBOSYLTRANSF
ERASE

(Thermus
thermophilus) 		PF01634
(HisG) 		4 GLY A  72
ASP A  74
VAL A  75
ASP A 153
 None
 0.81A 2uyqA-1ve4A:
undetectable		 2uyqA-1ve4A:
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.
1vl5 UNKNOWN CONSERVED
PROTEIN BH2331

(Bacillus
halodurans) 		PF08241
(Methyltransf_11) 		4 ALA A  50
GLY A  52
ASP A  71
ASP A  98
 None
 0.52A 2uyqA-1vl5A:
12.2		 2uyqA-1vl5A:
19.94
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.
1vli SPORE COAT
POLYSACCHARIDE
BIOSYNTHESIS PROTEIN
SPSE

(Bacillus
subtilis) 		PF03102
(NeuB)
PF08666
(SAF) 		5 ALA A 115
GLY A 113
ASP A 116
LEU A 145
ARG A 144
 None
 1.30A 2uyqA-1vliA:
undetectable		 2uyqA-1vliA:
22.70
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.
1vlp NICOTINATE
PHOSPHORIBOSYLTRANSF
ERASE

(Saccharomyces
cerevisiae) 		PF04095
(NAPRTase) 		4 ALA A 239
GLY A 237
VAL A 383
ARG A 407
 None
 0.82A 2uyqA-1vlpA:
undetectable		 2uyqA-1vlpA:
19.82
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.
1wm6 PHENYLACETIC ACID
DEGRADATION PROTEIN
PAAI

(Thermus
thermophilus) 		PF03061
(4HBT) 		4 ALA A  38
GLY A  40
ASP A  30
ARG A  28
 None
 0.63A 2uyqA-1wm6A:
undetectable		 2uyqA-1wm6A:
18.24
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.
1wzn SAM-DEPENDENT
METHYLTRANSFERASE

(Pyrococcus
horikoshii) 		PF13649
(Methyltransf_25) 		4 ALA A  49
GLY A  51
ASP A  70
ASP A  96
 SAH  A1001 (-3.4A)
SAH  A1001 (-3.1A)
SAH  A1001 (-2.7A)
SAH  A1001 (-3.3A)
 0.62A 2uyqA-1wznA:
11.7		 2uyqA-1wznA:
22.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1y8c S-ADENOSYLMETHIONINE
-DEPENDENT
METHYLTRANSFERASE

(Clostridium
acetobutylicum) 		PF13649
(Methyltransf_25) 		4 ALA A  46
GLY A  48
ASP A  67
ASP A  93
 None
 0.56A 2uyqA-1y8cA:
11.6		 2uyqA-1y8cA:
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.
1yp4 GLUCOSE-1-PHOSPHATE
ADENYLYLTRANSFERASE
SMALL SUBUNIT

(Solanum
tuberosum) 		PF00483
(NTP_transferase) 		4 ALA A 121
GLY A 119
ASP A 122
LEU A 244
 None
ADP  A 557 ( 4.6A)
None
None
 0.84A 2uyqA-1yp4A:
undetectable		 2uyqA-1yp4A:
21.27
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.
1yq2 BETA-GALACTOSIDASE

(Arthrobacter
sp. C2-2) 		PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF02929
(Bgal_small_N)
PF16353
(DUF4981) 		4 GLY A 331
VAL A 362
ASP A 353
ARG A 555
 None
 0.78A 2uyqA-1yq2A:
undetectable		 2uyqA-1yq2A:
16.63
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.
1zgj ISOFLAVANONE
4'-O-METHYLTRANSFERA
SE'

(Medicago
truncatula) 		PF00891
(Methyltransf_2)
PF08100
(Dimerisation) 		4 GLY A 209
ASP A 230
VAL A 234
ASP A 250
 SAH  A3994 ( 4.0A)
SAH  A3994 (-2.8A)
None
SAH  A3994 (-3.4A)
 0.65A 2uyqA-1zgjA:
9.9		 2uyqA-1zgjA:
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.
2bzw APOPTOSIS REGULATOR
BCL-X

(Mus musculus) 		PF00452
(Bcl-2)
PF02180
(BH4) 		4 GLY A 147
ASP A  11
LEU A  90
ARG A  91
 None
 0.77A 2uyqA-2bzwA:
undetectable		 2uyqA-2bzwA:
22.26
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.
2c0z NOVW

(Streptomyces
niveus) 		PF00908
(dTDP_sugar_isom) 		5 GLY A 120
VAL A  84
ASP A  87
LEU A  88
ARG A  89
 None
 1.19A 2uyqA-2c0zA:
undetectable		 2uyqA-2c0zA:
22.85
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.
2c20 UDP-GLUCOSE
4-EPIMERASE

(Bacillus
anthracis) 		PF01370
(Epimerase) 		5 GLY A   9
ASP A  32
ASP A  52
LEU A  53
ARG A  54
 None
NAD  A 401 (-2.7A)
NAD  A 401 (-3.1A)
NAD  A 401 (-4.1A)
NAD  A 401 ( 4.6A)
 1.26A 2uyqA-2c20A:
4.4		 2uyqA-2c20A:
22.75
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.
2c5a GDP-MANNOSE-3',
5'-EPIMERASE

(Arabidopsis
thaliana) 		PF01370
(Epimerase) 		5 GLY A  36
ASP A  58
ASP A  78
LEU A  79
ARG A  80
 NAD  A1378 (-4.1A)
NAD  A1378 (-2.8A)
NAD  A1378 ( 3.8A)
NAD  A1378 (-3.9A)
None
 0.77A 2uyqA-2c5aA:
4.0		 2uyqA-2c5aA:
21.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2c5a GDP-MANNOSE-3',
5'-EPIMERASE

(Arabidopsis
thaliana) 		PF01370
(Epimerase) 		5 GLY A  37
ASP A  58
ASP A  78
LEU A  79
ARG A  80
 NAD  A1378 (-3.2A)
NAD  A1378 (-2.8A)
NAD  A1378 ( 3.8A)
NAD  A1378 (-3.9A)
None
 0.81A 2uyqA-2c5aA:
4.0		 2uyqA-2c5aA:
21.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2cs4 PROTEIN C12ORF2

(Homo sapiens) 		PF00788
(RA) 		4 ALA A  38
GLY A  42
LEU A  84
ARG A  85
 None
 0.85A 2uyqA-2cs4A:
undetectable		 2uyqA-2cs4A:
14.52
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.
2d6f GLUTAMYL-TRNA(GLN)
AMIDOTRANSFERASE
SUBUNIT E

(Methanothermobacter
thermautotrophicus) 		PF02637
(GatB_Yqey)
PF02934
(GatB_N)
PF02938
(GAD) 		5 GLY C 129
VAL C 121
ASP C 159
LEU C 178
ARG C 177
 None
 1.42A 2uyqA-2d6fC:
undetectable		 2uyqA-2d6fC:
19.94
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.
2elc ANTHRANILATE
PHOSPHORIBOSYLTRANSF
ERASE

(Thermus
thermophilus) 		PF00591
(Glycos_transf_3)
PF02885
(Glycos_trans_3N) 		4 ALA A 119
GLY A 117
ASP A 120
LEU A 129
 None
 0.80A 2uyqA-2elcA:
undetectable		 2uyqA-2elcA:
23.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2f8l HYPOTHETICAL PROTEIN
LMO1582

(Listeria
monocytogenes) 		PF02384
(N6_Mtase) 		4 ALA A 126
GLY A 128
ASP A 154
ASP A 180
 SAM  A 400 (-3.4A)
SAM  A 400 (-3.3A)
SAM  A 400 (-2.7A)
SAM  A 400 (-3.4A)
 0.75A 2uyqA-2f8lA:
9.9		 2uyqA-2f8lA:
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.
2f8t ARGONAUTE PROTEIN

(Aquifex
aeolicus) 		PF02171
(Piwi) 		5 ALA A  60
GLY A  61
ASP A 103
LEU A 100
ARG A  39
 None
 1.27A 2uyqA-2f8tA:
2.1		 2uyqA-2f8tA:
17.04
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.
2fxv XANTHINE
PHOSPHORIBOSYLTRANSF
ERASE

(Bacillus
subtilis) 		PF00156
(Pribosyltran) 		4 ALA A 133
GLY A 135
VAL A  96
LEU A 127
 None
None
None
5GP  A 200 ( 4.8A)
 0.73A 2uyqA-2fxvA:
3.9		 2uyqA-2fxvA:
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.
2hp3 IDS-EPIMERASE

(Agrobacterium
tumefaciens) 		PF03972
(MmgE_PrpD) 		4 GLY A 373
VAL A 306
ASP A 379
ARG A 392
 UNX  A1212 ( 3.6A)
None
None
EDO  A1005 (-4.2A)
 0.67A 2uyqA-2hp3A:
undetectable		 2uyqA-2hp3A:
25.65
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.
2hrv 2A CYSTEINE
PROTEINASE

(Rhinovirus A) 		PF00947
(Pico_P2A) 		4 GLY A 108
ASP A 132
LEU A 133
ARG A 134
 None
 0.61A 2uyqA-2hrvA:
undetectable		 2uyqA-2hrvA:
16.99
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.
2i0o SER/THR PHOSPHATASE

(Anopheles
gambiae) 		PF00481
(PP2C) 		4 ALA A 476
GLY A 478
VAL A  64
ASP A  57
 None
None
None
ZN  A 580 (-2.1A)
 0.81A 2uyqA-2i0oA:
undetectable		 2uyqA-2i0oA:
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.
2i14 NICOTINATE-NUCLEOTID
E PYROPHOSPHORYLASE

(Pyrococcus
furiosus) 		PF01729
(QRPTase_C)
PF02749
(QRPTase_N) 		5 ALA A 144
GLY A 164
ASP A 148
VAL A 159
ARG A 137
 None
None
None
None
PCP  A 392 (-2.8A)
 1.38A 2uyqA-2i14A:
undetectable		 2uyqA-2i14A:
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.
2ixl DTDP-4-DEHYDRORHAMNO
SE 3,5-EPIMERASE

(Streptococcus
suis) 		PF00908
(dTDP_sugar_isom) 		4 GLY A 128
ASP A  98
LEU A  99
ARG A 100
 TRH  A1198 ( 4.1A)
None
None
None
 0.63A 2uyqA-2ixlA:
undetectable		 2uyqA-2ixlA:
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.
2mu3 ACINIFORM SPIDROIN 1

(Argiope
trifasciata) 		PF12042
(RP1-2) 		4 ALA A  67
GLY A 134
ASP A 132
ASP A  62
 None
 0.81A 2uyqA-2mu3A:
undetectable		 2uyqA-2mu3A:
22.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2n47 SLR1183 PROTEIN

(Synechocystis
sp. PCC 6803) 		PF13649
(Methyltransf_25) 		4 ALA A  37
GLY A  39
ASP A  58
LEU A  85
 None
 0.39A 2uyqA-2n47A:
9.2		 2uyqA-2n47A:
21.07
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.
2o0m TRANSCRIPTIONAL
REGULATOR, SORC
FAMILY

(Enterococcus
faecalis) 		PF04198
(Sugar-bind) 		4 ALA A 334
GLY A 115
ASP A 332
VAL A 123
 None
 0.85A 2uyqA-2o0mA:
3.2		 2uyqA-2o0mA:
20.16
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.
2ob1 LEUCINE CARBOXYL
METHYLTRANSFERASE 1

(Saccharomyces
cerevisiae) 		PF04072
(LCM) 		4 GLY A 107
ASP A 128
ASP A 175
LEU A 176
 None
 0.70A 2uyqA-2ob1A:
22.9		 2uyqA-2ob1A:
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.
2okc TYPE I RESTRICTION
ENZYME STYSJI M
PROTEIN

(Bacteroides
thetaiotaomicron) 		PF02384
(N6_Mtase)
PF12161
(HsdM_N) 		5 ALA A 178
GLY A 180
ASP A 214
ASP A 243
ARG A 265
 SAM  A 500 (-3.4A)
SAM  A 500 (-3.2A)
SAM  A 500 (-2.9A)
SAM  A 500 (-3.3A)
SAM  A 500 ( 4.6A)
 1.10A 2uyqA-2okcA:
8.1		 2uyqA-2okcA:
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.
2okc TYPE I RESTRICTION
ENZYME STYSJI M
PROTEIN

(Bacteroides
thetaiotaomicron) 		PF02384
(N6_Mtase)
PF12161
(HsdM_N) 		4 ALA A 178
GLY A 180
ASP A 214
VAL A 219
 SAM  A 500 (-3.4A)
SAM  A 500 (-3.2A)
SAM  A 500 (-2.9A)
None
 0.64A 2uyqA-2okcA:
8.1		 2uyqA-2okcA:
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.
2ovj RAC
GTPASE-ACTIVATING
PROTEIN 1

(Homo sapiens) 		PF00620
(RhoGAP) 		4 ALA A 497
GLY A 501
VAL A 505
LEU A 532
 None
 0.85A 2uyqA-2ovjA:
undetectable		 2uyqA-2ovjA:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2p35 TRANS-ACONITATE
2-METHYLTRANSFERASE

(Agrobacterium
fabrum) 		PF13489
(Methyltransf_23) 		4 GLY A  40
ASP A  61
ASP A  83
LEU A  84
 SAH  A 301 (-3.3A)
SAH  A 301 (-2.7A)
SAH  A 301 (-3.2A)
SAH  A 301 (-3.8A)
 0.40A 2uyqA-2p35A:
11.3		 2uyqA-2p35A:
23.31
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.
2p5u UDP-GLUCOSE
4-EPIMERASE

(Thermus
thermophilus) 		PF01370
(Epimerase) 		5 ALA A  74
GLY A   8
ASP A  51
LEU A  52
ARG A  53
 NAD  A1118 (-3.5A)
None
NAD  A1118 (-3.0A)
NAD  A1118 (-4.0A)
None
 1.31A 2uyqA-2p5uA:
4.6		 2uyqA-2p5uA:
24.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2p5u UDP-GLUCOSE
4-EPIMERASE

(Thermus
thermophilus) 		PF01370
(Epimerase) 		5 GLY A   8
ASP A  31
ASP A  51
LEU A  52
ARG A  53
 None
NAD  A1118 (-2.7A)
NAD  A1118 (-3.0A)
NAD  A1118 (-4.0A)
None
 1.12A 2uyqA-2p5uA:
4.6		 2uyqA-2p5uA:
24.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2p8e PPM1B BETA ISOFORM
VARIANT 6

(Homo sapiens) 		PF00481
(PP2C) 		4 ALA A 201
GLY A 203
VAL A  67
ASP A  60
 None
None
None
MG  A 306 (-2.5A)
 0.84A 2uyqA-2p8eA:
undetectable		 2uyqA-2p8eA:
23.50
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.
2peb PUTATIVE DIOXYGENASE

(Nostoc
punctiforme) 		PF08883
(DOPA_dioxygen) 		5 ALA A  90
GLY A  88
ASP A  93
LEU A 112
ARG A 113
 None
 1.42A 2uyqA-2pebA:
undetectable		 2uyqA-2pebA:
18.12
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.
2pzi PROBABLE
SERINE/THREONINE-PRO
TEIN KINASE PKNG

(Mycobacterium
tuberculosis) 		PF00069
(Pkinase)
PF16918
(PknG_TPR)
PF16919
(PknG_rubred) 		4 ALA A 622
ASP A 627
LEU A 626
ARG A 667
 None
 0.83A 2uyqA-2pziA:
undetectable		 2uyqA-2pziA:
19.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2q1w PUTATIVE NUCLEOTIDE
SUGAR EPIMERASE/
DEHYDRATASE

(Bordetella
bronchiseptica) 		PF01370
(Epimerase) 		5 ALA A  18
GLY A  14
ASP A  26
LEU A  22
ARG A  24
 None
 1.42A 2uyqA-2q1wA:
4.9		 2uyqA-2q1wA:
24.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qe6 UNCHARACTERIZED
PROTEIN TFU_2867

(Thermobifida
fusca) 		PF04672
(Methyltransf_19) 		4 GLY A  86
ASP A 110
ASP A 135
ARG A 137
 SAM  A 400 ( 3.2A)
SAM  A 400 (-2.7A)
SAM  A 400 (-3.4A)
SAM  A 400 (-4.6A)
 0.47A 2uyqA-2qe6A:
16.9		 2uyqA-2qe6A:
25.96
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.
2qyo O-METHYLTRANSFERASE

(Medicago
truncatula) 		PF00891
(Methyltransf_2)
PF08100
(Dimerisation) 		4 GLY A 203
ASP A 224
VAL A 228
ASP A 244
 SAH  A 601 ( 3.8A)
SAH  A 601 (-2.9A)
SAH  A 601 ( 4.9A)
SAH  A 601 (-3.5A)
 0.60A 2uyqA-2qyoA:
9.5		 2uyqA-2qyoA:
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.
2rmc PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
C

(Mus musculus) 		PF00160
(Pro_isomerase) 		4 ALA A  74
GLY A  76
ASP A  43
ARG A  53
 None
 0.79A 2uyqA-2rmcA:
undetectable		 2uyqA-2rmcA:
20.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2uv8 FATTY ACID SYNTHASE
SUBUNIT BETA (FAS1)

(Saccharomyces
cerevisiae) 		PF00698
(Acyl_transf_1)
PF01575
(MaoC_dehydratas)
PF08354
(DUF1729)
PF13452
(MaoC_dehydrat_N)
PF16073
(SAT) 		4 GLY G 272
ASP G 467
LEU G 468
ARG G 469
 None
 0.67A 2uyqA-2uv8G:
undetectable		 2uyqA-2uv8G:
9.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2uyo HYPOTHETICAL PROTEIN
ML2640

(Mycobacterium
leprae) 		PF04072
(LCM) 		7 ALA A 110
GLY A 112
ASP A 132
VAL A 136
ASP A 161
LEU A 162
ARG A 163
 None
 0.46A 2uyqA-2uyoA:
47.6		 2uyqA-2uyoA:
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.
2v6j RNA HELICASE

(Kokobera virus) 		PF00271
(Helicase_C)
PF07652
(Flavi_DEAD) 		4 GLY A 411
ASP A 410
VAL A 254
LEU A 355
 None
 0.76A 2uyqA-2v6jA:
4.1		 2uyqA-2v6jA:
24.83
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.
2we8 XANTHINE
DEHYDROGENASE

(Mycolicibacterium
smegmatis) 		PF02625
(XdhC_CoxI)
PF13478
(XdhC_C) 		4 ALA A  34
ASP A 100
LEU A  99
ARG A  80
 None
 0.80A 2uyqA-2we8A:
4.4		 2uyqA-2we8A:
24.42
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.
2xqw COMPLEMENT C3

(Homo sapiens) 		PF07678
(A2M_comp)
PF10569
(Thiol-ester_cl) 		4 ALA A  31
ASP A  36
LEU A  35
ARG A  49
 None
 0.78A 2uyqA-2xqwA:
undetectable		 2uyqA-2xqwA:
21.79
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.
2xva TELLURITE RESISTANCE
PROTEIN TEHB

(Escherichia
coli) 		PF03848
(TehB) 		4 GLY A  40
ASP A  59
ASP A  86
LEU A  87
 SFG  A1198 (-3.2A)
SFG  A1198 (-2.8A)
SFG  A1198 (-3.9A)
SFG  A1198 (-3.8A)
 0.49A 2uyqA-2xvaA:
13.4		 2uyqA-2xvaA:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xwb COMPLEMENT C3B
ALPHA' CHAIN

(Homo sapiens) 		PF00207
(A2M)
PF01759
(NTR)
PF07677
(A2M_recep)
PF07678
(A2M_comp)
PF10569
(Thiol-ester_cl) 		4 ALA B1002
ASP B1007
LEU B1006
ARG B1020
 None
 0.79A 2uyqA-2xwbB:
undetectable		 2uyqA-2xwbB:
16.78
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.
2yxl 450AA LONG
HYPOTHETICAL FMU
PROTEIN

(Pyrococcus
horikoshii) 		PF01189
(Methyltr_RsmB-F)
PF17125
(Methyltr_RsmF_N) 		4 ALA A 267
ASP A 291
ASP A 318
ARG A 320
 SFG  A5748 (-3.4A)
SFG  A5748 (-2.9A)
SFG  A5748 (-3.7A)
SFG  A5748 (-4.5A)
 0.66A 2uyqA-2yxlA:
9.4		 2uyqA-2yxlA:
20.81
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.
2zwa LEUCINE CARBOXYL
METHYLTRANSFERASE 2

(Saccharomyces
cerevisiae) 		PF04072
(LCM)
PF13418
(Kelch_4) 		4 GLY A 117
ASP A 146
ASP A 196
LEU A 197
 SAH  A 801 (-3.4A)
SAH  A 801 (-2.9A)
SAH  A 801 (-4.1A)
SAH  A 801 (-3.7A)
 0.22A 2uyqA-2zwaA:
20.9		 2uyqA-2zwaA:
16.28
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.
3aw9 NAD-DEPENDENT
EPIMERASE/DEHYDRATAS
E

(Pyrobaculum
calidifontis) 		PF01370
(Epimerase) 		4 GLY A  10
ASP A  31
ASP A  47
LEU A  48
 NAD  A 901 (-3.2A)
NAD  A 901 (-2.9A)
NAD  A 901 (-3.8A)
NAD  A 901 (-3.7A)
 0.85A 2uyqA-3aw9A:
4.7		 2uyqA-3aw9A:
26.57
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.
3b89 16S RRNA METHYLASE

(Escherichia
coli) 		PF07091
(FmrO) 		4 ALA A 111
GLY A 113
ASP A 131
ASP A 157
 5GP  A 500 (-3.1A)
5GP  A 500 ( 4.5A)
5GP  A 500 (-3.1A)
5GP  A 500 (-2.7A)
 0.51A 2uyqA-3b89A:
10.3		 2uyqA-3b89A:
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.
3bkw S-ADENOSYLMETHIONINE
DEPENDENT
METHYLTRANSFERASE

(Mesorhizobium
japonicum) 		PF08241
(Methyltransf_11) 		4 GLY A  52
ASP A  72
ASP A  96
LEU A  97
 None
 0.69A 2uyqA-3bkwA:
12.3		 2uyqA-3bkwA:
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.
3bxo N,N-DIMETHYLTRANSFER
ASE

(Streptomyces
venezuelae) 		PF13649
(Methyltransf_25) 		4 ALA A  46
GLY A  48
ASP A  89
ARG A  91
 SAM  A 238 (-3.2A)
SAM  A 238 ( 3.7A)
SAM  A 238 (-3.0A)
SAM  A 238 (-4.1A)
 0.62A 2uyqA-3bxoA:
11.0		 2uyqA-3bxoA:
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.
3c4q PREDICTED
GLYCOSYLTRANSFERASES

(Corynebacterium
glutamicum) 		PF00534
(Glycos_transf_1)
PF13439
(Glyco_transf_4) 		4 ALA A  36
GLY A  39
ASP A  43
ARG A  64
 None
 0.83A 2uyqA-3c4qA:
2.5		 2uyqA-3c4qA:
23.32
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.
3cgg SAM-DEPENDENT
METHYLTRANSFERASE

(Corynebacterium
glutamicum) 		PF13649
(Methyltransf_25) 		4 GLY A  55
ASP A  74
ASP A  96
LEU A  97
 None
NHE  A 195 (-3.6A)
NHE  A 195 (-4.3A)
NHE  A 195 (-3.8A)
 0.56A 2uyqA-3cggA:
10.7		 2uyqA-3cggA:
21.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3d2l SAM-DEPENDENT
METHYLTRANSFERASE

(Exiguobacterium
sibiricum) 		PF13649
(Methyltransf_25) 		4 GLY A  42
ASP A  60
ASP A  86
ARG A  88
 None
 0.50A 2uyqA-3d2lA:
11.9		 2uyqA-3d2lA:
21.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dpi NAD+ SYNTHETASE

(Burkholderia
pseudomallei) 		PF02540
(NAD_synthase) 		4 ALA A  65
GLY A  62
VAL A 104
ARG A  80
 None
 0.81A 2uyqA-3dpiA:
undetectable		 2uyqA-3dpiA:
27.30
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.
3dzz PUTATIVE PYRIDOXAL
5'-PHOSPHATE-DEPENDE
NT C-S LYASE

(Lactobacillus
delbrueckii) 		PF00155
(Aminotran_1_2) 		4 ALA A  96
VAL A 124
ASP A 198
LEU A 228
 None
None
LLP  A 233 ( 2.8A)
None
 0.85A 2uyqA-3dzzA:
3.6		 2uyqA-3dzzA:
24.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3e96 DIHYDRODIPICOLINATE
SYNTHASE

(Bacillus
clausii) 		PF00701
(DHDPS) 		4 ALA A 177
GLY A 207
ASP A 151
ARG A 175
 None
 0.83A 2uyqA-3e96A:
undetectable		 2uyqA-3e96A:
21.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fd0 PUTATIVE
CYSTATHIONINE
BETA-LYASE INVOLVED
IN ALUMINUM
RESISTANCE

(Listeria
innocua) 		PF06838
(Met_gamma_lyase) 		4 ALA A 286
GLY A 289
VAL A 396
LEU A 371
 None
None
None
LLP  A 226 ( 4.1A)
 0.76A 2uyqA-3fd0A:
3.9		 2uyqA-3fd0A:
22.51
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.
3fot 15-O-ACETYLTRANSFERA
SE

(Fusarium
sporotrichioides) 		PF07428
(Tri3) 		5 ALA A 408
GLY A 410
VAL A 413
ASP A 249
LEU A 244
 None
 1.46A 2uyqA-3fotA:
undetectable		 2uyqA-3fotA:
22.88
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.
3fz0 NUCLEOSIDE
HYDROLASE, PUTATIVE

(Trypanosoma
brucei) 		PF01156
(IU_nuc_hydro) 		5 ALA A 130
GLY A 132
ASP A   9
VAL A  37
LEU A 128
 None
CA  A 400 ( 4.4A)
None
None
None
 1.26A 2uyqA-3fz0A:
2.6		 2uyqA-3fz0A:
22.85
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.
3ggd SAM-DEPENDENT
METHYLTRANSFERASE

(Trichormus
variabilis) 		PF13649
(Methyltransf_25) 		4 ALA A  63
GLY A  65
ASP A  84
ASP A 108
 SAH  A 248 (-3.2A)
SAH  A 248 (-3.2A)
SAH  A 248 (-2.9A)
SAH  A 248 (-3.7A)
 0.30A 2uyqA-3ggdA:
11.7		 2uyqA-3ggdA:
21.79
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.
3gip N-ACYL-D-GLUTAMATE
DEACYLASE

(Bordetella
bronchiseptica) 		PF07969
(Amidohydro_3) 		4 ALA A  37
GLY A 423
ASP A   8
LEU A   7
 None
 0.85A 2uyqA-3gipA:
undetectable		 2uyqA-3gipA:
22.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3h2i ESTERASE

(Xanthomonas
oryzae) 		PF03583
(LIP) 		5 ALA A 203
VAL A 362
ASP A 390
LEU A 393
ARG A 389
 None
 1.34A 2uyqA-3h2iA:
undetectable		 2uyqA-3h2iA:
23.60
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.
3h77 PQS BIOSYNTHETIC
ENZYME

(Pseudomonas
aeruginosa) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		4 GLY A 124
ASP A 180
LEU A 181
ARG A 182
 None
 0.76A 2uyqA-3h77A:
undetectable		 2uyqA-3h77A:
21.24
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.
3hig AMILORIDE-SENSITIVE
AMINE OXIDASE

(Homo sapiens) 		PF01179
(Cu_amine_oxid)
PF02727
(Cu_amine_oxidN2)
PF02728
(Cu_amine_oxidN3) 		5 GLY A 333
VAL A 352
ASP A 466
LEU A 452
ARG A 453
 None
 1.37A 2uyqA-3higA:
undetectable		 2uyqA-3higA:
18.33