SIMILAR PATTERNS OF AMINO ACIDS FOR 3V3O_B_T1CB405

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.
1ded CYCLODEXTRIN
GLUCANOTRANSFERASE

(Bacillus sp.
1011) 		PF00128
(Alpha-amylase)
PF00686
(CBM_20)
PF01833
(TIG)
PF02806
(Alpha-amylase_C) 		5 GLY A  99
PRO A 143
ALA A 198
GLY A 155
ASN A 193
 None
 1.30A 3v3oB-1dedA:
0.0		 3v3oB-1dedA:
19.33
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.
1g6o CAG-ALPHA

(Helicobacter
pylori) 		PF00437
(T2SSE) 		5 GLY A 247
ALA A 274
GLY A 178
GLU A 279
MET A 287
 None
 0.96A 3v3oB-1g6oA:
1.6		 3v3oB-1g6oA:
23.77
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.
1gwi CYTOCHROME P450
154C1

(Streptomyces
coelicolor) 		PF00067
(p450) 		5 ARG A 326
HIS A  49
GLY A 322
ALA A  29
GLY A  30
 None
 1.30A 3v3oB-1gwiA:
0.0		 3v3oB-1gwiA:
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.
1h39 SQUALENE--HOPENE
CYCLASE

(Alicyclobacillus
acidocaldarius) 		PF13243
(SQHop_cyclase_C)
PF13249
(SQHop_cyclase_N) 		5 GLN A 366
GLY A 260
GLY A 600
ASN A  39
MET A  42
 None
None
None
None
R03  A 800 ( 4.9A)
 1.11A 3v3oB-1h39A:
0.0		 3v3oB-1h39A:
21.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1i2m REGULATOR OF
CHROMOSOME
CONDENSATION 1

(Homo sapiens) 		PF00415
(RCC1) 		5 PHE B  91
ASN B  94
GLY B 113
ALA B  74
GLY B  75
 None
 1.23A 3v3oB-1i2mB:
undetectable		 3v3oB-1i2mB:
23.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1jsw L-ASPARTATE
AMMONIA-LYASE

(Escherichia
coli) 		PF00206
(Lyase_1)
PF10415
(FumaraseC_C) 		5 GLY A 275
ALA A 371
GLY A 369
GLU A 374
ASN A 346
 None
 1.29A 3v3oB-1jswA:
0.0		 3v3oB-1jswA:
21.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1mqt POLYPROTEIN CAPSID
PROTEIN

(Enterovirus B) 		PF00073
(Rhv) 		5 GLN C  81
GLY C  84
PRO C 142
ALA C 139
GLY C 140
 None
 1.33A 3v3oB-1mqtC:
undetectable		 3v3oB-1mqtC:
19.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pzt BETA-1,4-GALACTOSYLT
RANSFERASE 1

(Bos taurus) 		PF02709
(Glyco_transf_7C)
PF13733
(Glyco_transf_7N) 		5 PHE A 226
GLY A 313
ALA A 221
GLY A 222
ASN A 219
 None
 1.30A 3v3oB-1pztA:
0.4		 3v3oB-1pztA:
20.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qho ALPHA-AMYLASE

(Geobacillus
stearothermophilus) 		PF00128
(Alpha-amylase)
PF00686
(CBM_20)
PF01833
(TIG)
PF02806
(Alpha-amylase_C) 		5 GLY A  91
PRO A 135
ALA A 197
GLY A 147
ASN A 187
 None
 1.29A 3v3oB-1qhoA:
0.0		 3v3oB-1qhoA:
21.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1si8 CATALASE

(Enterococcus
faecalis) 		PF00199
(Catalase)
PF06628
(Catalase-rel) 		5 PHE A 111
GLY A 126
ALA A  60
GLY A  59
MET A 295
 None
HEM  A 501 (-3.8A)
None
None
None
 1.05A 3v3oB-1si8A:
undetectable		 3v3oB-1si8A:
22.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1sy7 CATALASE 1

(Neurospora
crassa) 		PF00199
(Catalase)
PF01965
(DJ-1_PfpI)
PF06628
(Catalase-rel) 		5 PHE A 149
GLY A 164
ALA A  98
GLY A  97
MET A 337
 None
HDD  A1880 ( 3.9A)
None
None
None
 1.10A 3v3oB-1sy7A:
undetectable		 3v3oB-1sy7A:
19.44
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.
1ulv GLUCODEXTRANASE

(Arthrobacter
globiformis) 		PF00723
(Glyco_hydro_15)
PF09136
(Glucodextran_B)
PF09137
(Glucodextran_N)
PF09985
(Glucodextran_C) 		5 GLN A 629
GLY A 574
PRO A 312
ALA A 317
GLY A 314
 None
 1.32A 3v3oB-1ulvA:
undetectable		 3v3oB-1ulvA:
17.18
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.
1vgq FORMYL-COENZYME A
TRANSFERASE

(Oxalobacter
formigenes) 		PF02515
(CoA_transf_3) 		5 ASN A 256
PRO A 346
GLY A 348
GLU A 338
MET A 295
 None
 1.23A 3v3oB-1vgqA:
5.1		 3v3oB-1vgqA:
21.40
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.
1vgq FORMYL-COENZYME A
TRANSFERASE

(Oxalobacter
formigenes) 		PF02515
(CoA_transf_3) 		5 PHE A 282
GLY A 264
PRO A 346
ALA A 341
MET A 295
 None
 1.24A 3v3oB-1vgqA:
5.1		 3v3oB-1vgqA:
21.40
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.
1vkd CONSERVED
HYPOTHETICAL PROTEIN
TM1225

(Thermotoga
maritima) 		PF04041
(Glyco_hydro_130) 		5 PHE A 277
HIS A 306
GLY A 276
GLY A  41
ASN A  66
 None
 1.28A 3v3oB-1vkdA:
undetectable		 3v3oB-1vkdA:
21.64
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.
1w6s METHANOL
DEHYDROGENASE
SUBUNIT 1

(Methylobacterium
extorquens) 		PF01011
(PQQ)
PF13360
(PQQ_2) 		5 ASN A 394
HIS A 393
GLY A 410
ALA A  57
GLY A  56
 PQQ  A1596 (-3.6A)
None
None
None
None
 1.19A 3v3oB-1w6sA:
undetectable		 3v3oB-1w6sA:
21.31
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.
2d0v METHANOL
DEHYDROGENASE LARGE
SUBUNIT
METHANOL
DEHYDROGENASE SMALL
SUBUNIT

(Hyphomicrobium
denitrificans) 		PF01011
(PQQ)
PF02315
(MDH)
PF13360
(PQQ_2) 		5 HIS A 183
GLY A 150
ALA B  52
GLU B  56
ASN B  53
 None
 1.25A 3v3oB-2d0vA:
undetectable		 3v3oB-2d0vA:
20.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2dm0 TYROSINE-PROTEIN
KINASE TXK

(Homo sapiens) 		PF00017
(SH2) 		5 ASN A 102
HIS A 101
PRO A 113
ALA A  40
GLY A  39
 None
 1.31A 3v3oB-2dm0A:
undetectable		 3v3oB-2dm0A:
14.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2dw4 LYSINE-SPECIFIC
HISTONE DEMETHYLASE
1

(Homo sapiens) 		PF01593
(Amino_oxidase)
PF04433
(SWIRM) 		5 GLN A 554
GLY A 770
PRO A 808
ALA A 814
GLY A 813
 None
None
None
FAD  A1001 (-3.4A)
None
 1.25A 3v3oB-2dw4A:
13.8		 3v3oB-2dw4A:
20.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2gvk HEME PEROXIDASE

(Bacteroides
thetaiotaomicron) 		PF04261
(Dyp_perox) 		5 GLY A  69
ALA A  46
GLY A 315
ASN A  47
MET A  51
 None
 1.32A 3v3oB-2gvkA:
undetectable		 3v3oB-2gvkA:
20.83
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.
2h88 SUCCINATE
DEHYDROGENASE
FLAVOPROTEIN SUBUNIT

(Gallus gallus) 		PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C) 		5 PHE A 249
ASN A 366
GLY A 405
ALA A 550
GLU A 552
 None
 1.23A 3v3oB-2h88A:
8.2		 3v3oB-2h88A:
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.
2iwz 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE

(Homo sapiens) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 PHE A 445
GLY A 446
ALA A 357
GLU A 419
ASN A 360
 None
6NA  A1460 (-3.3A)
None
None
None
 1.23A 3v3oB-2iwzA:
undetectable		 3v3oB-2iwzA:
19.65
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.
2j2m CATALASE

(Exiguobacterium
oxidotolerans) 		PF00199
(Catalase)
PF06628
(Catalase-rel) 		5 PHE A 113
GLY A 128
ALA A  62
GLY A  61
MET A 297
 None
HEM  A 501 (-3.7A)
None
None
None
 1.06A 3v3oB-2j2mA:
undetectable		 3v3oB-2j2mA:
22.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ntb PECTINESTERASE A

(Dickeya
dadantii) 		PF01095
(Pectinesterase) 		5 GLN A 343
ASN A 293
ALA A 333
GLY A 332
ASN A 298
 None
 1.31A 3v3oB-2ntbA:
undetectable		 3v3oB-2ntbA:
22.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2r09 CYTOHESIN-3

(Mus musculus) 		PF00169
(PH)
PF01369
(Sec7) 		5 ASN A 112
GLY A 108
GLY A  84
GLU A  90
ASN A  91
 None
 1.29A 3v3oB-2r09A:
undetectable		 3v3oB-2r09A:
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.
2vda MALTOPORIN
TRANSLOCASE SUBUNIT
SECA

(Escherichia
coli) 		PF01043
(SecA_PP_bind)
PF07516
(SecA_SW)
PF07517
(SecA_DEAD)
no annotation 		5 ASN A 369
HIS A 354
GLY A 352
ALA B  19
GLY B  20
 None
 1.24A 3v3oB-2vdaA:
undetectable		 3v3oB-2vdaA:
18.27
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.
2vdc GLUTAMATE SYNTHASE
[NADPH] SMALL CHAIN

(Azospirillum
brasilense) 		PF07992
(Pyr_redox_2)
PF14691
(Fer4_20) 		5 PRO G 157
ALA G 161
GLY G 159
GLU G 165
ASN G  89
 FAD  G 484 (-3.6A)
None
None
None
None
 1.24A 3v3oB-2vdcG:
5.5		 3v3oB-2vdcG:
20.80
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.
2vqr PUTATIVE SULFATASE

(Rhizobium
leguminosarum) 		PF00884
(Sulfatase)
PF16347
(DUF4976) 		5 PHE A  47
GLY A 366
ALA A 360
GLY A 361
ASN A 357
 None
 1.09A 3v3oB-2vqrA:
undetectable		 3v3oB-2vqrA:
20.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wk2 CHITINASE A

(Serratia
marcescens) 		PF00704
(Glyco_hydro_18)
PF08329
(ChitinaseA_N) 		5 PHE A 316
ASN A 323
GLY A 319
GLY A 273
MET A 388
 None
None
None
None
NGT  A1565 (-3.7A)
 1.23A 3v3oB-2wk2A:
undetectable		 3v3oB-2wk2A:
22.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xf2 CATALASE

(Penicillium
janthinellum) 		PF00199
(Catalase)
PF06628
(Catalase-rel) 		5 PHE A 121
GLY A 136
ALA A  70
GLY A  69
MET A 309
 None
HDD  A 690 (-3.9A)
None
None
None
 1.09A 3v3oB-2xf2A:
4.2		 3v3oB-2xf2A:
21.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xlr FLAVIN-CONTAINING
MONOOXYGENASE

(Methylophaga
aminisulfidivorans) 		PF00743
(FMO-like) 		5 GLN A 323
HIS A 169
PRO A  17
ALA A  15
GLY A  14
 FAD  A 500 ( 3.2A)
None
FAD  A 500 (-3.7A)
None
FAD  A 500 (-3.5A)
 1.22A 3v3oB-2xlrA:
10.1		 3v3oB-2xlrA:
21.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xt0 HALOALKANE
DEHALOGENASE

(Plesiocystis
pacifica) 		PF00561
(Abhydrolase_1) 		5 PHE A 100
GLY A  99
ALA A 205
GLY A 206
MET A   1
 None
 1.29A 3v3oB-2xt0A:
2.1		 3v3oB-2xt0A:
21.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2y89 PHOSPHORIBOSYL
ISOMERASE A

(Mycobacterium
tuberculosis) 		PF00977
(His_biosynth) 		5 GLY A 122
ALA A 106
GLY A 104
GLU A 109
ASN A 110
 None
None
SO4  A1246 (-3.4A)
None
SO4  A1252 (-3.7A)
 1.04A 3v3oB-2y89A:
undetectable		 3v3oB-2y89A:
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.
2yn2 UNCHARACTERIZED
PROTEIN YNL108C

(Saccharomyces
cerevisiae) 		PF00300
(His_Phos_1) 		5 GLN A  43
HIS A  39
GLY A  40
GLY A 251
GLU A 249
 None
None
None
FMT  A1264 ( 3.7A)
None
 1.14A 3v3oB-2yn2A:
undetectable		 3v3oB-2yn2A:
22.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3asi NEUREXIN-1-ALPHA

(Bos taurus) 		PF02210
(Laminin_G_2) 		5 GLN A1064
PHE A1068
GLY A1067
GLY A1059
ASN A1083
 None
 1.27A 3v3oB-3asiA:
undetectable		 3v3oB-3asiA:
22.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bmw CYCLOMALTODEXTRIN
GLUCANOTRANSFERASE

(Thermoanaerobacterium
thermosulfurigenes) 		PF00128
(Alpha-amylase)
PF00686
(CBM_20)
PF01833
(TIG) 		5 GLY A 100
PRO A 144
ALA A 199
GLY A 156
ASN A 194
 None
GOL  A 704 (-4.3A)
None
None
None
 1.31A 3v3oB-3bmwA:
undetectable		 3v3oB-3bmwA:
19.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3brz TODX

(Pseudomonas
putida) 		PF03349
(Toluene_X) 		5 HIS A 377
ALA A  11
GLY A  10
GLU A  47
ASN A 393
 None
 1.07A 3v3oB-3brzA:
undetectable		 3v3oB-3brzA:
21.57
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.
3grh ACYL-COA THIOESTER
HYDROLASE YBGC

(Escherichia
coli) 		PF01095
(Pectinesterase) 		5 ARG A  14
PHE A 340
GLY A 311
ALA A 335
GLY A 388
 None
 1.16A 3v3oB-3grhA:
undetectable		 3v3oB-3grhA:
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.
3i09 PERIPLASMIC
BRANCHED-CHAIN AMINO
ACID-BINDING PROTEIN

(Burkholderia
mallei) 		PF13458
(Peripla_BP_6) 		5 PHE A 168
GLY A 196
ALA A 178
GLY A 176
ASN A 182
 None
 1.18A 3v3oB-3i09A:
undetectable		 3v3oB-3i09A:
23.00
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.
3lpp SUCRASE-ISOMALTASE

(Homo sapiens) 		PF00088
(Trefoil)
PF01055
(Glyco_hydro_31)
PF16863
(NtCtMGAM_N) 		5 GLN A 245
GLY A 243
ALA A 599
GLY A 598
ASN A 572
 None
 1.14A 3v3oB-3lppA:
undetectable		 3v3oB-3lppA:
18.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3o8o 6-PHOSPHOFRUCTOKINAS
E SUBUNIT BETA

(Saccharomyces
cerevisiae) 		PF00365
(PFK) 		5 ARG B 366
GLY B 480
ALA B 360
GLY B 359
ASN B 349
 None
 1.24A 3v3oB-3o8oB:
2.5		 3v3oB-3o8oB:
18.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3odp PUTATIVE
TAGATOSE-6-PHOSPHATE
KETOSE/ALDOSE
ISOMERASE

(Clostridium
novyi) 		PF01380
(SIS) 		5 PHE A 180
GLY A 178
ALA A  69
GLY A  66
ASN A  73
 None
 1.25A 3v3oB-3odpA:
undetectable		 3v3oB-3odpA:
23.92
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.
3opy 6-PHOSPHOFRUCTO-1-KI
NASE ALPHA-SUBUNIT

(Komagataella
pastoris) 		PF00365
(PFK) 		5 ARG A 379
HIS A 493
GLY A 492
ALA A 373
GLY A 372
 None
SO4  B 943 (-4.2A)
None
None
None
 1.29A 3v3oB-3opyA:
undetectable		 3v3oB-3opyA:
17.76
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.
3opy 6-PHOSPHOFRUCTO-1-KI
NASE BETA-SUBUNIT

(Komagataella
pastoris) 		PF00365
(PFK) 		5 ARG B 351
HIS B 466
GLY B 465
ALA B 345
GLY B 344
 None
SO4  A 999 (-3.6A)
None
None
None
 1.31A 3v3oB-3opyB:
2.6		 3v3oB-3opyB:
17.27
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.
3os6 ISOCHORISMATE
SYNTHASE DHBC

(Bacillus
anthracis) 		PF00425
(Chorismate_bind) 		5 PHE A  25
ASN A 179
ALA A 194
GLY A 193
ASN A 170
 None
 1.27A 3v3oB-3os6A:
undetectable		 3v3oB-3os6A:
22.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3p9u TETX2 PROTEIN

(Bacteroides
thetaiotaomicron) 		PF01494
(FAD_binding_3) 		6 GLN A 192
ARG A 213
ASN A 226
ALA A 320
GLY A 321
ASN A 371
 FAD  A 401 (-3.4A)
SO4  A   1 (-4.5A)
SO4  A   1 (-4.5A)
None
None
None
 0.96A 3v3oB-3p9uA:
30.9		 3v3oB-3p9uA:
99.74
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3p9u TETX2 PROTEIN

(Bacteroides
thetaiotaomicron) 		PF01494
(FAD_binding_3) 		10 GLN A 192
ARG A 213
ASN A 226
HIS A 234
GLY A 236
PRO A 318
ALA A 320
GLY A 321
GLU A 367
MET A 375
 FAD  A 401 (-3.4A)
SO4  A   1 (-4.5A)
SO4  A   1 (-4.5A)
SO4  A   1 ( 4.6A)
None
FAD  A 401 (-4.4A)
None
None
None
None
 0.72A 3v3oB-3p9uA:
30.9		 3v3oB-3p9uA:
99.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pih UVRABC SYSTEM
PROTEIN A

(Thermotoga
maritima) 		PF00005
(ABC_tran) 		5 GLN A 722
PHE A 709
GLY A 721
PRO A 673
ALA A 803
 None
 1.33A 3v3oB-3pihA:
undetectable		 3v3oB-3pihA:
16.95
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.
3q3q ALKALINE PHOSPHATASE

(Sphingomonas
sp. BSAR-1) 		PF01663
(Phosphodiest) 		5 PHE A 260
GLY A 259
PRO A 192
GLY A 190
ASN A 211
 None
 1.06A 3v3oB-3q3qA:
undetectable		 3v3oB-3q3qA:
19.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qdf 2-HYDROXYHEPTA-2,4-D
IENE-1,7-DIOATE
ISOMERASE

(Mycobacterium
marinum) 		PF01557
(FAA_hydrolase)
PF10370
(DUF2437) 		5 PHE A 116
ASN A 257
GLY A 118
ALA A 195
GLY A 194
 None
 1.03A 3v3oB-3qdfA:
undetectable		 3v3oB-3qdfA:
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.
3s4d LACTOSE
PHOSPHORYLASE

(Cellulomonas
uda) 		PF06165
(Glyco_transf_36)
PF17167
(Glyco_hydro_36) 		5 PHE A 149
HIS A 249
GLY A 247
ALA A 228
ASN A 222
 None
 1.14A 3v3oB-3s4dA:
undetectable		 3v3oB-3s4dA:
18.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3t4j HISTIDINE KINASE 4

(Arabidopsis
thaliana) 		PF03924
(CHASE) 		5 PHE A 153
ASN A 158
GLY A 379
ALA A 322
GLY A 321
 None
None
None
ZIP  A 400 (-3.5A)
None
 1.24A 3v3oB-3t4jA:
undetectable		 3v3oB-3t4jA:
22.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4aah METHANOL
DEHYDROGENASE

(Methylophilus
methylotrophus) 		PF13360
(PQQ_2) 		5 ASN A 387
HIS A 386
GLY A 403
ALA A  57
GLY A  56
 PQQ  A 701 (-3.5A)
None
None
None
None
 1.20A 3v3oB-4aahA:
undetectable		 3v3oB-4aahA:
22.68
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.
4aef NEOPULLULANASE
(ALPHA-AMYLASE II)

(Pyrococcus
furiosus) 		PF00128
(Alpha-amylase)
PF02903
(Alpha-amylase_N)
PF16561
(AMPK1_CBM) 		5 PHE A 122
ASN A 587
GLY A 123
ALA A 490
GLY A 488
 None
 1.21A 3v3oB-4aefA:
undetectable		 3v3oB-4aefA:
20.69
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.
4aj9 CATALASE-3

(Neurospora
crassa) 		PF00199
(Catalase)
PF06628
(Catalase-rel) 		5 PHE A 159
GLY A 174
ALA A 108
GLY A 107
MET A 347
 None
HEM  A1715 (-3.8A)
None
None
None
 1.12A 3v3oB-4aj9A:
4.5		 3v3oB-4aj9A:
20.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4c7v TRANSKETOLASE

(Lactobacillus
salivarius) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		5 ASN A 256
GLY A 264
PRO A  32
ALA A  35
GLY A  34
 None
 1.27A 3v3oB-4c7vA:
undetectable		 3v3oB-4c7vA:
19.97
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.
4cab CATALASE

(Deinococcus
radiodurans) 		PF00199
(Catalase)
PF06628
(Catalase-rel) 		5 PHE A 143
GLY A 158
ALA A  87
GLY A  86
MET A 327
 None
HEM  A 537 (-4.0A)
None
None
None
 1.12A 3v3oB-4cabA:
undetectable		 3v3oB-4cabA:
22.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4cx9 CYTOCHROME C, CLASS
II

(Shewanella
frigidimarina) 		PF01322
(Cytochrom_C_2) 		5 PHE A  23
ASN A  47
GLY A  24
ALA A 110
ASN A 113
 HEC  A1129 ( 4.0A)
None
None
None
None
 1.19A 3v3oB-4cx9A:
undetectable		 3v3oB-4cx9A:
16.30
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.
4e8d GLYCOSYL HYDROLASE,
FAMILY 35

(Streptococcus
pneumoniae) 		PF01301
(Glyco_hydro_35) 		5 GLN A 335
PHE A  46
ASN A  40
GLY A  45
GLU A 258
 None
 1.03A 3v3oB-4e8dA:
undetectable		 3v3oB-4e8dA:
20.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4eud SUCCINYL-COA:ACETATE
COENZYME A
TRANSFERASE

(Acetobacter
aceti) 		PF02550
(AcetylCoA_hydro)
PF13336
(AcetylCoA_hyd_C) 		5 PHE A 250
HIS A 252
ALA A 243
GLY A 244
MET A 360
 None
 1.23A 3v3oB-4eudA:
undetectable		 3v3oB-4eudA:
20.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4eyo EXTRACELLULAR
LIGAND-BINDING
RECEPTOR

(Rhodopseudomonas
palustris) 		PF13458
(Peripla_BP_6) 		5 PHE A 311
ASN A  52
GLY A 308
ALA A  58
GLU A  60
 None
 1.31A 3v3oB-4eyoA:
undetectable		 3v3oB-4eyoA:
22.38
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.
4fvv NEUROTOXIN

(Clostridium
botulinum) 		PF07951
(Toxin_R_bind_C)
PF07953
(Toxin_R_bind_N) 		5 ARG A1132
ASN A1135
GLY A 999
ALA A1282
GLU A1107
 None
 1.18A 3v3oB-4fvvA:
undetectable		 3v3oB-4fvvA:
21.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hxe PUTATIVE
UNCHARACTERIZED
PROTEIN PH0594

(Pyrococcus
horikoshii) 		PF00326
(Peptidase_S9)
PF07676
(PD40) 		5 ASN B 473
GLY B 434
PRO B 388
GLY B 386
ASN B 414
 None
None
None
HEZ  B 709 ( 4.0A)
None
 1.11A 3v3oB-4hxeB:
undetectable		 3v3oB-4hxeB:
19.40
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.
4jc8 HOPS COMPONENT VPS33

(Chaetomium
thermophilum) 		PF00995
(Sec1) 		5 PHE A 157
ASN A 154
GLY A 610
PRO A 245
MET A 465
 None
 1.01A 3v3oB-4jc8A:
undetectable		 3v3oB-4jc8A:
20.21
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.
4jcl CYCLOMALTODEXTRIN
GLUCANOTRANSFERASE

(Paenibacillus
macerans) 		PF00128
(Alpha-amylase)
PF00686
(CBM_20)
PF01833
(TIG) 		5 GLY A  99
PRO A 143
ALA A 198
GLY A 155
ASN A 193
 None
EDO  A 720 ( 4.9A)
None
None
None
 1.28A 3v3oB-4jclA:
undetectable		 3v3oB-4jclA:
18.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jcm CYCLODEXTRIN
GLUCANOTRANSFERASE

([Bacillus]
clarkii) 		PF00128
(Alpha-amylase)
PF00686
(CBM_20)
PF01833
(TIG) 		5 GLY A  96
PRO A 140
ALA A 189
GLY A 146
ASN A 184
 None
 1.29A 3v3oB-4jcmA:
undetectable		 3v3oB-4jcmA:
20.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jfc ENOYL-COA HYDRATASE

(Polaromonas sp.
JS666) 		PF00378
(ECH_1) 		5 HIS A  88
GLY A  86
ALA A  26
GLY A  63
ASN A  20
 None
 1.26A 3v3oB-4jfcA:
undetectable		 3v3oB-4jfcA:
22.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4k1c VACUOLAR CALCIUM ION
TRANSPORTER

(Saccharomyces
cerevisiae) 		PF01699
(Na_Ca_ex) 		5 GLN A 152
GLY A 145
ALA A 322
GLY A 320
ASN A 133
 None
 1.23A 3v3oB-4k1cA:
undetectable		 3v3oB-4k1cA:
21.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4kf5 FLUORESCENT PROTEIN
SFCHERRY+GFP10-11

(synthetic
construct) 		PF01353
(GFP) 		5 HIS C  75
GLY C 259
GLY C 159
GLU C 216
ASN C 162
 None
 1.17A 3v3oB-4kf5C:
undetectable		 3v3oB-4kf5C:
21.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4lut ALANINE RACEMASE

(Clostridioides
difficile) 		PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N) 		5 ASN A  13
GLY A 230
ALA A  47
GLY A  46
GLU A  72
 None
 1.30A 3v3oB-4lutA:
undetectable		 3v3oB-4lutA:
23.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4o4x TBPB

(Glaesserella
parasuis) 		PF01298
(TbpB_B_D)
PF17483
(TbpB_C)
PF17484
(TbpB_A) 		5 ARG A  62
ASN A 157
GLY A 182
GLU A  41
ASN A  67
 None
 0.96A 3v3oB-4o4xA:
undetectable		 3v3oB-4o4xA:
22.10
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.
4qc8 VP2

(Ungulate
bocaparvovirus
1) 		PF00740
(Parvo_coat) 		5 PHE A 530
ASN A 254
HIS A 533
ALA A 376
ASN A 522
 None
 1.23A 3v3oB-4qc8A:
undetectable		 3v3oB-4qc8A:
20.63
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.
4qor CATALASE

(Bacillus
pumilus) 		PF00199
(Catalase)
PF06628
(Catalase-rel) 		5 PHE A 114
GLY A 129
ALA A  63
GLY A  62
MET A 298
 None
HEM  A 501 ( 3.8A)
None
None
None
 1.19A 3v3oB-4qorA:
undetectable		 3v3oB-4qorA:
21.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida) 		PF00171
(Aldedh) 		5 GLN A 299
ASN A 351
HIS A 348
GLY A 403
ALA A 373
 None
 1.28A 3v3oB-4qyjA:
2.6		 3v3oB-4qyjA:
21.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rpd CAPSID PROTEIN

(Norwalk virus) 		PF08435
(Calici_coat_C) 		5 ASN A 331
GLY A 334
PRO A 434
GLY A 442
ASN A 239
 None
 1.18A 3v3oB-4rpdA:
undetectable		 3v3oB-4rpdA:
22.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xsr ALR3699 PROTEIN

(Nostoc sp. PCC
7120) 		no annotation 5 PHE B 362
GLY B 175
ALA B 312
GLY B 311
MET B 298
 None
 1.20A 3v3oB-4xsrB:
2.4		 3v3oB-4xsrB:
25.47
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.
5b3j NMDA GLUTAMATE
RECEPTOR SUBUNIT

(Xenopus laevis) 		PF01094
(ANF_receptor) 		5 PHE A 137
GLY A 365
PRO A 117
ALA A 111
GLY A 112
 None
 1.18A 3v3oB-5b3jA:
4.0		 3v3oB-5b3jA:
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.
5b47 2-OXOACID--FERREDOXI
N OXIDOREDUCTASE
BETA SUBUNIT

(Sulfurisphaera
tokodaii) 		PF02775
(TPP_enzyme_C)
PF12367
(PFO_beta_C) 		5 PHE B 101
HIS B 103
GLY B  99
ALA B 154
ASN B 151
 None
 1.20A 3v3oB-5b47B:
undetectable		 3v3oB-5b47B:
20.48
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.
5csu 4-ALPHA-GLUCANOTRANS
FERASE DPE1,
CHLOROPLASTIC/AMYLOP
LASTIC

(Arabidopsis
thaliana) 		PF02446
(Glyco_hydro_77) 		5 ARG A 359
GLY A 292
PRO A 135
ALA A 137
GLY A 138
 None
None
None
GLC  A 605 ( 4.1A)
None
 1.17A 3v3oB-5csuA:
undetectable		 3v3oB-5csuA:
21.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5df0 AC-CHIA

(Autographa
californica
multiple
nucleopolyhedrovirus) 		PF00704
(Glyco_hydro_18)
PF08329
(ChitinaseA_N) 		5 PHE A 306
ASN A 313
GLY A 309
GLY A 263
MET A 379
 None
None
None
None
58Y  A 605 (-3.3A)
 1.18A 3v3oB-5df0A:
undetectable		 3v3oB-5df0A:
21.33
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.
5e2h BETA-LACTAMASE

(Mycolicibacterium
smegmatis) 		PF00144
(Beta-lactamase) 		5 ASN A 102
GLY A 110
PRO A 147
ALA A 215
GLY A 150
 None
None
CL  A 402 ( 4.8A)
None
None
 1.32A 3v3oB-5e2hA:
undetectable		 3v3oB-5e2hA:
20.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5gpr CHITINASE

(Ostrinia
furnacalis) 		PF00704
(Glyco_hydro_18)
PF08329
(ChitinaseA_N) 		5 PHE A 309
ASN A 316
GLY A 312
GLY A 266
MET A 381
 PHE  A 309 ( 1.3A)
ASN  A 316 ( 0.6A)
GLY  A 312 ( 0.0A)
GLY  A 266 ( 0.0A)
MET  A 381 ( 0.0A)
 1.11A 3v3oB-5gprA:
undetectable		 3v3oB-5gprA:
21.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5gt5 PECTATE LYASE

(Paenibacillus
sp. 0602) 		no annotation 5 PHE A  12
HIS A 266
GLY A  11
ALA A 333
ASN A 402
 None
 1.28A 3v3oB-5gt5A:
undetectable		 3v3oB-5gt5A:
23.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ipy FLAVIN-CONTAINING
MONOOXYGENASE

(Roseovarius
nubinhibens) 		PF00743
(FMO-like) 		5 GLN A 318
HIS A 164
PRO A  12
ALA A  10
GLY A   9
 FAD  A 502 (-3.2A)
None
FAD  A 502 (-3.7A)
None
FAD  A 502 (-3.3A)
 1.31A 3v3oB-5ipyA:
11.5		 3v3oB-5ipyA:
22.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jh8 PROBABLE CHITINASE

(Chromobacterium
violaceum) 		PF00704
(Glyco_hydro_18) 		5 GLN A  87
PHE A 121
HIS A 123
ALA A 114
GLY A 116
 None
 1.27A 3v3oB-5jh8A:
undetectable		 3v3oB-5jh8A:
20.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5lw7 ABC TRANSPORTER
ATP-BINDING PROTEIN

(Pyrococcus
abyssi) 		PF00005
(ABC_tran)
PF00037
(Fer4)
PF04068
(RLI) 		5 GLN B 410
ARG B 210
GLY B 217
GLY B 536
GLU B 534
 None
 0.84A 3v3oB-5lw7B:
undetectable		 3v3oB-5lw7B:
20.76
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.
5ng6 CRISPR-ASSOCIATED
ENDONUCLEASE CPF1

(Francisella
tularensis) 		no annotation 5 ASN A1093
GLY A1090
ALA A1079
GLY A1080
GLU A1006
 None
 1.22A 3v3oB-5ng6A:
undetectable		 3v3oB-5ng6A:
14.43
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.
5ng6 CRISPR-ASSOCIATED
ENDONUCLEASE CPF1

(Francisella
tularensis) 		no annotation 5 GLN A1296
ASN A1093
GLY A1090
GLY A1080
GLU A1006
 None
 1.25A 3v3oB-5ng6A:
undetectable		 3v3oB-5ng6A:
14.43
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.
5u7s FRUCTOSE-1,6-BISPHOS
PHATE ALDOLASE

(Acinetobacter
baumannii) 		PF01116
(F_bP_aldolase) 		5 ARG A 205
PHE A 203
GLY A 257
ALA A 213
GLY A 209
 None
 1.33A 3v3oB-5u7sA:
undetectable		 3v3oB-5u7sA:
19.65
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.
5uuj ALKZ

(Streptomyces
sahachiroi) 		PF06224
(HTH_42) 		5 PHE A   9
GLY A 321
PRO A 290
ALA A 218
GLY A 216
 None
 1.30A 3v3oB-5uujA:
undetectable		 3v3oB-5uujA:
22.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ux5 BIFUNCTIONAL PROTEIN
PROLINE UTILIZATION
A (PUTA)

(Corynebacterium
freiburgense) 		PF00171
(Aldedh)
PF01619
(Pro_dh) 		5 GLN A 721
HIS A 718
GLY A 720
ALA A 670
GLY A 669
 None
None
None
NAD  A2002 (-3.5A)
NAD  A2002 (-3.3A)
 1.24A 3v3oB-5ux5A:
undetectable		 3v3oB-5ux5A:
16.40
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.
5vj1 MDCA

(Pseudomonas
aeruginosa) 		PF16957
(Mal_decarbox_Al) 		5 PHE A 312
ASN A  58
GLY A 313
ALA A 382
GLY A 380
 CL  A 601 (-3.6A)
None
None
None
None
 1.28A 3v3oB-5vj1A:
undetectable		 3v3oB-5vj1A:
22.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xgv PYRE3

(Streptomyces
rugosporus) 		no annotation 5 GLN A  56
ARG A 322
ASN A 297
GLY A 440
GLY A 289
 None
 1.28A 3v3oB-5xgvA:
27.2		 3v3oB-5xgvA:
14.42
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.
5xm3 GLUCOSE
DEHYDROGENASE

(Methylophaga
aminisulfidivorans) 		no annotation 5 ASN A 264
GLY A 233
ALA A 207
GLY A 210
ASN A 292
 None
None
PQQ  A 701 (-3.0A)
None
MG  A 702 ( 3.0A)
 1.23A 3v3oB-5xm3A:
undetectable		 3v3oB-5xm3A:
11.83
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.
5yax SCFV1 ANTIBODY

(Homo sapiens) 		no annotation 5 GLN A1006
PHE A1118
ASN A1029
GLY A1119
ALA A 114
 None
 1.22A 3v3oB-5yaxA:
undetectable		 3v3oB-5yaxA:
19.00
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.
5yq0 COFJ

(Escherichia
coli) 		no annotation 5 PHE A 154
ASN A 130
GLY A 151
ALA A 220
ASN A 228
 None
 1.21A 3v3oB-5yq0A:
undetectable		 3v3oB-5yq0A:
11.76
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.
5zl9 CHITINASE AB

(Serratia
marcescens) 		no annotation 5 PHE A 316
ASN A 323
GLY A 319
GLY A 273
MET A 390
 None
None
None
None
GOL  A 706 (-3.3A)
 1.12A 3v3oB-5zl9A:
undetectable		 3v3oB-5zl9A:
13.17
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.
6bbp CYTOHESIN-3,ADP-RIBO
SYLATION FACTOR 6

(Homo sapiens;
Mus musculus) 		no annotation 5 ASN A 112
GLY A 108
GLY A  84
GLU A  90
ASN A  91
 None
 1.29A 3v3oB-6bbpA:
undetectable		 3v3oB-6bbpA:
14.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6cfw MEMBRANE-BOUND
HYDROGENASE SUBUNIT
ALPHA
MEMBRANE-BOUND
HYDROGENASE SUBUNIT
BETA

(Pyrococcus
furiosus) 		no annotation 5 ARG L  54
GLY L  47
PRO K 146
GLY K 153
GLU K 151
 None
 1.31A 3v3oB-6cfwL:
undetectable		 3v3oB-6cfwL:
10.85
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.
6etz BETA-GALACTOSIDASE

(Arthrobacter
sp. 32cB) 		no annotation 5 HIS A 131
GLY A 213
PRO A 127
GLY A  71
GLU A 124
 None
 1.23A 3v3oB-6etzA:
undetectable		 3v3oB-6etzA:
11.78