SIMILAR PATTERNS OF AMINO ACIDS FOR 3SFE_C_TMGC1_1

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.
1aso ASCORBATE OXIDASE

(Cucurbita pepo) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 PRO A 291
TRP A 277
SER A 181
ILE A 182
 None
 0.97A 3sfeB-1asoA:
0.0
3sfeC-1asoA:
undetectable		 3sfeB-1asoA:
16.61
3sfeC-1asoA:
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.
1buc BUTYRYL-COA
DEHYDROGENASE

(Megasphaera
elsdenii) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		4 HIS A 356
ILE A 257
ILE A 208
ARG A 355
 None
 1.11A 3sfeB-1bucA:
0.0
3sfeC-1bucA:
2.5		 3sfeB-1bucA:
18.72
3sfeC-1bucA:
17.19
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.
1c4x PROTEIN
(2-HYDROXY-6-OXO-6-P
HENYLHEXA-2,4-DIENOA
TE HYDROLASE)

(Rhodococcus
jostii) 		PF12697
(Abhydrolase_6) 		4 PRO A  78
MET A 202
SER A 205
ILE A  81
 None
 1.03A 3sfeB-1c4xA:
0.0
3sfeC-1c4xA:
0.0		 3sfeB-1c4xA:
21.66
3sfeC-1c4xA:
20.07
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.
1c8o ICE INHIBITOR

(Cowpox virus) 		PF00079
(Serpin) 		4 HIS A 280
ILE A 279
SER A 298
ILE A 128
 None
 1.06A 3sfeB-1c8oA:
undetectable
3sfeC-1c8oA:
undetectable		 3sfeB-1c8oA:
20.39
3sfeC-1c8oA:
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.
1g1c IMMUNOGLOBULIN-LIKE
DOMAIN I1 FROM TITIN

(Homo sapiens) 		PF07679
(I-set) 		4 ILE A   8
TRP A  39
SER A  90
ILE A  12
 None
 1.10A 3sfeB-1g1cA:
0.0
3sfeC-1g1cA:
undetectable		 3sfeB-1g1cA:
19.56
3sfeC-1g1cA:
17.14
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.
1hyb NICOTINAMIDE
MONONUCLEOTIDE
ADENYLYLTRANSFERASE

(Methanothermobacter
thermautotrophicus) 		PF01467
(CTP_transf_like) 		4 PRO A  14
ILE A 157
ILE A 166
ARG A 165
 None
 0.98A 3sfeB-1hybA:
0.0
3sfeC-1hybA:
0.0		 3sfeB-1hybA:
23.64
3sfeC-1hybA:
22.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1j5s URONATE ISOMERASE

(Thermotoga
maritima) 		PF02614
(UxaC) 		4 PRO A 237
HIS A 346
ILE A 291
ILE A 353
 None
 0.95A 3sfeB-1j5sA:
0.0
3sfeC-1j5sA:
0.0		 3sfeB-1j5sA:
19.79
3sfeC-1j5sA:
15.92
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.
1jdi L-RIBULOSE 5
PHOSPHATE
4-EPIMERASE

(Escherichia
coli) 		PF00596
(Aldolase_II) 		4 HIS A  95
ILE A  93
SER A  30
ILE A  41
 ZN  A 301 (-3.3A)
None
None
None
 1.05A 3sfeB-1jdiA:
0.0
3sfeC-1jdiA:
undetectable		 3sfeB-1jdiA:
19.06
3sfeC-1jdiA:
16.60
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.
1kag SHIKIMATE KINASE I

(Escherichia
coli) 		PF01202
(SKI) 		4 ILE A  67
SER A  35
ILE A  39
ARG A  42
 None
 1.12A 3sfeB-1kagA:
0.0
3sfeC-1kagA:
undetectable		 3sfeB-1kagA:
18.15
3sfeC-1kagA:
23.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1kfi PHOSPHOGLUCOMUTASE 1

(Paramecium
tetraurelia) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		4 ILE A 316
TRP A 409
SER A 328
ILE A 332
 None
 1.07A 3sfeB-1kfiA:
undetectable
3sfeC-1kfiA:
0.3		 3sfeB-1kfiA:
19.11
3sfeC-1kfiA:
13.73
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.
1kwa HCASK/LIN-2 PROTEIN

(Homo sapiens) 		PF00595
(PDZ) 		4 HIS A 512
ILE A 514
ILE A 536
ARG A 537
 None
 0.97A 3sfeB-1kwaA:
undetectable
3sfeC-1kwaA:
undetectable		 3sfeB-1kwaA:
15.66
3sfeC-1kwaA:
23.58
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.
1l3l TRANSCRIPTIONAL
ACTIVATOR PROTEIN
TRAR

(Agrobacterium
tumefaciens) 		PF00196
(GerE)
PF03472
(Autoind_bind) 		4 HIS A 156
ILE A 155
TRP A   4
ILE A 116
 None
 1.02A 3sfeB-1l3lA:
undetectable
3sfeC-1l3lA:
undetectable		 3sfeB-1l3lA:
20.45
3sfeC-1l3lA:
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.
1lq2 BETA-D-GLUCAN
GLUCOHYDROLASE
ISOENZYME EXO1

(Hordeum vulgare) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C) 		4 HIS A 331
ILE A 308
SER A 307
ILE A 289
 None
 1.07A 3sfeB-1lq2A:
undetectable
3sfeC-1lq2A:
0.0		 3sfeB-1lq2A:
17.11
3sfeC-1lq2A:
13.21
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.
1m0u GST2 GENE PRODUCT

(Drosophila
melanogaster) 		PF02798
(GST_N)
PF14497
(GST_C_3) 		4 PRO A  63
ILE A 205
TRP A 197
ILE A 111
 None
 0.90A 3sfeB-1m0uA:
undetectable
3sfeC-1m0uA:
2.0		 3sfeB-1m0uA:
18.55
3sfeC-1m0uA:
17.53
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.
1ni5 PUTATIVE CELL CYCLE
PROTEIN MESJ

(Escherichia
coli) 		PF01171
(ATP_bind_3)
PF09179
(TilS)
PF11734
(TilS_C) 		4 PRO A 154
ILE A 152
TRP A  35
ILE A  15
 None
 1.07A 3sfeB-1ni5A:
1.4
3sfeC-1ni5A:
undetectable		 3sfeB-1ni5A:
18.82
3sfeC-1ni5A:
15.09
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.
1nyl GLUTAMINYL-TRNA
SYNTHETASE

(Escherichia
coli) 		PF00749
(tRNA-synt_1c)
PF03950
(tRNA-synt_1c_C) 		4 ILE A 331
TRP A  87
SER A 305
ILE A 306
 None
 1.00A 3sfeB-1nylA:
undetectable
3sfeC-1nylA:
undetectable		 3sfeB-1nylA:
20.26
3sfeC-1nylA:
15.53
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.
1oww FIBRONECTIN FIRST
TYPE III MODULE

(Homo sapiens) 		PF00041
(fn3) 		4 PRO A  25
HIS A  29
ILE A  30
SER A  75
 None
 1.11A 3sfeB-1owwA:
undetectable
3sfeC-1owwA:
undetectable		 3sfeB-1owwA:
16.74
3sfeC-1owwA:
22.73
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.
1ozh ACETOLACTATE
SYNTHASE, CATABOLIC

(Klebsiella
pneumoniae) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		4 HIS A 337
ILE A 335
SER A 234
ILE A 236
 None
 0.94A 3sfeB-1ozhA:
undetectable
3sfeC-1ozhA:
undetectable		 3sfeB-1ozhA:
17.01
3sfeC-1ozhA:
13.35
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.
1pvt SUGAR-PHOSPHATE
ALDOLASE

(Thermotoga
maritima) 		PF00596
(Aldolase_II) 		4 HIS A 123
ILE A 121
SER A  29
ILE A  60
 None
 0.97A 3sfeB-1pvtA:
undetectable
3sfeC-1pvtA:
undetectable		 3sfeB-1pvtA:
22.03
3sfeC-1pvtA:
20.00
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.
1qu2 ISOLEUCYL-TRNA
SYNTHETASE

(Staphylococcus
aureus) 		PF00133
(tRNA-synt_1)
PF06827
(zf-FPG_IleRS)
PF08264
(Anticodon_1) 		4 PRO A  89
HIS A  53
ILE A  51
SER A 546
 None
 0.85A 3sfeB-1qu2A:
undetectable
3sfeC-1qu2A:
undetectable		 3sfeB-1qu2A:
14.90
3sfeC-1qu2A:
10.28
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.
1r3d CONSERVED
HYPOTHETICAL PROTEIN
VC1974

(Vibrio cholerae) 		PF12697
(Abhydrolase_6) 		4 PRO A 209
MET A 257
SER A 260
ILE A 261
 None
 0.73A 3sfeB-1r3dA:
undetectable
3sfeC-1r3dA:
undetectable		 3sfeB-1r3dA:
20.14
3sfeC-1r3dA:
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.
1squ CHEX PROTEIN

(Thermotoga
maritima) 		PF13690
(CheX) 		4 HIS A  35
ILE A 132
SER A 128
ILE A 126
 None
 1.06A 3sfeB-1squA:
undetectable
3sfeC-1squA:
undetectable		 3sfeB-1squA:
21.48
3sfeC-1squA:
26.25
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.
1vko INOSITOL-3-PHOSPHATE
SYNTHASE

(Caenorhabditis
elegans) 		PF01658
(Inos-1-P_synth)
PF07994
(NAD_binding_5) 		4 PRO A 269
HIS A 211
SER A 184
ILE A 149
 None
None
NAD  A 601 (-2.9A)
NAD  A 601 (-4.1A)
 1.06A 3sfeB-1vkoA:
undetectable
3sfeC-1vkoA:
undetectable		 3sfeB-1vkoA:
17.22
3sfeC-1vkoA:
12.57
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.
1w85 PYRUVATE
DEHYDROGENASE E1
COMPONENT, ALPHA
SUBUNIT

(Geobacillus
stearothermophilus) 		PF00676
(E1_dh) 		4 PRO A 100
HIS A 111
ILE A 108
ILE A 131
 None
 1.12A 3sfeB-1w85A:
undetectable
3sfeC-1w85A:
undetectable		 3sfeB-1w85A:
20.42
3sfeC-1w85A:
16.76
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.
1xuq SUPEROXIDE DISMUTASE

(Bacillus
anthracis) 		PF00081
(Sod_Fe_N)
PF02777
(Sod_Fe_C) 		4 PRO A  98
ILE A 106
TRP A 187
ILE A 162
 None
 0.98A 3sfeB-1xuqA:
undetectable
3sfeC-1xuqA:
undetectable		 3sfeB-1xuqA:
19.92
3sfeC-1xuqA:
21.83
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.
1yqq XANTHOSINE
PHOSPHORYLASE

(Escherichia
coli) 		PF01048
(PNP_UDP_1) 		4 PRO A 144
HIS A 226
ILE A 101
ARG A 102
 None
 1.10A 3sfeB-1yqqA:
undetectable
3sfeC-1yqqA:
undetectable		 3sfeB-1yqqA:
20.07
3sfeC-1yqqA:
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.
1yr1 CELL-DIVISION
INITIATION PROTEIN

(Geobacillus
stearothermophilus) 		no annotation 4 PRO A 189
TRP A 158
ILE A 211
ARG A 212
 None
 0.97A 3sfeB-1yr1A:
undetectable
3sfeC-1yr1A:
undetectable		 3sfeB-1yr1A:
17.32
3sfeC-1yr1A:
20.74
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.
2a9j BISPHOSPHOGLYCERATE
MUTASE

(Homo sapiens) 		PF00300
(His_Phos_1) 		4 PRO A 213
ILE A 245
ILE A 210
ARG A 117
 None
None
None
3PG  A 408 (-2.8A)
 0.91A 3sfeB-2a9jA:
undetectable
3sfeC-2a9jA:
undetectable		 3sfeB-2a9jA:
20.65
3sfeC-2a9jA:
22.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ag1 BENZALDEHYDE LYASE

(Pseudomonas
fluorescens) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		4 PRO A 162
ILE A 165
MET A 133
ARG A 105
 None
 1.10A 3sfeB-2ag1A:
undetectable
3sfeC-2ag1A:
undetectable		 3sfeB-2ag1A:
17.99
3sfeC-2ag1A:
13.00
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.
2bru NAD(P)
TRANSHYDROGENASE
SUBUNIT ALPHA

(Escherichia
coli) 		PF01262
(AlaDh_PNT_C)
PF05222
(AlaDh_PNT_N) 		4 PRO A1006
ILE A1069
ILE A1003
ARG A1002
 None
 1.07A 3sfeB-2bruA:
undetectable
3sfeC-2bruA:
undetectable		 3sfeB-2bruA:
18.58
3sfeC-2bruA:
18.11
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.
2cgj L-RHAMNULOSE KINASE

(Escherichia
coli) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		4 HIS A 236
SER A 240
ILE A 243
ARG A 292
 LFR  A1481 (-3.9A)
None
None
None
 1.10A 3sfeB-2cgjA:
undetectable
3sfeC-2cgjA:
undetectable		 3sfeB-2cgjA:
19.31
3sfeC-2cgjA:
15.24
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.
2ckr ENDOGLUCANASE E-5

(Thermobifida
fusca) 		PF00150
(Cellulase) 		4 PRO A 264
HIS A 225
ILE A 226
ILE A 260
 None
 0.99A 3sfeB-2ckrA:
undetectable
3sfeC-2ckrA:
undetectable		 3sfeB-2ckrA:
19.87
3sfeC-2ckrA:
16.67
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.
2fja ADENYLYLSULFATE
REDUCTASE, SUBUNIT A
ADENYLYLSULFATE
REDUCTASE, SUBUNIT B

(Archaeoglobus
fulgidus) 		PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C)
PF12139
(APS-reductase_C)
PF13187
(Fer4_9) 		4 PRO B 844
HIS A 115
ILE B 838
ILE A  77
 None
 1.08A 3sfeB-2fjaB:
undetectable
3sfeC-2fjaB:
undetectable		 3sfeB-2fjaB:
22.61
3sfeC-2fjaB:
20.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2gpr GLUCOSE-PERMEASE IIA
COMPONENT

(Mycoplasma
capricolum) 		PF00358
(PTS_EIIA_1) 		4 PRO A  18
ILE A  45
SER A 129
ILE A  84
 None
 1.05A 3sfeB-2gprA:
undetectable
3sfeC-2gprA:
undetectable		 3sfeB-2gprA:
19.84
3sfeC-2gprA:
29.81
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.
2h89 SUCCINATE
DEHYDROGENASE
CYTOCHROME B, LARGE
SUBUNIT

(Gallus gallus) 		PF01127
(Sdh_cyt) 		5 TRP C  32
MET C  36
SER C  39
ILE C  40
ARG C  43
 BHG  C 141 (-4.0A)
UNL  C 144 (-4.7A)
UNL  C 145 ( 3.8A)
UNL  C 144 ( 4.0A)
HEM  C 142 (-3.8A)
 0.80A 3sfeB-2h89C:
undetectable
3sfeC-2h89C:
15.7		 3sfeB-2h89C:
19.76
3sfeC-2h89C:
69.29
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.
2htv NEURAMINIDASE

(Influenza A
virus) 		PF00064
(Neur) 		4 PRO A 167
ILE A 117
SER A 440
ILE A 106
 None
 0.91A 3sfeB-2htvA:
undetectable
3sfeC-2htvA:
undetectable		 3sfeB-2htvA:
20.05
3sfeC-2htvA:
16.76
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.
2if7 SLAM FAMILY MEMBER 6

(Homo sapiens) 		PF07686
(V-set) 		4 PRO A  51
HIS A  54
ILE A  53
ILE A  31
 None
 0.94A 3sfeB-2if7A:
undetectable
3sfeC-2if7A:
undetectable		 3sfeB-2if7A:
16.41
3sfeC-2if7A:
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.
2iyf OLEANDOMYCIN
GLYCOSYLTRANSFERASE

(Streptomyces
antibioticus) 		PF00201
(UDPGT) 		4 PRO A 132
HIS A 109
SER A  13
ILE A  14
 None
 1.10A 3sfeB-2iyfA:
undetectable
3sfeC-2iyfA:
undetectable		 3sfeB-2iyfA:
19.71
3sfeC-2iyfA:
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.
2p2s PUTATIVE
OXIDOREDUCTASE

(Pectobacterium
atrosepticum) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		4 PRO A  98
ILE A 181
SER A 324
ILE A 325
 None
 0.82A 3sfeB-2p2sA:
undetectable
3sfeC-2p2sA:
undetectable		 3sfeB-2p2sA:
19.82
3sfeC-2p2sA:
18.89
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.
2qjx PROTEIN BIM1

(Saccharomyces
cerevisiae) 		no annotation 4 ILE A  43
TRP A  15
SER A  42
ILE A  39
 None
 1.10A 3sfeB-2qjxA:
undetectable
3sfeC-2qjxA:
undetectable		 3sfeB-2qjxA:
19.51
3sfeC-2qjxA:
20.00
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.
2var FRUCTOKINASE

(Sulfolobus
solfataricus) 		PF00294
(PfkB) 		4 PRO A  10
ILE A  65
SER A  69
ILE A  74
 None
 1.06A 3sfeB-2varA:
undetectable
3sfeC-2varA:
undetectable		 3sfeB-2varA:
21.04
3sfeC-2varA:
21.76
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.
2zbz CYTOCHROME P450-SU1

(Streptomyces
griseolus) 		PF00067
(p450) 		4 PRO A  27
SER A 321
ILE A 322
ARG A  34
 None
 0.92A 3sfeB-2zbzA:
undetectable
3sfeC-2zbzA:
1.9		 3sfeB-2zbzA:
20.29
3sfeC-2zbzA:
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.
2zbz CYTOCHROME P450-SU1

(Streptomyces
griseolus) 		PF00067
(p450) 		4 PRO A  27
SER A 321
ILE A 322
ARG A 325
 None
 1.05A 3sfeB-2zbzA:
undetectable
3sfeC-2zbzA:
1.9		 3sfeB-2zbzA:
20.29
3sfeC-2zbzA:
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.
2zqp PREPROTEIN
TRANSLOCASE SECY
SUBUNIT

(Thermus
thermophilus) 		PF00344
(SecY) 		4 PRO Y 382
ILE Y 385
TRP Y 196
ILE Y 224
 None
 1.06A 3sfeB-2zqpY:
undetectable
3sfeC-2zqpY:
1.6		 3sfeB-2zqpY:
19.13
3sfeC-2zqpY:
17.65
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.
3a3h ENDOGLUCANASE

(Salipaludibacillus
agaradhaerens) 		PF00150
(Cellulase) 		4 PRO A 140
HIS A 101
ILE A 102
ILE A 136
 None
CTR  A   1 (-4.0A)
None
None
 0.88A 3sfeB-3a3hA:
undetectable
3sfeC-3a3hA:
undetectable		 3sfeB-3a3hA:
19.57
3sfeC-3a3hA:
17.50
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3aeb SUCCINATE
DEHYDROGENASE
CYTOCHROME B560
SUBUNIT,
MITOCHONDRIAL
SUCCINATE
DEHYDROGENASE
[UBIQUINONE]
IRON-SULFUR SUBUNIT,
MITOCHONDRIAL

(Sus scrofa) 		PF01127
(Sdh_cyt)
PF13085
(Fer2_3)
PF13534
(Fer4_17) 		6 PRO B 169
HIS B 216
ILE B 218
MET C  39
ILE C  43
ARG C  46
 F7A  C1201 (-4.6A)
F7A  C1201 ( 4.1A)
F3S  B 304 (-4.2A)
F7A  C1201 (-3.2A)
None
F7A  C1201 ( 3.2A)
 0.65A 3sfeB-3aebB:
36.7
3sfeC-3aebB:
undetectable		 3sfeB-3aebB:
99.60
3sfeC-3aebB:
19.38
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3aeb SUCCINATE
DEHYDROGENASE
CYTOCHROME B560
SUBUNIT,
MITOCHONDRIAL
SUCCINATE
DEHYDROGENASE
[UBIQUINONE]
IRON-SULFUR SUBUNIT,
MITOCHONDRIAL

(Sus scrofa) 		PF01127
(Sdh_cyt)
PF13085
(Fer2_3)
PF13534
(Fer4_17) 		6 PRO B 169
ILE B 218
MET C  39
SER C  42
ILE C  43
ARG C  46
 F7A  C1201 (-4.6A)
F3S  B 304 (-4.2A)
F7A  C1201 (-3.2A)
F7A  C1201 (-3.1A)
None
F7A  C1201 ( 3.2A)
 0.92A 3sfeB-3aebB:
36.7
3sfeC-3aebB:
undetectable		 3sfeB-3aebB:
99.60
3sfeC-3aebB:
19.38
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.
3agr NUCLEOSIDE
TRIPHOSPHATE
HYDROLASE

(Neospora
caninum) 		PF01150
(GDA1_CD39) 		4 ILE A 535
MET A 470
SER A 473
ILE A 474
 None
 1.12A 3sfeB-3agrA:
undetectable
3sfeC-3agrA:
undetectable		 3sfeB-3agrA:
17.55
3sfeC-3agrA:
13.09
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.
3c2o NICOTINATE-NUCLEOTID
E PYROPHOSPHORYLASE

(Saccharomyces
cerevisiae) 		PF01729
(QRPTase_C)
PF02749
(QRPTase_N) 		4 ILE A 119
MET A 157
SER A 123
ILE A 280
 None
 0.97A 3sfeB-3c2oA:
undetectable
3sfeC-3c2oA:
undetectable		 3sfeB-3c2oA:
22.19
3sfeC-3c2oA:
18.77
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.
3c3m RESPONSE REGULATOR
RECEIVER PROTEIN

(Methanoculleus
marisnigri) 		PF00072
(Response_reg) 		4 PRO A 106
ILE A  14
MET A  13
SER A  11
 None
GOL  A 201 (-4.5A)
None
GOL  A 201 (-2.7A)
 1.10A 3sfeB-3c3mA:
undetectable
3sfeC-3c3mA:
undetectable		 3sfeB-3c3mA:
17.79
3sfeC-3c3mA:
25.83
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.
3ckz NEURAMINIDASE

(Influenza A
virus) 		PF00064
(Neur) 		4 PRO A 167
ILE A 117
SER A 440
ILE A 106
 None
 0.96A 3sfeB-3ckzA:
undetectable
3sfeC-3ckzA:
undetectable		 3sfeB-3ckzA:
20.00
3sfeC-3ckzA:
18.47
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.
3cze SUCROSE HYDROLASE

(Xanthomonas
citri) 		PF00128
(Alpha-amylase) 		4 HIS A  34
ILE A 312
TRP A  59
ARG A  37
 None
 1.11A 3sfeB-3czeA:
undetectable
3sfeC-3czeA:
undetectable		 3sfeB-3czeA:
15.43
3sfeC-3czeA:
12.81
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.
3hdc THIOREDOXIN FAMILY
PROTEIN

(Geobacter
metallireducens) 		PF00578
(AhpC-TSA) 		4 ILE A  61
TRP A 156
ILE A 139
ARG A 147
 None
 0.91A 3sfeB-3hdcA:
undetectable
3sfeC-3hdcA:
undetectable		 3sfeB-3hdcA:
19.01
3sfeC-3hdcA:
20.36
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.
3hhs PHENOLOXIDASE
SUBUNIT 1

(Manduca sexta) 		PF00372
(Hemocyanin_M)
PF03722
(Hemocyanin_N)
PF03723
(Hemocyanin_C) 		4 PRO B  33
ILE B  32
SER B 114
ARG B 119
 None
 1.01A 3sfeB-3hhsB:
undetectable
3sfeC-3hhsB:
1.4		 3sfeB-3hhsB:
16.76
3sfeC-3hhsB:
12.95
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.
3i1i HOMOSERINE
O-ACETYLTRANSFERASE

(Bacillus
anthracis) 		PF00561
(Abhydrolase_1) 		4 HIS A 146
ILE A  42
TRP A  68
ILE A 173
 None
 0.93A 3sfeB-3i1iA:
undetectable
3sfeC-3i1iA:
undetectable		 3sfeB-3i1iA:
21.50
3sfeC-3i1iA:
16.85
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.
3ihg RDME

(Streptomyces
purpurascens) 		PF01494
(FAD_binding_3) 		4 MET A 102
SER A  96
ILE A  81
ARG A  82
 VAK  A 537 ( 4.2A)
None
None
None
 1.02A 3sfeB-3ihgA:
undetectable
3sfeC-3ihgA:
undetectable		 3sfeB-3ihgA:
17.62
3sfeC-3ihgA:
13.89
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.
3j8v H16.14J HEAVY CHAIN

(Mus musculus) 		no annotation 4 ILE H  82
TRP H  36
MET H  80
ILE H  20
 None
 1.03A 3sfeB-3j8vH:
undetectable
3sfeC-3j8vH:
undetectable		 3sfeB-3j8vH:
18.33
3sfeC-3j8vH:
18.52
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.
3k7y ASPARTATE
AMINOTRANSFERASE

(Plasmodium
falciparum) 		PF00155
(Aminotran_1_2) 		4 HIS A 262
ILE A 263
SER A 242
ILE A 211
 None
 1.09A 3sfeB-3k7yA:
undetectable
3sfeC-3k7yA:
undetectable		 3sfeB-3k7yA:
21.17
3sfeC-3k7yA:
17.31
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.
3la8 PUTATIVE PURINE
NUCLEOSIDE
PHOSPHORYLASE

(Streptococcus
mutans) 		PF01048
(PNP_UDP_1) 		4 PRO A 138
HIS A 220
ILE A 216
ARG A  98
 None
 1.11A 3sfeB-3la8A:
undetectable
3sfeC-3la8A:
undetectable		 3sfeB-3la8A:
21.73
3sfeC-3la8A:
20.66
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.
3lmz PUTATIVE SUGAR
ISOMERASE

(Parabacteroides
distasonis) 		PF01261
(AP_endonuc_2) 		4 PRO A 136
HIS A 176
ILE A 157
ILE A 184
 None
 1.03A 3sfeB-3lmzA:
undetectable
3sfeC-3lmzA:
undetectable		 3sfeB-3lmzA:
21.43
3sfeC-3lmzA:
22.18
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.
3lpm PUTATIVE
METHYLTRANSFERASE

(Listeria
monocytogenes) 		PF05175
(MTS) 		4 MET A  87
SER A  91
ILE A  24
ARG A  23
 None
 0.92A 3sfeB-3lpmA:
undetectable
3sfeC-3lpmA:
undetectable		 3sfeB-3lpmA:
20.34
3sfeC-3lpmA:
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.
3my7 ALCOHOL
DEHYDROGENASE/ACETAL
DEHYDE DEHYDROGENASE

(Vibrio
parahaemolyticus) 		PF00171
(Aldedh) 		5 PRO A 218
HIS A 368
MET A 390
ILE A 395
ARG A 394
 None
 1.24A 3sfeB-3my7A:
undetectable
3sfeC-3my7A:
undetectable		 3sfeB-3my7A:
20.58
3sfeC-3my7A:
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.
3nzp ARGININE
DECARBOXYLASE

(Campylobacter
jejuni) 		PF02784
(Orn_Arg_deC_N) 		4 HIS A 379
ILE A 382
SER A 381
ILE A 412
 None
 1.07A 3sfeB-3nzpA:
undetectable
3sfeC-3nzpA:
3.0		 3sfeB-3nzpA:
17.80
3sfeC-3nzpA:
13.01
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.
3oa2 WBPB

(Pseudomonas
aeruginosa) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		4 HIS A 134
ILE A 137
ILE A 249
ARG A 247
 None
 1.10A 3sfeB-3oa2A:
undetectable
3sfeC-3oa2A:
undetectable		 3sfeB-3oa2A:
23.21
3sfeC-3oa2A:
18.79
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.
3pzu ENDOGLUCANASE

(Bacillus
subtilis) 		PF00150
(Cellulase) 		4 PRO A 170
HIS A 131
ILE A 132
ILE A 166
 None
 0.90A 3sfeB-3pzuA:
undetectable
3sfeC-3pzuA:
undetectable		 3sfeB-3pzuA:
20.06
3sfeC-3pzuA:
16.13
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.
3qlt GLUTAMATE RECEPTOR,
IONOTROPIC KAINATE 2

(Rattus
norvegicus) 		PF01094
(ANF_receptor) 		4 PRO A 120
ILE A 250
ILE A 344
ARG A 343
 None
 1.11A 3sfeB-3qltA:
undetectable
3sfeC-3qltA:
undetectable		 3sfeB-3qltA:
19.31
3sfeC-3qltA:
19.63
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.
3qvn MANGANESE-CONTAINING
SUPEROXIDE DISMUTASE

(Candida
albicans) 		PF00081
(Sod_Fe_N)
PF02777
(Sod_Fe_C) 		4 PRO A  98
ILE A 108
TRP A 192
ILE A 137
 None
 0.90A 3sfeB-3qvnA:
undetectable
3sfeC-3qvnA:
undetectable		 3sfeB-3qvnA:
22.81
3sfeC-3qvnA:
20.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ti8 NEURAMINIDASE

(Influenza A
virus) 		PF00064
(Neur) 		4 PRO A 166
ILE A 117
SER A 440
ILE A 106
 None
 0.86A 3sfeB-3ti8A:
undetectable
3sfeC-3ti8A:
undetectable		 3sfeB-3ti8A:
21.33
3sfeC-3ti8A:
16.09
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.
3ttg PUTATIVE
AMINOMETHYLTRANSFERA
SE

(Leptospirillum
rubarum) 		PF01571
(GCV_T)
PF08669
(GCV_T_C) 		4 ILE A 297
SER A 295
ILE A 302
ARG A 262
 None
 0.94A 3sfeB-3ttgA:
undetectable
3sfeC-3ttgA:
undetectable		 3sfeB-3ttgA:
20.48
3sfeC-3ttgA:
18.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3v5r PROTEIN GAL3

(Saccharomyces
cerevisiae) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C)
PF10509
(GalKase_gal_bdg) 		4 PRO A 157
ILE A 156
ILE A  67
ARG A  47
 None
None
None
SO4  A   4 (-2.8A)
 1.06A 3sfeB-3v5rA:
undetectable
3sfeC-3v5rA:
undetectable		 3sfeB-3v5rA:
20.81
3sfeC-3v5rA:
14.61
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.
3vkg DYNEIN HEAVY CHAIN,
CYTOPLASMIC

(Dictyostelium
discoideum) 		PF03028
(Dynein_heavy)
PF07728
(AAA_5)
PF08393
(DHC_N2)
PF12774
(AAA_6)
PF12775
(AAA_7)
PF12777
(MT)
PF12780
(AAA_8)
PF12781
(AAA_9) 		4 HIS A2524
ILE A2525
ILE A2671
ARG A2532
 None
 1.06A 3sfeB-3vkgA:
undetectable
3sfeC-3vkgA:
undetectable		 3sfeB-3vkgA:
5.46
3sfeC-3vkgA:
3.61
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.
4b7j NEURAMINIDASE

(Influenza A
virus) 		PF00064
(Neur) 		4 PRO A 167
ILE A 117
SER A 439
ILE A 106
 None
 0.88A 3sfeB-4b7jA:
undetectable
3sfeC-4b7jA:
undetectable		 3sfeB-4b7jA:
18.75
3sfeC-4b7jA:
16.31
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.
4c25 L-FUCULOSE PHOSPHATE
ALDOLASE

(Streptococcus
pneumoniae) 		PF00596
(Aldolase_II) 		4 HIS A  93
ILE A  91
SER A  29
ILE A  40
 ZN  A 301 ( 3.2A)
None
None
None
 1.04A 3sfeB-4c25A:
undetectable
3sfeC-4c25A:
undetectable		 3sfeB-4c25A:
19.69
3sfeC-4c25A:
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.
4e4r PHOSPHATE
ACETYLTRANSFERASE

(Staphylococcus
aureus) 		PF01515
(PTA_PTB) 		4 ILE A 181
SER A 150
ILE A 169
ARG A 148
 EDO  A 502 (-4.7A)
EDO  A 502 ( 4.3A)
None
EDO  A 502 (-3.7A)
 1.12A 3sfeB-4e4rA:
undetectable
3sfeC-4e4rA:
undetectable		 3sfeB-4e4rA:
20.65
3sfeC-4e4rA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4izk YELLOWTAIL ASCITES
VIRUS (YAV) VP4
PROTEASE

(Yellowtail
ascites virus) 		PF01768
(Birna_VP4) 		4 PRO A 537
ILE A 619
ILE A 542
ARG A 651
 None
 1.10A 3sfeB-4izkA:
undetectable
3sfeC-4izkA:
undetectable		 3sfeB-4izkA:
20.08
3sfeC-4izkA:
24.07
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.
4jat ALPHA-PYRONE
SYNTHESIS POLYKETIDE
SYNTHASE-LIKE PKS11

(Mycobacterium
tuberculosis) 		PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C) 		4 HIS A 318
TRP A 352
ILE A 324
ARG A 321
 None
 1.10A 3sfeB-4jatA:
undetectable
3sfeC-4jatA:
undetectable		 3sfeB-4jatA:
19.39
3sfeC-4jatA:
20.06
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.
4l5i TRANSCRIPTIONAL
REGULATOR LSRR

(Escherichia
coli) 		PF04198
(Sugar-bind) 		4 HIS A 108
ILE A 104
ILE A  90
ARG A  88
 None
 0.97A 3sfeB-4l5iA:
undetectable
3sfeC-4l5iA:
undetectable		 3sfeB-4l5iA:
20.96
3sfeC-4l5iA:
17.85
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.
4lk2 PRE-MRNA-PROCESSING
ATP-DEPENDENT RNA
HELICASE PRP5

(Saccharomyces
cerevisiae) 		PF00270
(DEAD)
PF00271
(Helicase_C) 		4 ILE A 282
TRP A 257
SER A 309
ILE A 308
 None
 0.97A 3sfeB-4lk2A:
undetectable
3sfeC-4lk2A:
undetectable		 3sfeB-4lk2A:
17.68
3sfeC-4lk2A:
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.
4lqz UNCHARACTERIZED
PROTEIN

(Staphylococcus
aureus) 		PF16253
(DUF4909) 		4 HIS A  56
ILE A  57
TRP A  95
ILE A  80
 None
 0.70A 3sfeB-4lqzA:
undetectable
3sfeC-4lqzA:
undetectable		 3sfeB-4lqzA:
21.96
3sfeC-4lqzA:
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.
4mju NEURAMINIDASE

(Influenza A
virus) 		PF00064
(Neur) 		4 PRO A 167
ILE A 117
SER A 440
ILE A 106
 None
 0.88A 3sfeB-4mjuA:
undetectable
3sfeC-4mjuA:
undetectable		 3sfeB-4mjuA:
19.84
3sfeC-4mjuA:
16.49
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.
4mq0 PARKIA BIGLOBOSA
LECTIN (PBL)

(Parkia
biglobosa) 		PF01419
(Jacalin) 		4 ILE A 123
TRP A  11
SER A  81
ILE A 144
 None
 0.91A 3sfeB-4mq0A:
undetectable
3sfeC-4mq0A:
undetectable		 3sfeB-4mq0A:
18.85
3sfeC-4mq0A:
14.38
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.
4mq0 PARKIA BIGLOBOSA
LECTIN (PBL)

(Parkia
biglobosa) 		PF01419
(Jacalin) 		4 ILE A 268
TRP A 159
SER A 227
ILE A 289
 None
 0.96A 3sfeB-4mq0A:
undetectable
3sfeC-4mq0A:
undetectable		 3sfeB-4mq0A:
18.85
3sfeC-4mq0A:
14.38
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.
4p7h MYOSIN-7,GREEN
FLUORESCENT PROTEIN

(Aequorea
victoria;
Homo sapiens) 		PF00063
(Myosin_head)
PF01353
(GFP)
PF02736
(Myosin_N) 		4 HIS A 284
ILE A 285
ILE A 313
ARG A 281
 None
 1.07A 3sfeB-4p7hA:
undetectable
3sfeC-4p7hA:
undetectable		 3sfeB-4p7hA:
13.52
3sfeC-4p7hA:
9.02
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.
4pu5 TOXIN-ANTITOXIN
SYSTEM TOXIN HIPA
FAMILY

(Shewanella
oneidensis) 		PF07804
(HipA_C)
PF13657
(Couple_hipA) 		4 PRO A 397
ILE A 208
ILE A 191
ARG A 194
 None
 1.11A 3sfeB-4pu5A:
undetectable
3sfeC-4pu5A:
undetectable		 3sfeB-4pu5A:
18.53
3sfeC-4pu5A:
16.56
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.
4u3a ENDOGLUCANASE H

(Ruminiclostridium
thermocellum) 		PF00150
(Cellulase) 		4 PRO A 210
HIS A 168
ILE A 240
ARG A 124
 None
 0.94A 3sfeB-4u3aA:
undetectable
3sfeC-4u3aA:
undetectable		 3sfeB-4u3aA:
19.42
3sfeC-4u3aA:
15.65
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.
4xqk LLABIII

(Lactococcus
lactis) 		PF00271
(Helicase_C)
PF02384
(N6_Mtase)
PF04851
(ResIII)
PF13156
(Mrr_cat_2) 		4 PRO A1019
MET A1068
SER A1071
ILE A1081
 None
 0.95A 3sfeB-4xqkA:
undetectable
3sfeC-4xqkA:
2.2		 3sfeB-4xqkA:
9.52
3sfeC-4xqkA:
6.73
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.
4xzb CELA

(Geobacillus sp.
70PC53) 		PF00150
(Cellulase) 		4 PRO A 143
HIS A 104
ILE A 105
ILE A 139
 None
 0.87A 3sfeB-4xzbA:
undetectable
3sfeC-4xzbA:
undetectable		 3sfeB-4xzbA:
19.94
3sfeC-4xzbA:
17.42
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.
4xzw ENDO-GLUCANASE
CHIMERA C10

(Geobacillus sp.
70PC53;
uncultured
bacterium) 		PF00150
(Cellulase) 		4 PRO A 143
HIS A 104
ILE A 105
ILE A 139
 None
 0.94A 3sfeB-4xzwA:
undetectable
3sfeC-4xzwA:
undetectable		 3sfeB-4xzwA:
19.52
3sfeC-4xzwA:
19.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yxd SUCCINATE
DEHYDROGENASE
CYTOCHROME B560
SUBUNIT,
MITOCHONDRIAL

(Sus scrofa) 		PF01127
(Sdh_cyt) 		4 MET C  39
SER C  42
ILE C  43
ARG C  46
 FTN  C 302 (-3.3A)
FTN  C 302 (-3.0A)
None
FTN  C 302 ( 3.6A)
 0.81A 3sfeB-4yxdC:
undetectable
3sfeC-4yxdC:
16.6		 3sfeB-4yxdC:
19.85
3sfeC-4yxdC:
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.
5bnz GLUTAMINE--TRNA
LIGASE

(Pseudomonas
aeruginosa) 		PF00749
(tRNA-synt_1c)
PF03950
(tRNA-synt_1c_C) 		4 ILE A 333
TRP A  89
SER A 307
ILE A 308
 None
 0.73A 3sfeB-5bnzA:
undetectable
3sfeC-5bnzA:
undetectable		 3sfeB-5bnzA:
18.91
3sfeC-5bnzA:
13.68
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.
5c0p ENDO-ARABINASE

(Bacteroides
thetaiotaomicron) 		PF04616
(Glyco_hydro_43) 		4 HIS A 286
TRP A  86
SER A 300
ILE A  56
 MG  A 402 ( 3.4A)
None
None
None
 0.85A 3sfeB-5c0pA:
undetectable
3sfeC-5c0pA:
undetectable		 3sfeB-5c0pA:
22.15
3sfeC-5c0pA:
20.53
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.
5foi MYCINAMICIN VIII C21
METHYL HYDROXYLASE

(Micromonospora
griseorubida) 		PF00067
(p450) 		4 PRO A  15
TRP A   4
SER A 303
ARG A  22
 None
 1.06A 3sfeB-5foiA:
undetectable
3sfeC-5foiA:
2.1		 3sfeB-5foiA:
18.20
3sfeC-5foiA:
16.18
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.
5h42 UNCHARACTERIZED
PROTEIN

(Lachnoclostridium
phytofermentans) 		PF17167
(Glyco_hydro_36) 		4 PRO A 172
HIS A  32
ILE A  35
SER A  34
 None
 1.11A 3sfeB-5h42A:
undetectable
3sfeC-5h42A:
undetectable		 3sfeB-5h42A:
11.87
3sfeC-5h42A:
8.18
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.
5ir6 BD-TYPE QUINOL
OXIDASE SUBUNIT I
PUTATIVE MEMBRANE
PROTEIN

(Geobacillus sp.
PA-3;
Geobacillus
stearothermophilus) 		PF01654
(Cyt_bd_oxida_I)
no annotation 		4 HIS C 792
MET A  48
ILE A  43
ARG A  44
 None
 1.13A 3sfeB-5ir6C:
undetectable
3sfeC-5ir6C:
undetectable		 3sfeB-5ir6C:
8.96
3sfeC-5ir6C:
14.29
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.
5k1b WD REPEAT-CONTAINING
PROTEIN 48

(Homo sapiens) 		PF00400
(WD40)
PF11816
(DUF3337) 		4 PRO B 514
HIS B  73
SER B  52
ILE B  53
 None
 0.95A 3sfeB-5k1bB:
undetectable
3sfeC-5k1bB:
undetectable		 3sfeB-5k1bB:
13.93
3sfeC-5k1bB:
12.73
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.
5lc5 NADH DEHYDROGENASE
[UBIQUINONE]
IRON-SULFUR PROTEIN
2, MITOCHONDRIAL
NADH DEHYDROGENASE
[UBIQUINONE]
IRON-SULFUR PROTEIN
3, MITOCHONDRIAL

(Bos taurus) 		PF00329
(Complex1_30kDa)
PF00346
(Complex1_49kDa) 		4 HIS D  59
ILE D 423
TRP C 129
ILE D  80
 None
 1.04A 3sfeB-5lc5D:
undetectable
3sfeC-5lc5D:
2.2		 3sfeB-5lc5D:
19.81
3sfeC-5lc5D:
14.92
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.
5lgx PENTAERYTHRITOL
TETRANITRATE
REDUCTASE

(Enterobacter
cloacae) 		PF00724
(Oxidored_FMN) 		4 PRO A 236
HIS A 184
SER A 182
ILE A 232
 None
IPA  A 402 ( 3.5A)
None
None
 1.12A 3sfeB-5lgxA:
undetectable
3sfeC-5lgxA:
undetectable		 3sfeB-5lgxA:
21.56
3sfeC-5lgxA:
18.47
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.
5mqs BETA-L-ARABINOBIOSID
ASE

(Bacteroides
thetaiotaomicron) 		PF13088
(BNR_2) 		4 ILE A 165
TRP A 246
MET A 167
ILE A 205
 None
 1.06A 3sfeB-5mqsA:
undetectable
3sfeC-5mqsA:
undetectable		 3sfeB-5mqsA:
12.74
3sfeC-5mqsA:
7.58
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.
5xu6 INOSITOL-PENTAKISPHO
SPHATE 2-KINASE

(Cryptococcus
neoformans) 		PF06090
(Ins_P5_2-kin) 		4 PRO A 160
HIS A 164
SER A 289
ILE A 288
 None
 1.09A 3sfeB-5xu6A:
undetectable
3sfeC-5xu6A:
undetectable		 3sfeB-5xu6A:
20.38
3sfeC-5xu6A:
18.54
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.
6fsa -

(-) 		no annotation 4 HIS A 284
ILE A 285
ILE A 313
ARG A 281
 None
 1.08A 3sfeB-6fsaA:
undetectable
3sfeC-6fsaA:
2.0		 3sfeB-6fsaA:
undetectable
3sfeC-6fsaA:
undetectable