SIMILAR PATTERNS OF AMINO ACIDS FOR 3U9F_S_CLMS221_0

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.
1aux SYNAPSIN IA

(Bos taurus) 		PF02078
(Synapsin)
PF02750
(Synapsin_C) 		5 SER A 390
SER A 212
LEU A 116
VAL A 143
VAL A 410
 None
 1.30A 3u9fP-1auxA:
0.0
3u9fS-1auxA:
0.0		 3u9fP-1auxA:
19.29
3u9fS-1auxA:
19.29
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.
1aux SYNAPSIN IA

(Bos taurus) 		PF02078
(Synapsin)
PF02750
(Synapsin_C) 		5 SER A 390
SER A 212
VAL A 143
PHE A 130
VAL A 410
 None
 1.33A 3u9fP-1auxA:
0.0
3u9fS-1auxA:
0.0		 3u9fP-1auxA:
19.29
3u9fS-1auxA:
19.29
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.
1efv ELECTRON TRANSFER
FLAVOPROTEIN

(Homo sapiens) 		PF00766
(ETF_alpha)
PF01012
(ETF) 		5 CYH A  53
PHE A 115
LEU A  67
VAL A  76
VAL A  63
 None
 1.18A 3u9fP-1efvA:
0.0
3u9fS-1efvA:
0.0		 3u9fP-1efvA:
22.15
3u9fS-1efvA:
22.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1hdf SPHERULIN 3A

(Physarum
polycephalum) 		PF08964
(Crystall_3) 		5 THR A  56
LEU A  17
VAL A  47
PHE A  37
VAL A  30
 None
 1.34A 3u9fP-1hdfA:
0.0
3u9fS-1hdfA:
0.0		 3u9fP-1hdfA:
18.69
3u9fS-1hdfA:
18.69
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.
1hpl LIPASE

(Equus caballus) 		PF00151
(Lipase)
PF01477
(PLAT) 		5 PHE A 139
SER A  62
LEU A 131
VAL A 132
PHE A  72
 None
 1.33A 3u9fP-1hplA:
0.0
3u9fS-1hplA:
0.0		 3u9fP-1hplA:
19.29
3u9fS-1hplA:
19.29
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.
1jg3 PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Pyrococcus
furiosus) 		PF01135
(PCMT) 		5 SER A 102
LEU A  84
VAL A  39
PHE A  43
VAL A  80
 None
 1.34A 3u9fP-1jg3A:
0.5
3u9fS-1jg3A:
0.0		 3u9fP-1jg3A:
20.80
3u9fS-1jg3A:
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.
1kr1 HEVAMINE A

(Hevea
brasiliensis) 		PF00704
(Glyco_hydro_18) 		5 THR A 154
PHE A 175
LEU A 100
VAL A  96
PHE A  36
 None
 1.27A 3u9fP-1kr1A:
0.0
3u9fS-1kr1A:
0.0		 3u9fP-1kr1A:
18.51
3u9fS-1kr1A:
18.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1lnl HEMOCYANIN

(Rapana venosa) 		PF00264
(Tyrosinase)
PF14830
(Haemocyan_bet_s) 		5 PHE A 272
PHE A 219
TYR A 170
LEU A 247
VAL A  60
 None
 1.20A 3u9fP-1lnlA:
0.0
3u9fS-1lnlA:
0.0		 3u9fP-1lnlA:
19.21
3u9fS-1lnlA:
19.21
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1pd5 CHLORAMPHENICOL
ACETYLTRANSFERASE

(Escherichia
coli) 		PF00302
(CAT) 		9 THR A  93
PHE A 102
SER A 104
TYR A 133
SER A 146
LEU A 158
VAL A 160
PHE A 166
VAL A 170
 None
 0.53A 3u9fP-1pd5A:
34.4
3u9fS-1pd5A:
34.2		 3u9fP-1pd5A:
100.00
3u9fS-1pd5A:
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.
1pk6 COMPLEMENT C1Q
SUBCOMPONENT, A
CHAIN PRECURSOR

(Homo sapiens) 		PF00386
(C1q) 		5 SER A 145
LEU A 151
VAL A 195
PHE A 111
VAL A 143
 None
 1.01A 3u9fP-1pk6A:
undetectable
3u9fS-1pk6A:
undetectable		 3u9fP-1pk6A:
18.54
3u9fS-1pk6A:
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.
1pk8 RAT SYNAPSIN I

(Rattus
norvegicus) 		PF02078
(Synapsin)
PF02750
(Synapsin_C) 		5 SER A 390
SER A 212
LEU A 116
VAL A 143
VAL A 410
 None
 1.35A 3u9fP-1pk8A:
undetectable
3u9fS-1pk8A:
undetectable		 3u9fP-1pk8A:
19.66
3u9fS-1pk8A:
19.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pk8 RAT SYNAPSIN I

(Rattus
norvegicus) 		PF02078
(Synapsin)
PF02750
(Synapsin_C) 		5 SER A 390
SER A 212
VAL A 143
PHE A 130
VAL A 410
 None
 1.38A 3u9fP-1pk8A:
undetectable
3u9fS-1pk8A:
undetectable		 3u9fP-1pk8A:
19.66
3u9fS-1pk8A:
19.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1sxl SEX-LETHAL PROTEIN
PROTEIN

(Drosophila
melanogaster) 		PF00076
(RRM_1) 		5 SER A  84
LEU A  87
VAL A  60
PHE A  34
VAL A  78
 None
 1.43A 3u9fP-1sxlA:
undetectable
3u9fS-1sxlA:
undetectable		 3u9fP-1sxlA:
17.94
3u9fS-1sxlA:
17.94
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.
1y6n INTERLEUKIN-10
RECEPTOR ALPHA CHAIN

(Homo sapiens) 		PF01108
(Tissue_fac)
PF09294
(Interfer-bind) 		5 THR R  57
SER R  59
LEU R  62
VAL R  65
VAL R  38
 None
 1.44A 3u9fP-1y6nR:
undetectable
3u9fS-1y6nR:
undetectable		 3u9fP-1y6nR:
20.93
3u9fS-1y6nR:
20.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2a7n L(+)-MANDELATE
DEHYDROGENASE

(Pseudomonas
putida;
Spinacia
oleracea) 		PF01070
(FMN_dh) 		5 PHE A  44
SER A 265
LEU A 252
VAL A 281
VAL A 269
 None
 1.38A 3u9fP-2a7nA:
undetectable
3u9fS-2a7nA:
undetectable		 3u9fP-2a7nA:
19.52
3u9fS-2a7nA:
19.52
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.
2ag8 PYRROLINE-5-CARBOXYL
ATE REDUCTASE

(Neisseria
meningitidis) 		PF03807
(F420_oxidored)
PF14748
(P5CR_dimer) 		5 THR A 148
LEU A  19
VAL A   3
PHE A   5
VAL A  15
 None
 1.35A 3u9fP-2ag8A:
undetectable
3u9fS-2ag8A:
undetectable		 3u9fP-2ag8A:
18.98
3u9fS-2ag8A:
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.
2ap1 PUTATIVE REGULATOR
PROTEIN

(Salmonella
enterica) 		PF00480
(ROK) 		5 CYH A  44
TYR A  36
LEU A  96
VAL A  47
VAL A 100
 None
 1.34A 3u9fP-2ap1A:
undetectable
3u9fS-2ap1A:
undetectable		 3u9fP-2ap1A:
20.92
3u9fS-2ap1A:
20.92
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.
2bx6 XRP2 PROTEIN

(Homo sapiens) 		PF07986
(TBCC) 		5 CYH A 110
LEU A 125
VAL A 127
PHE A 117
VAL A 119
 None
 1.22A 3u9fP-2bx6A:
undetectable
3u9fS-2bx6A:
undetectable		 3u9fP-2bx6A:
18.52
3u9fS-2bx6A:
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.
2c1q BIOTIN BINDING
PROTEIN A

(Gallus gallus) 		PF01382
(Avidin) 		5 PHE A  80
PHE A 121
SER A  16
TYR A  33
VAL A 116
 BTN  A1126 ( 4.8A)
None
BTN  A1126 (-2.6A)
BTN  A1126 (-4.5A)
None
 1.37A 3u9fP-2c1qA:
undetectable
3u9fS-2c1qA:
undetectable		 3u9fP-2c1qA:
21.31
3u9fS-2c1qA:
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.
2d6l LECTIN, GALACTOSE
BINDING, SOLUBLE 9

(Mus musculus) 		PF00337
(Gal-bind_lectin) 		5 PHE X  17
LEU X  33
VAL X  46
PHE X  48
VAL X  31
 None
 1.11A 3u9fP-2d6lX:
undetectable
3u9fS-2d6lX:
undetectable		 3u9fP-2d6lX:
17.05
3u9fS-2d6lX:
17.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2f9r SPHINGOMYELINASE D 1

(Loxosceles
laeta) 		no annotation 5 THR A  74
PHE A  85
LEU A  90
VAL A  35
PHE A  63
 None
 1.20A 3u9fP-2f9rA:
undetectable
3u9fS-2f9rA:
undetectable		 3u9fP-2f9rA:
22.22
3u9fS-2f9rA:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fg5 RAS-RELATED PROTEIN
RAB-31

(Homo sapiens) 		PF00071
(Ras) 		5 SER A  41
LEU A  10
VAL A  82
PHE A 159
VAL A  22
 None
 1.38A 3u9fP-2fg5A:
undetectable
3u9fS-2fg5A:
undetectable		 3u9fP-2fg5A:
17.33
3u9fS-2fg5A:
17.33
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.
2fj0 CARBOXYLIC ESTER
HYDROLASE

(Manduca sexta) 		PF00135
(COesterase) 		5 PHE A 173
THR A 232
LEU A 140
VAL A 170
PHE A 479
 None
 1.29A 3u9fP-2fj0A:
undetectable
3u9fS-2fj0A:
undetectable		 3u9fP-2fj0A:
15.08
3u9fS-2fj0A:
15.08
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.
2ggz GUANYLYL
CYCLASE-ACTIVATING
PROTEIN 3

(Homo sapiens) 		PF13202
(EF-hand_5)
PF13499
(EF-hand_7) 		5 PHE A 174
THR A  62
PHE A  63
VAL A 168
PHE A 154
 None
 1.05A 3u9fP-2ggzA:
undetectable
3u9fS-2ggzA:
undetectable		 3u9fP-2ggzA:
21.22
3u9fS-2ggzA:
21.22
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.
2gs5 CONSERVED
HYPOTHETICAL PROTEIN

(Corynebacterium
diphtheriae) 		PF02622
(DUF179) 		5 THR A  94
LEU A  38
VAL A  50
PHE A 135
VAL A 165
 None
 1.23A 3u9fP-2gs5A:
undetectable
3u9fS-2gs5A:
undetectable		 3u9fP-2gs5A:
18.45
3u9fS-2gs5A:
18.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2lzj UBIQUITIN-LIKE
MODIFIER-ACTIVATING
ENZYME 1

(Mus musculus) 		PF16190
(E1_FCCH) 		5 CYH A 234
THR A 244
VAL A 221
PHE A 250
VAL A 248
 None
 1.25A 3u9fP-2lzjA:
undetectable
3u9fS-2lzjA:
undetectable		 3u9fP-2lzjA:
16.91
3u9fS-2lzjA:
16.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2odp COMPLEMENT C2

(Homo sapiens) 		PF00089
(Trypsin)
PF00092
(VWA) 		5 THR A 317
PHE A 278
SER A 242
LEU A 403
VAL A 398
 MG  A 901 (-2.6A)
None
MG  A 901 (-1.9A)
None
None
 1.32A 3u9fP-2odpA:
undetectable
3u9fS-2odpA:
undetectable		 3u9fP-2odpA:
18.11
3u9fS-2odpA:
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.
2ok8 PUTATIVE
FERREDOXIN--NADP
REDUCTASE

(Plasmodium
falciparum) 		PF00175
(NAD_binding_1) 		5 PHE A 160
THR A 178
LEU A 281
VAL A 311
VAL A 293
 None
 1.42A 3u9fP-2ok8A:
undetectable
3u9fS-2ok8A:
undetectable		 3u9fP-2ok8A:
20.38
3u9fS-2ok8A:
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.
2p9n ACTIN-RELATED
PROTEIN 2/3 COMPLEX
SUBUNIT 1B

(Bos taurus) 		PF00400
(WD40) 		5 HIS C 136
LEU C  93
VAL C 113
PHE C 111
VAL C  91
 None
 1.30A 3u9fP-2p9nC:
undetectable
3u9fS-2p9nC:
undetectable		 3u9fP-2p9nC:
21.68
3u9fS-2p9nC:
21.68
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.
2q5e CARBOXY-TERMINAL
DOMAIN RNA
POLYMERASE II
POLYPEPTIDE A SMALL
PHOSPHATASE 2

(Homo sapiens) 		PF03031
(NIF) 		5 THR A 163
PHE A 188
SER A 165
LEU A 177
VAL A 113
 None
 1.37A 3u9fP-2q5eA:
undetectable
3u9fS-2q5eA:
undetectable		 3u9fP-2q5eA:
21.65
3u9fS-2q5eA:
21.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yev CYTOCHROME C OXIDASE
SUBUNIT 2

(Thermus
thermophilus) 		PF00034
(Cytochrom_C)
PF00116
(COX2)
PF02790
(COX2_TM) 		5 THR B 273
SER B 274
VAL B 121
PHE B 164
VAL B 212
 None
 1.31A 3u9fP-2yevB:
undetectable
3u9fS-2yevB:
undetectable		 3u9fP-2yevB:
20.23
3u9fS-2yevB:
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.
2z1p COLLAGEN ADHESIN
PROTEIN

(Enterococcus
faecalis) 		PF05737
(Collagen_bind) 		5 PHE A  61
PHE A 115
LEU A  77
VAL A  42
VAL A 111
 None
 1.30A 3u9fP-2z1pA:
undetectable
3u9fS-2z1pA:
undetectable		 3u9fP-2z1pA:
19.77
3u9fS-2z1pA:
19.77
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.
2zbw THIOREDOXIN
REDUCTASE

(Thermus
thermophilus) 		PF07992
(Pyr_redox_2) 		5 THR A 210
PHE A 187
LEU A 156
VAL A 244
VAL A 228
 None
 1.39A 3u9fP-2zbwA:
undetectable
3u9fS-2zbwA:
undetectable		 3u9fP-2zbwA:
18.54
3u9fS-2zbwA:
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.
2zyg 6-PHOSPHOGLUCONATE
DEHYDROGENASE,
DECARBOXYLATING

(Klebsiella
pneumoniae) 		PF00393
(6PGD)
PF03446
(NAD_binding_2) 		5 THR A 218
LEU A 203
VAL A 418
PHE A 421
VAL A 321
 None
 1.43A 3u9fP-2zygA:
undetectable
3u9fS-2zygA:
undetectable		 3u9fP-2zygA:
16.77
3u9fS-2zygA:
16.77
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.
3a2q 6-AMINOHEXANOATE-CYC
LIC-DIMER HYDROLASE

(Arthrobacter
sp. KI72) 		PF01425
(Amidase) 		5 SER A 218
LEU A 225
VAL A 228
PHE A 112
VAL A 165
 None
 1.41A 3u9fP-3a2qA:
undetectable
3u9fS-3a2qA:
undetectable		 3u9fP-3a2qA:
17.65
3u9fS-3a2qA:
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.
3be7 ZN-DEPENDENT
ARGININE
CARBOXYPEPTIDASE

(unidentified) 		PF01979
(Amidohydro_1) 		5 THR A 349
SER A 345
SER A  61
VAL A 268
PHE A 319
 None
 1.38A 3u9fP-3be7A:
undetectable
3u9fS-3be7A:
undetectable		 3u9fP-3be7A:
19.02
3u9fS-3be7A:
19.02
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.
3cc8 PUTATIVE
METHYLTRANSFERASE

(Bacillus cereus) 		PF13489
(Methyltransf_23) 		5 PHE A 162
LEU A 105
VAL A 101
PHE A  98
VAL A 111
 None
 1.38A 3u9fP-3cc8A:
undetectable
3u9fS-3cc8A:
undetectable		 3u9fP-3cc8A:
19.17
3u9fS-3cc8A:
19.17
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.
3cmv PROTEIN RECA

(Escherichia
coli) 		PF00154
(RecA) 		5 THR A3042
SER A3041
SER A3044
LEU A3277
VAL A3323
 None
 1.32A 3u9fP-3cmvA:
undetectable
3u9fS-3cmvA:
undetectable		 3u9fP-3cmvA:
9.89
3u9fS-3cmvA:
9.89
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.
3e77 PHOSPHOSERINE
AMINOTRANSFERASE

(Homo sapiens) 		PF00266
(Aminotran_5) 		5 SER A 238
LEU A 255
VAL A 202
PHE A 181
VAL A  60
 None
 1.07A 3u9fP-3e77A:
undetectable
3u9fS-3e77A:
1.7		 3u9fP-3e77A:
18.26
3u9fS-3e77A:
18.26
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.
3g0i EPOXIDE HYDROLASE

(Aspergillus
niger) 		PF06441
(EHN) 		5 PHE A 244
CYH A 350
TYR A 251
LEU A 215
PHE A 196
 VPR  A   1 ( 4.7A)
VPR  A   1 ( 4.4A)
VPR  A   1 (-4.2A)
VPR  A   1 ( 4.4A)
VPR  A   1 (-4.3A)
 1.39A 3u9fP-3g0iA:
undetectable
3u9fS-3g0iA:
undetectable		 3u9fP-3g0iA:
19.89
3u9fS-3g0iA:
19.89
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.
3j9d OUTER CAPSID PROTEIN
VP2

(Bluetongue
virus) 		PF00898
(Orbi_VP2) 		5 CYH A 446
THR A 565
LEU A 765
PHE A 460
VAL A 773
 None
 1.32A 3u9fP-3j9dA:
undetectable
3u9fS-3j9dA:
undetectable		 3u9fP-3j9dA:
11.78
3u9fS-3j9dA:
11.78
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.
3k50 PUTATIVE S41
PROTEASE

(Bacteroides
fragilis) 		PF03572
(Peptidase_S41) 		5 PHE A 249
PHE A 238
LEU A 334
VAL A 340
VAL A 330
 None
 1.13A 3u9fP-3k50A:
undetectable
3u9fS-3k50A:
undetectable		 3u9fP-3k50A:
21.20
3u9fS-3k50A:
21.20
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.
3l6n METALLO-BETA-LACTAMA
SE

(Chryseobacterium
indologenes) 		PF00753
(Lactamase_B) 		5 PHE A  25
LEU A  64
VAL A  67
PHE A 108
VAL A  89
 None
 1.12A 3u9fP-3l6nA:
undetectable
3u9fS-3l6nA:
undetectable		 3u9fP-3l6nA:
20.43
3u9fS-3l6nA:
20.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lp8 PHOSPHORIBOSYLAMINE-
GLYCINE LIGASE

(Ehrlichia
chaffeensis) 		PF01071
(GARS_A)
PF02843
(GARS_C)
PF02844
(GARS_N) 		5 PHE A 288
THR A 311
PHE A  90
LEU A 300
VAL A 321
 None
 1.14A 3u9fP-3lp8A:
undetectable
3u9fS-3lp8A:
undetectable		 3u9fP-3lp8A:
17.42
3u9fS-3lp8A:
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.
3mc2 INHIBITOR OF
CARBONIC ANHYDRASE

(Mus musculus) 		PF00405
(Transferrin) 		5 THR A 375
SER A 592
LEU A 604
PHE A 633
VAL A 590
 None
 1.02A 3u9fP-3mc2A:
undetectable
3u9fS-3mc2A:
undetectable		 3u9fP-3mc2A:
14.91
3u9fS-3mc2A:
14.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nnk UREIDOGLYCINE-GLYOXY
LATE
AMINOTRANSFERASE

(Klebsiella
pneumoniae) 		PF00266
(Aminotran_5) 		5 CYH A 104
HIS A 101
THR A 151
SER A 150
VAL A 145
 None
None
None
None
LLP  A 200 ( 4.8A)
 1.37A 3u9fP-3nnkA:
undetectable
3u9fS-3nnkA:
undetectable		 3u9fP-3nnkA:
18.18
3u9fS-3nnkA:
18.18
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.
3o82 PEPTIDE ARYLATION
ENZYME

(Acinetobacter
baumannii) 		PF00501
(AMP-binding) 		5 PHE A 272
LEU A 310
VAL A 312
PHE A 317
VAL A 325
 None
 1.24A 3u9fP-3o82A:
undetectable
3u9fS-3o82A:
undetectable		 3u9fP-3o82A:
17.72
3u9fS-3o82A:
17.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3o8l 6-PHOSPHOFRUCTOKINAS
E, MUSCLE TYPE

(Oryctolagus
cuniculus) 		PF00365
(PFK) 		5 TYR A  55
LEU A 348
VAL A 335
PHE A 169
VAL A 352
 ATP  A 763 (-4.5A)
None
None
None
None
 1.10A 3u9fP-3o8lA:
undetectable
3u9fS-3o8lA:
undetectable		 3u9fP-3o8lA:
15.81
3u9fS-3o8lA:
15.81
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.
3p1i EPHRIN TYPE-B
RECEPTOR 3

(Homo sapiens) 		PF01404
(Ephrin_lbd) 		5 THR A  45
LEU A 132
VAL A 157
PHE A 181
VAL A 107
 None
 1.44A 3u9fP-3p1iA:
undetectable
3u9fS-3p1iA:
undetectable		 3u9fP-3p1iA:
17.94
3u9fS-3p1iA:
17.94
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.
3q1n GALACTOSE MUTAROTASE
RELATED ENZYME

(Lactobacillus
paracasei) 		PF01263
(Aldose_epim) 		5 PHE A  92
SER A  22
LEU A 121
VAL A 123
PHE A 141
 None
 1.25A 3u9fP-3q1nA:
undetectable
3u9fS-3q1nA:
undetectable		 3u9fP-3q1nA:
20.88
3u9fS-3q1nA:
20.88
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.
3qc0 SUGAR ISOMERASE

(Sinorhizobium
meliloti) 		PF01261
(AP_endonuc_2) 		5 SER A   7
LEU A  94
VAL A  41
PHE A  19
VAL A  53
 None
 1.38A 3u9fP-3qc0A:
undetectable
3u9fS-3qc0A:
undetectable		 3u9fP-3qc0A:
19.86
3u9fS-3qc0A:
19.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3r2j ALPHA/BETA-HYDROLASE
-LIKE PROTEIN

(Leishmania
infantum) 		PF00857
(Isochorismatase) 		5 THR A 183
LEU A 211
VAL A  21
PHE A  65
VAL A  59
 None
 1.18A 3u9fP-3r2jA:
undetectable
3u9fS-3r2jA:
undetectable		 3u9fP-3r2jA:
20.00
3u9fS-3r2jA:
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.
3rbl AROMATIC L-AMINO
ACID DECARBOXYLASE

(Homo sapiens) 		PF00282
(Pyridoxal_deC) 		5 CYH A 438
SER A 211
SER A 250
VAL A 445
VAL A 402
 None
 1.08A 3u9fP-3rblA:
undetectable
3u9fS-3rblA:
undetectable		 3u9fP-3rblA:
18.50
3u9fS-3rblA:
18.50
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.
3rmh YEAST CDC13 OB4

([Candida]
glabrata) 		no annotation 5 PHE A 685
CYH A 726
PHE A 696
LEU A 706
VAL A 655
 None
 1.24A 3u9fP-3rmhA:
undetectable
3u9fS-3rmhA:
undetectable		 3u9fP-3rmhA:
20.56
3u9fS-3rmhA:
20.56
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.
3sgg HYPOTHETICAL
HYDROLASE

(Bacteroides
thetaiotaomicron) 		PF14323
(GxGYxYP_C)
PF16216
(GxGYxYP_N) 		5 HIS A 323
LEU A 534
VAL A 540
PHE A 327
VAL A 530
 None
 1.39A 3u9fP-3sggA:
undetectable
3u9fS-3sggA:
undetectable		 3u9fP-3sggA:
18.24
3u9fS-3sggA:
18.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3stt METHYLKETONE
SYNTHASE I

(Solanum
habrochaites) 		PF12697
(Abhydrolase_6) 		5 HIS A 243
SER A 168
TYR A 165
SER A 241
LEU A 110
 DKA  A 266 (-3.8A)
None
None
None
None
 1.43A 3u9fP-3sttA:
undetectable
3u9fS-3sttA:
undetectable		 3u9fP-3sttA:
21.79
3u9fS-3sttA:
21.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4f92 U5 SMALL NUCLEAR
RIBONUCLEOPROTEIN
200 KDA HELICASE

(Homo sapiens) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF02889
(Sec63) 		5 THR B1194
LEU B1494
VAL B1500
PHE B1759
VAL B1724
 None
 1.44A 3u9fP-4f92B:
undetectable
3u9fS-4f92B:
undetectable		 3u9fP-4f92B:
9.26
3u9fS-4f92B:
9.26
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.
4gel MITOCHONDRIAL
CARDIOLIPIN
HYDROLASE

(Drosophila
melanogaster) 		PF13091
(PLDc_2) 		5 PHE A 114
SER A 122
LEU A 212
VAL A 205
VAL A  93
 None
 1.01A 3u9fP-4gelA:
undetectable
3u9fS-4gelA:
undetectable		 3u9fP-4gelA:
19.03
3u9fS-4gelA:
19.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hea NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT 14

(Thermus
thermophilus) 		PF00361
(Proton_antipo_M) 		5 SER N 262
TYR N 288
LEU N 299
VAL N 298
PHE N 326
 None
 1.33A 3u9fP-4heaN:
undetectable
3u9fS-4heaN:
undetectable		 3u9fP-4heaN:
16.36
3u9fS-4heaN:
16.36
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.
4hvm TLMII

(Streptoalloteichus
hindustanus) 		PF00668
(Condensation) 		5 PHE A  60
PHE A 162
TYR A 167
LEU A 121
VAL A 119
 None
 1.40A 3u9fP-4hvmA:
8.9
3u9fS-4hvmA:
8.7		 3u9fP-4hvmA:
17.49
3u9fS-4hvmA:
17.49
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.
4i6j F-BOX/LRR-REPEAT
PROTEIN 3

(Homo sapiens) 		PF12937
(F-box-like) 		5 PHE B 379
LEU B 324
VAL B 319
PHE B 315
VAL B 327
 None
 1.43A 3u9fP-4i6jB:
undetectable
3u9fS-4i6jB:
undetectable		 3u9fP-4i6jB:
19.62
3u9fS-4i6jB:
19.62
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.
4j2h SHORT CHAIN ALCOHOL
DEHYDROGENASE-RELATE
D DEHYDROGENASE

(Sinorhizobium
meliloti) 		PF13561
(adh_short_C2) 		5 HIS A 243
TYR A 150
LEU A 232
VAL A 142
VAL A 228
 EDO  A 304 ( 3.9A)
EDO  A 302 ( 4.2A)
None
None
None
 1.11A 3u9fP-4j2hA:
undetectable
3u9fS-4j2hA:
undetectable		 3u9fP-4j2hA:
23.36
3u9fS-4j2hA:
23.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mew SERINE/THREONINE-PRO
TEIN PHOSPHATASE 2A
REGULATORY SUBUNIT
B'' SUBUNIT BETA

(Homo sapiens) 		PF13499
(EF-hand_7) 		5 PHE A 237
PHE A 311
LEU A 286
VAL A 218
VAL A 273
 None
 1.06A 3u9fP-4mewA:
undetectable
3u9fS-4mewA:
undetectable		 3u9fP-4mewA:
20.11
3u9fS-4mewA:
20.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mfi SN-GLYCEROL-3-PHOSPH
ATE ABC TRANSPORTER
SUBSTRATE-BINDING
PROTEIN USPB

(Mycobacterium
tuberculosis) 		PF13416
(SBP_bac_8) 		5 THR A 343
SER A  49
LEU A 309
VAL A  97
PHE A 326
 None
 1.29A 3u9fP-4mfiA:
undetectable
3u9fS-4mfiA:
undetectable		 3u9fP-4mfiA:
18.92
3u9fS-4mfiA:
18.92
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.
4mj7 RRNA-PROCESSING
PROTEIN UTP23

(Saccharomyces
cerevisiae) 		PF04900
(Fcf1) 		5 PHE A  43
CYH A  38
THR A  52
LEU A  34
VAL A  35
 None
 1.10A 3u9fP-4mj7A:
undetectable
3u9fS-4mj7A:
undetectable		 3u9fP-4mj7A:
18.94
3u9fS-4mj7A:
18.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mj7 RRNA-PROCESSING
PROTEIN UTP23

(Saccharomyces
cerevisiae) 		PF04900
(Fcf1) 		5 PHE A  43
CYH A  38
THR A  52
VAL A  35
PHE A  84
 None
 1.13A 3u9fP-4mj7A:
undetectable
3u9fS-4mj7A:
undetectable		 3u9fP-4mj7A:
18.94
3u9fS-4mj7A:
18.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4o2w E3 UBIQUITIN-PROTEIN
LIGASE HERC1

(Homo sapiens) 		PF00415
(RCC1) 		5 PHE A4158
LEU A4155
VAL A4180
PHE A4211
VAL A4191
 None
 1.22A 3u9fP-4o2wA:
undetectable
3u9fS-4o2wA:
undetectable		 3u9fP-4o2wA:
17.04
3u9fS-4o2wA:
17.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4od7 THIOL:DISULFIDE
INTERCHANGE PROTEIN

(Proteus
mirabilis) 		PF01323
(DSBA) 		5 SER A 127
LEU A  81
VAL A 116
PHE A 111
VAL A  77
 None
 1.36A 3u9fP-4od7A:
undetectable
3u9fS-4od7A:
undetectable		 3u9fP-4od7A:
24.44
3u9fS-4od7A:
24.44
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.
4q73 PROLINE
DEHYDROGENASE

(Bradyrhizobium
diazoefficiens) 		PF00171
(Aldedh)
PF01619
(Pro_dh)
PF14850
(Pro_dh-DNA_bdg) 		5 PHE A 799
THR A 910
LEU A 916
VAL A 918
VAL A 933
 None
 1.34A 3u9fP-4q73A:
undetectable
3u9fS-4q73A:
undetectable		 3u9fP-4q73A:
11.97
3u9fS-4q73A:
11.97
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.
4q73 PROLINE
DEHYDROGENASE

(Bradyrhizobium
diazoefficiens) 		PF00171
(Aldedh)
PF01619
(Pro_dh)
PF14850
(Pro_dh-DNA_bdg) 		5 PHE A 799
THR A 910
LEU A 916
VAL A 918
VAL A 935
 None
 1.27A 3u9fP-4q73A:
undetectable
3u9fS-4q73A:
undetectable		 3u9fP-4q73A:
11.97
3u9fS-4q73A:
11.97
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.
4qhs FLAGELLAR REGULATORY
PROTEIN C

(Vibrio cholerae) 		PF00158
(Sigma54_activat) 		5 PHE A 284
LEU A 247
VAL A 246
PHE A 219
VAL A 267
 None
 1.09A 3u9fP-4qhsA:
undetectable
3u9fS-4qhsA:
undetectable		 3u9fP-4qhsA:
20.43
3u9fS-4qhsA:
20.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4u28 PHOSPHORIBOSYL
ISOMERASE A

(Streptomyces
sviceus) 		PF00977
(His_biosynth) 		5 THR A 170
SER A 200
LEU A  58
VAL A  22
VAL A  56
 None
PO4  A 301 ( 4.4A)
None
None
None
 1.34A 3u9fP-4u28A:
undetectable
3u9fS-4u28A:
undetectable		 3u9fP-4u28A:
19.84
3u9fS-4u28A:
19.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4v3d ENDOTHELIAL PROTEIN
C RECEPTOR

(Homo sapiens) 		PF16497
(MHC_I_3) 		5 PHE B  19
SER B  17
TYR B  27
PHE B 114
VAL B 116
 None
None
None
PTY  B 200 ( 4.9A)
PTY  B 200 (-4.9A)
 1.32A 3u9fP-4v3dB:
undetectable
3u9fS-4v3dB:
undetectable		 3u9fP-4v3dB:
21.62
3u9fS-4v3dB:
21.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4w8o LUCIFERASE-LIKE
ENZYMEAMP-COA-LIGASE

(Zophobas
atratus) 		PF00501
(AMP-binding) 		5 CYH A  74
SER A 134
LEU A 100
VAL A  98
PHE A 184
 None
 1.43A 3u9fP-4w8oA:
undetectable
3u9fS-4w8oA:
undetectable		 3u9fP-4w8oA:
20.70
3u9fS-4w8oA:
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.
4w91 AMINOTRANSFERASE

(Brucella suis) 		PF00266
(Aminotran_5) 		5 SER A  80
LEU A 298
VAL A 235
PHE A 230
VAL A  84
 None
None
LLP  A 234 ( 3.1A)
None
None
 1.17A 3u9fP-4w91A:
undetectable
3u9fS-4w91A:
undetectable		 3u9fP-4w91A:
18.98
3u9fS-4w91A:
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.
4wcj POLYSACCHARIDE
DEACETYLASE

(Ammonifex
degensii) 		PF01522
(Polysacc_deac_1) 		5 THR A 265
SER A 268
LEU A  33
VAL A 250
VAL A 272
 None
 1.40A 3u9fP-4wcjA:
undetectable
3u9fS-4wcjA:
undetectable		 3u9fP-4wcjA:
18.52
3u9fS-4wcjA:
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.
4x28 ACYL-COA
DEHYDROGENASE

(Mycobacterium
tuberculosis) 		no annotation 5 CYH D  24
HIS D  28
LEU D  43
VAL D  20
VAL D  85
 None
 1.45A 3u9fP-4x28D:
undetectable
3u9fS-4x28D:
undetectable		 3u9fP-4x28D:
18.57
3u9fS-4x28D:
18.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4x2r 1-(5-PHOSPHORIBOSYL)
-5-[(5-PHOSPHORIBOSY
LAMINO)METHYLIDENEAM
INO]
IMIDAZOLE-4-CARBOXAM
IDE ISOMERASE

(Actinomyces
urogenitalis) 		PF00977
(His_biosynth) 		5 THR A 164
SER A 194
LEU A  52
VAL A  16
VAL A  50
 None
PO4  A 303 ( 4.2A)
None
None
PO4  A 303 (-4.7A)
 1.31A 3u9fP-4x2rA:
undetectable
3u9fS-4x2rA:
undetectable		 3u9fP-4x2rA:
21.37
3u9fS-4x2rA:
21.37
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.
4z2a FURIN

(Homo sapiens) 		PF00082
(Peptidase_S8)
PF01483
(P_proprotein) 		5 THR A 367
SER A 293
SER A 370
LEU A 429
VAL A 397
 None
 1.39A 3u9fP-4z2aA:
undetectable
3u9fS-4z2aA:
undetectable		 3u9fP-4z2aA:
17.58
3u9fS-4z2aA:
17.58
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.
5dy1 TETR FAMILY
TRANSCRIPTIONAL
REGULATOR

(Corynebacterium
glutamicum) 		PF00440
(TetR_N) 		5 PHE A 160
THR A  79
SER A  78
LEU A 107
VAL A 166
 None
 1.42A 3u9fP-5dy1A:
undetectable
3u9fS-5dy1A:
undetectable		 3u9fP-5dy1A:
20.82
3u9fS-5dy1A:
20.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5elg GLUTATHIONE
S-TRANSFERASE DHAR1,
MITOCHONDRIAL

(Arabidopsis
thaliana) 		PF13410
(GST_C_2)
PF13417
(GST_N_3) 		5 HIS A 133
THR A  91
SER A 148
LEU A 130
VAL A 180
 None
 1.41A 3u9fP-5elgA:
undetectable
3u9fS-5elgA:
undetectable		 3u9fP-5elgA:
23.77
3u9fS-5elgA:
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.
5eur UNCHARACTERIZED
PROTEIN

(Shigella
flexneri) 		no annotation 5 THR A  43
SER A  42
LEU A   8
VAL A  21
PHE A  31
 None
 1.09A 3u9fP-5eurA:
undetectable
3u9fS-5eurA:
undetectable		 3u9fP-5eurA:
19.63
3u9fS-5eurA:
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.
5f3y UNCONVENTIONAL
MYOSIN-VIIB

(Mus musculus) 		PF00784
(MyTH4) 		5 CYH A1334
TYR A1286
LEU A1331
VAL A1335
VAL A1352
 None
 1.19A 3u9fP-5f3yA:
undetectable
3u9fS-5f3yA:
undetectable		 3u9fP-5f3yA:
15.00
3u9fS-5f3yA:
15.00
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.
5gtq LUCIFERIN
REGENERATING ENZYME

(Photinus
pyralis) 		PF08450
(SGL) 		5 THR A 122
LEU A  75
VAL A  54
PHE A  39
VAL A  73
 None
None
None
HG  A 402 (-4.2A)
None
 1.44A 3u9fP-5gtqA:
undetectable
3u9fS-5gtqA:
undetectable		 3u9fP-5gtqA:
21.00
3u9fS-5gtqA:
21.00
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.
5hdt SISTER CHROMATID
COHESION PROTEIN
PDS5 HOMOLOG B

(Homo sapiens) 		no annotation 5 PHE A  42
CYH A  83
LEU A  35
VAL A  80
PHE A  68
 None
 1.18A 3u9fP-5hdtA:
undetectable
3u9fS-5hdtA:
undetectable		 3u9fP-5hdtA:
11.48
3u9fS-5hdtA:
11.48
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.
5hkj COMPLEMENT C1Q
SUBCOMPONENT SUBUNIT
A,COMPLEMENT C1Q
SUBCOMPONENT SUBUNIT
C,COMPLEMENT C1Q
SUBCOMPONENT SUBUNIT
B

(Homo sapiens) 		PF00386
(C1q) 		5 SER A  58
LEU A  64
VAL A 108
PHE A  24
VAL A  56
 None
 1.02A 3u9fP-5hkjA:
undetectable
3u9fS-5hkjA:
undetectable		 3u9fP-5hkjA:
20.76
3u9fS-5hkjA:
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.
5hkj COMPLEMENT C1Q
SUBCOMPONENT SUBUNIT
A,COMPLEMENT C1Q
SUBCOMPONENT SUBUNIT
C,COMPLEMENT C1Q
SUBCOMPONENT SUBUNIT
B

(Homo sapiens) 		PF00386
(C1q) 		5 THR A 366
SER A 229
VAL A  97
PHE A 265
VAL A 194
 None
 1.24A 3u9fP-5hkjA:
undetectable
3u9fS-5hkjA:
undetectable		 3u9fP-5hkjA:
20.76
3u9fS-5hkjA:
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.
5ijg CYS/MET METABOLISM
PYRIDOXAL-PHOSPHATE-
DEPENDENT ENZYME

(Brucella
melitensis) 		PF01053
(Cys_Met_Meta_PP) 		5 PHE A 104
SER A 100
LEU A 234
PHE A 118
VAL A 260
 None
 1.40A 3u9fP-5ijgA:
undetectable
3u9fS-5ijgA:
undetectable		 3u9fP-5ijgA:
17.95
3u9fS-5ijgA:
17.95
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.
5k8c 3-DEOXY-ALPHA-D-MANN
O-OCTULOSONATE
8-OXIDASE

(Shewanella
oneidensis) 		PF00465
(Fe-ADH) 		5 PHE A 170
THR A 140
LEU A  40
VAL A 109
VAL A  65
 None
NAD  A 401 (-4.0A)
None
None
CL  A 406 ( 4.1A)
 1.39A 3u9fP-5k8cA:
undetectable
3u9fS-5k8cA:
undetectable		 3u9fP-5k8cA:
22.13
3u9fS-5k8cA:
22.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5o4m HCGC

(Methanococcus
maripaludis) 		PF06690
(DUF1188) 		5 CYH A 155
THR A 113
LEU A 131
VAL A 156
VAL A 109
 None
SAH  A 301 ( 4.1A)
None
None
None
 1.36A 3u9fP-5o4mA:
undetectable
3u9fS-5o4mA:
undetectable		 3u9fP-5o4mA:
22.26
3u9fS-5o4mA:
22.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5oom 39S RIBOSOMAL
PROTEIN L23,
MITOCHONDRIAL
39S RIBOSOMAL
PROTEIN L47,
MITOCHONDRIAL

(Homo sapiens;
Homo sapiens) 		PF00276
(Ribosomal_L23)
PF06984
(MRP-L47) 		5 PHE U 105
THR Y 114
PHE Y  68
LEU U  57
VAL U  65
 None
 1.07A 3u9fP-5oomU:
undetectable
3u9fS-5oomU:
undetectable		 3u9fP-5oomU:
20.35
3u9fS-5oomU:
20.35
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.
5ti1 FUMARYLACETOACETATE
HYDROLASE

(Paraburkholderia
xenovorans) 		PF01557
(FAA_hydrolase)
PF09298
(FAA_hydrolase_N) 		5 SER A  79
LEU A 104
VAL A  51
PHE A  36
VAL A 100
 None
 1.24A 3u9fP-5ti1A:
undetectable
3u9fS-5ti1A:
undetectable		 3u9fP-5ti1A:
18.45
3u9fS-5ti1A:
18.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5w21 KLOTHO

(Homo sapiens) 		no annotation 5 THR A  76
SER A 128
TYR A 172
SER A  71
VAL A 185
 None
 1.39A 3u9fP-5w21A:
undetectable
3u9fS-5w21A:
undetectable		 3u9fP-5w21A:
undetectable
3u9fS-5w21A:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6a91 -

(-) 		no annotation 5 SER A 870
LEU A 962
VAL A 965
PHE A1304
VAL A1308
 None
 1.36A 3u9fP-6a91A:
undetectable
3u9fS-6a91A:
undetectable		 3u9fP-6a91A:
undetectable
3u9fS-6a91A:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6c96 TWO PORE CALCIUM
CHANNEL PROTEIN 1

(Mus musculus) 		no annotation 5 PHE A 669
THR A 661
PHE A 590
SER A 662
VAL A 272
 None
 1.45A 3u9fP-6c96A:
undetectable
3u9fS-6c96A:
undetectable		 3u9fP-6c96A:
undetectable
3u9fS-6c96A:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6caj TRANSLATION
INITIATION FACTOR
EIF-2B SUBUNIT BETA

(Homo sapiens) 		no annotation 5 THR C 173
SER C 171
LEU C 245
VAL C 316
VAL C 267
 None
 1.33A 3u9fP-6cajC:
undetectable
3u9fS-6cajC:
undetectable		 3u9fP-6cajC:
undetectable
3u9fS-6cajC:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6cbl NEAMINE TRANSAMINASE
NEON

(Streptomyces
fradiae) 		no annotation 5 PHE A 316
PHE A  44
LEU A 329
VAL A 307
VAL A 367
 None
 1.34A 3u9fP-6cblA:
undetectable
3u9fS-6cblA:
undetectable		 3u9fP-6cblA:
undetectable
3u9fS-6cblA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6coy CHLORIDE CHANNEL
PROTEIN 1

(Homo sapiens) 		no annotation 5 THR A 539
SER A 537
TYR A 578
SER A 541
PHE A 279
 None
 1.36A 3u9fP-6coyA:
undetectable
3u9fS-6coyA:
undetectable		 3u9fP-6coyA:
undetectable
3u9fS-6coyA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6d95 -

(-) 		no annotation 5 PHE A 379
THR A 503
PHE A 499
SER A 500
VAL A 407
 None
 1.33A 3u9fP-6d95A:
undetectable
3u9fS-6d95A:
undetectable		 3u9fP-6d95A:
undetectable
3u9fS-6d95A:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6fpe TRNA N6-ADENOSINE
THREONYLCARBAMOYLTRA
NSFERASE

(Thermotoga
maritima) 		no annotation 5 THR B 138
PHE B 207
LEU B 271
VAL B 275
PHE B 288
 None
 1.29A 3u9fP-6fpeB:
undetectable
3u9fS-6fpeB:
undetectable		 3u9fP-6fpeB:
undetectable
3u9fS-6fpeB:
undetectable