SIMILAR PATTERNS OF AMINO ACIDS FOR 3U9F_N_CLMN221

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
 1.31A 3u9fN-1auxA:
0.0
3u9fO-1auxA:
0.0		 3u9fN-1auxA:
19.29
3u9fO-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 3u9fN-1auxA:
0.0
3u9fO-1auxA:
0.0		 3u9fN-1auxA:
19.29
3u9fO-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.
1cns CHITINASE

(Hordeum vulgare) 		PF00182
(Glyco_hydro_19) 		5 SER A  65
TYR A  84
VAL A   2
PHE A  44
PHE A  11
 None
 1.44A 3u9fN-1cnsA:
undetectable
3u9fO-1cnsA:
undetectable		 3u9fN-1cnsA:
19.92
3u9fO-1cnsA:
19.92
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.
1dxj CLASS II CHITINASE

(Canavalia
ensiformis) 		PF00182
(Glyco_hydro_19) 		5 SER A  66
TYR A  85
VAL A   3
PHE A  45
PHE A  12
 None
 1.49A 3u9fN-1dxjA:
undetectable
3u9fO-1dxjA:
undetectable		 3u9fN-1dxjA:
21.13
3u9fO-1dxjA:
21.13
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.
1fcp PROTEIN (FERRIC
HYDROXAMATE UPTAKE
RECEPTOR)

(Escherichia
coli) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		5 SER A  33
SER A  51
LEU A  70
VAL A  66
VAL A  53
 None
 1.41A 3u9fN-1fcpA:
0.0
3u9fO-1fcpA:
0.0		 3u9fN-1fcpA:
15.45
3u9fO-1fcpA:
15.45
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.
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
 1.39A 3u9fN-1hdfA:
undetectable
3u9fO-1hdfA:
0.0		 3u9fN-1hdfA:
18.69
3u9fO-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.
1hw2 FATTY ACID
METABOLISM REGULATOR
PROTEIN

(Escherichia
coli) 		PF00392
(GntR)
PF07840
(FadR_C) 		5 PHE A  25
SER A  19
LEU A  48
VAL A  43
VAL A  51
 None
 1.35A 3u9fN-1hw2A:
0.0
3u9fO-1hw2A:
0.0		 3u9fN-1hw2A:
21.79
3u9fO-1hw2A:
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.
1ioa ARCELIN-5A

(Phaseolus
vulgaris) 		PF00139
(Lectin_legB) 		5 PHE A 223
LEU A 190
VAL A 188
PHE A 133
VAL A 120
 None
 1.46A 3u9fN-1ioaA:
0.0
3u9fO-1ioaA:
0.0		 3u9fN-1ioaA:
19.70
3u9fO-1ioaA:
19.70
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.
1izc MACROPHOMATE
SYNTHASE
INTERMOLECULAR
DIELS-ALDERASE

(Macrophoma
commelinae) 		PF03328
(HpcH_HpaI) 		5 THR A 173
SER A 174
TYR A 141
SER A 162
PHE A 149
 None
 1.41A 3u9fN-1izcA:
0.0
3u9fO-1izcA:
0.0		 3u9fN-1izcA:
23.03
3u9fO-1izcA:
23.03
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.
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
 1.43A 3u9fN-1jg3A:
0.0
3u9fO-1jg3A:
0.0		 3u9fN-1jg3A:
20.80
3u9fO-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
 1.34A 3u9fN-1kr1A:
0.0
3u9fO-1kr1A:
0.0		 3u9fN-1kr1A:
18.51
3u9fO-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.
1kwg BETA-GALACTOSIDASE

(Thermus
thermophilus) 		PF02449
(Glyco_hydro_42)
PF08532
(Glyco_hydro_42M)
PF08533
(Glyco_hydro_42C) 		5 PHE A 252
LEU A 461
VAL A 464
PHE A 472
VAL A 458
 None
 1.35A 3u9fN-1kwgA:
0.0
3u9fO-1kwgA:
undetectable		 3u9fN-1kwgA:
15.04
3u9fO-1kwgA:
15.04
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.
1lnl HEMOCYANIN

(Rapana venosa) 		PF00264
(Tyrosinase)
PF14830
(Haemocyan_bet_s) 		5 PHE A 219
TYR A 170
LEU A 247
VAL A  60
PHE A 272
 None
 1.27A 3u9fN-1lnlA:
undetectable
3u9fO-1lnlA:
undetectable		 3u9fN-1lnlA:
19.21
3u9fO-1lnlA:
19.21
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.
1lxy ARGININE DEIMINASE

(Mycoplasma
arginini) 		PF02274
(Amidinotransf) 		5 THR A 200
LEU A  78
VAL A   3
VAL A 190
PHE A   8
 None
 1.47A 3u9fN-1lxyA:
undetectable
3u9fO-1lxyA:
undetectable		 3u9fN-1lxyA:
21.80
3u9fO-1lxyA:
21.80
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
 0.55A 3u9fN-1pd5A:
34.8
3u9fO-1pd5A:
34.2		 3u9fN-1pd5A:
100.00
3u9fO-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
 0.99A 3u9fN-1pk6A:
undetectable
3u9fO-1pk6A:
undetectable		 3u9fN-1pk6A:
18.54
3u9fO-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
 1.37A 3u9fN-1pk8A:
undetectable
3u9fO-1pk8A:
undetectable		 3u9fN-1pk8A:
19.66
3u9fO-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 3u9fN-1pk8A:
undetectable
3u9fO-1pk8A:
undetectable		 3u9fN-1pk8A:
19.66
3u9fO-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
 1.49A 3u9fN-1sxlA:
undetectable
3u9fO-1sxlA:
undetectable		 3u9fN-1sxlA:
17.94
3u9fO-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.
1wh0 UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE 19

(Homo sapiens) 		PF04969
(CS) 		5 PHE A  66
VAL A  48
PHE A  55
VAL A  34
PHE A  59
 None
 1.50A 3u9fN-1wh0A:
undetectable
3u9fO-1wh0A:
undetectable		 3u9fN-1wh0A:
21.08
3u9fO-1wh0A:
21.08
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.
1wmm HYPOTHETICAL UPF0310
PROTEIN PH1033

(Pyrococcus
horikoshii) 		PF01878
(EVE) 		5 THR A  67
SER A  68
LEU A  32
VAL A  24
VAL A  35
 None
 1.45A 3u9fN-1wmmA:
undetectable
3u9fO-1wmmA:
undetectable		 3u9fN-1wmmA:
19.72
3u9fO-1wmmA:
19.72
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.
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
 1.40A 3u9fN-2ag8A:
undetectable
3u9fO-2ag8A:
undetectable		 3u9fN-2ag8A:
18.98
3u9fO-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.
2d6l LECTIN, GALACTOSE
BINDING, SOLUBLE 9

(Mus musculus) 		PF00337
(Gal-bind_lectin) 		5 LEU X  33
VAL X  46
PHE X  48
VAL X  31
PHE X  17
 None
 1.13A 3u9fN-2d6lX:
undetectable
3u9fO-2d6lX:
undetectable		 3u9fN-2d6lX:
17.05
3u9fO-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.
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 3u9fN-2fg5A:
undetectable
3u9fO-2fg5A:
undetectable		 3u9fN-2fg5A:
17.33
3u9fO-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.
2ggz GUANYLYL
CYCLASE-ACTIVATING
PROTEIN 3

(Homo sapiens) 		PF13202
(EF-hand_5)
PF13499
(EF-hand_7) 		5 THR A  62
PHE A  63
VAL A 168
PHE A 154
PHE A 174
 None
 1.05A 3u9fN-2ggzA:
undetectable
3u9fO-2ggzA:
undetectable		 3u9fN-2ggzA:
21.22
3u9fO-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.
2gou OXIDOREDUCTASE,
FMN-BINDING

(Shewanella
oneidensis) 		PF00724
(Oxidored_FMN) 		5 THR A  26
PHE A 350
SER A  28
VAL A 145
VAL A 104
 PE4  A4124 ( 3.7A)
PE4  A4124 (-4.2A)
None
None
None
 1.47A 3u9fN-2gouA:
undetectable
3u9fO-2gouA:
undetectable		 3u9fN-2gouA:
19.09
3u9fO-2gouA:
19.09
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.
2h26 T-CELL SURFACE
GLYCOPROTEIN CD1B

(Homo sapiens) 		PF07654
(C1-set)
PF16497
(MHC_I_3) 		5 PHE A  77
LEU A 114
VAL A 126
VAL A 158
PHE A 144
 6UL  A 312 (-4.7A)
6UL  A 312 (-4.6A)
6PL  A 311 (-4.4A)
6PL  A 311 ( 4.4A)
6UL  A 312 (-4.4A)
 1.48A 3u9fN-2h26A:
undetectable
3u9fO-2h26A:
undetectable		 3u9fN-2h26A:
22.45
3u9fO-2h26A:
22.45
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.
2iop CHAPERONE PROTEIN
HTPG

(Escherichia
coli) 		PF00183
(HSP90)
PF02518
(HATPase_c) 		5 SER A 590
LEU A 519
VAL A 523
PHE A 568
VAL A 515
 None
 1.49A 3u9fN-2iopA:
undetectable
3u9fO-2iopA:
undetectable		 3u9fN-2iopA:
15.25
3u9fO-2iopA:
15.25
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.
2nya PERIPLASMIC NITRATE
REDUCTASE

(Escherichia
coli) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4) 		5 THR A 489
SER A 472
LEU A 485
VAL A  90
PHE A  88
 MGD  A3001 (-3.6A)
None
None
None
None
 1.39A 3u9fN-2nyaA:
undetectable
3u9fO-2nyaA:
undetectable		 3u9fN-2nyaA:
13.29
3u9fO-2nyaA:
13.29
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.
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
 1.37A 3u9fN-2odpA:
undetectable
3u9fO-2odpA:
undetectable		 3u9fN-2odpA:
18.11
3u9fO-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.
2p9n ACTIN-RELATED
PROTEIN 2/3 COMPLEX
SUBUNIT 1B

(Bos taurus) 		PF00400
(WD40) 		5 LEU C  93
VAL C 113
PHE C 111
VAL C  91
HIS C 136
 None
 1.26A 3u9fN-2p9nC:
undetectable
3u9fO-2p9nC:
undetectable		 3u9fN-2p9nC:
21.68
3u9fO-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.
2q1y CELL DIVISION
PROTEIN FTSZ

(Mycobacterium
tuberculosis) 		PF00091
(Tubulin)
PF12327
(FtsZ_C) 		5 THR A 306
SER A 260
LEU A  32
VAL A  35
VAL A 191
 None
 1.46A 3u9fN-2q1yA:
undetectable
3u9fO-2q1yA:
undetectable		 3u9fN-2q1yA:
18.92
3u9fO-2q1yA:
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.
2vq9 RNASE 1

(Danio rerio) 		PF00074
(RnaseA) 		5 SER A  78
VAL A  17
PHE A  12
VAL A 111
HIS A  57
 None
 1.39A 3u9fN-2vq9A:
undetectable
3u9fO-2vq9A:
undetectable		 3u9fN-2vq9A:
26.22
3u9fO-2vq9A:
26.22
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.
2vwb PUTATIVE
O-SIALOGLYCOPROTEIN
ENDOPEPTIDASE

(Methanocaldococcus
jannaschii) 		PF00814
(Peptidase_M22)
PF01163
(RIO1) 		5 THR A  96
LEU A   6
VAL A  15
VAL A  89
PHE A  60
 None
 1.46A 3u9fN-2vwbA:
undetectable
3u9fO-2vwbA:
undetectable		 3u9fN-2vwbA:
17.13
3u9fO-2vwbA:
17.13
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.
2xhy 6-PHOSPHO-BETA-GLUCO
SIDASE BGLA

(Escherichia
coli) 		PF00232
(Glyco_hydro_1) 		5 PHE A 444
TYR A 468
VAL A 129
PHE A 374
PHE A  85
 None
 1.46A 3u9fN-2xhyA:
undetectable
3u9fO-2xhyA:
undetectable		 3u9fN-2xhyA:
17.23
3u9fO-2xhyA:
17.23
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.
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
 1.39A 3u9fN-2yevB:
undetectable
3u9fO-2yevB:
undetectable		 3u9fN-2yevB:
20.23
3u9fO-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.
2yn9 POTASSIUM-TRANSPORTI
NG ATPASE ALPHA
CHAIN 1

(Sus scrofa) 		PF00122
(E1-E2_ATPase)
PF00689
(Cation_ATPase_C)
PF00690
(Cation_ATPase_N)
PF09040
(H-K_ATPase_N)
PF13246
(Cation_ATPase) 		5 THR A 426
PHE A 402
SER A 424
LEU A 473
PHE A 420
 None
 1.42A 3u9fN-2yn9A:
undetectable
3u9fO-2yn9A:
undetectable		 3u9fN-2yn9A:
11.98
3u9fO-2yn9A:
11.98
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.
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
 1.38A 3u9fN-2zbwA:
undetectable
3u9fO-2zbwA:
undetectable		 3u9fN-2zbwA:
18.54
3u9fO-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
 1.50A 3u9fN-2zygA:
undetectable
3u9fO-2zygA:
undetectable		 3u9fN-2zygA:
16.77
3u9fO-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.
2zzg ALANYL-TRNA
SYNTHETASE

(Pyrococcus
horikoshii) 		PF01411
(tRNA-synt_2c)
PF07973
(tRNA_SAD) 		5 LEU A 214
VAL A 167
VAL A 204
PHE A  70
HIS A 150
 None
 1.47A 3u9fN-2zzgA:
undetectable
3u9fO-2zzgA:
undetectable		 3u9fN-2zzgA:
14.25
3u9fO-2zzgA:
14.25
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.
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
 1.44A 3u9fN-3a2qA:
undetectable
3u9fO-3a2qA:
undetectable		 3u9fN-3a2qA:
17.65
3u9fO-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.
3ak5 HEMOGLOBIN-BINDING
PROTEASE HBP

(Escherichia
coli) 		PF02395
(Peptidase_S6) 		5 PHE A 304
LEU A 159
VAL A 132
PHE A 134
VAL A 163
 None
 1.48A 3u9fN-3ak5A:
undetectable
3u9fO-3ak5A:
undetectable		 3u9fN-3ak5A:
12.38
3u9fO-3ak5A:
12.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cc8 PUTATIVE
METHYLTRANSFERASE

(Bacillus cereus) 		PF13489
(Methyltransf_23) 		5 LEU A 105
VAL A 101
PHE A  98
VAL A 111
PHE A 162
 None
 1.29A 3u9fN-3cc8A:
undetectable
3u9fO-3cc8A:
undetectable		 3u9fN-3cc8A:
19.17
3u9fO-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
 1.42A 3u9fN-3cmvA:
undetectable
3u9fO-3cmvA:
undetectable		 3u9fN-3cmvA:
9.89
3u9fO-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.
3dqq PUTATIVE TRNA
SYNTHASE

(Salmonella
enterica) 		PF07005
(DUF1537)
PF17042
(DUF1357_C) 		5 THR A 318
SER A 317
VAL A 254
VAL A 267
PHE A 341
 None
 1.02A 3u9fN-3dqqA:
undetectable
3u9fO-3dqqA:
undetectable		 3u9fN-3dqqA:
19.33
3u9fO-3dqqA:
19.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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
 1.13A 3u9fN-3e77A:
undetectable
3u9fO-3e77A:
undetectable		 3u9fN-3e77A:
18.26
3u9fO-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.
3fgb UNCHARACTERIZED
PROTEIN Q89ZH8_BACTN

(Bacteroides
thetaiotaomicron) 		PF10282
(Lactonase) 		5 PHE A 164
LEU A 191
VAL A 206
PHE A 218
VAL A 135
 None
 1.45A 3u9fN-3fgbA:
undetectable
3u9fO-3fgbA:
undetectable		 3u9fN-3fgbA:
20.06
3u9fO-3fgbA:
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.
3gg9 D-3-PHOSPHOGLYCERATE
DEHYDROGENASE
OXIDOREDUCTASE
PROTEIN

(Ralstonia
solanacearum) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		5 THR A 259
SER A 260
LEU A 172
VAL A 195
VAL A 184
 None
GOL  A 364 (-3.6A)
None
None
None
 1.50A 3u9fN-3gg9A:
undetectable
3u9fO-3gg9A:
undetectable		 3u9fN-3gg9A:
20.88
3u9fO-3gg9A:
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.
3lp8 PHOSPHORIBOSYLAMINE-
GLYCINE LIGASE

(Ehrlichia
chaffeensis) 		PF01071
(GARS_A)
PF02843
(GARS_C)
PF02844
(GARS_N) 		5 THR A 311
PHE A  90
LEU A 300
VAL A 321
PHE A 288
 None
 1.04A 3u9fN-3lp8A:
undetectable
3u9fO-3lp8A:
undetectable		 3u9fN-3lp8A:
17.42
3u9fO-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
 1.05A 3u9fN-3mc2A:
undetectable
3u9fO-3mc2A:
undetectable		 3u9fN-3mc2A:
14.91
3u9fO-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.
3mvs CADHERIN-23

(Mus musculus) 		PF00028
(Cadherin) 		5 THR A  23
LEU A  17
VAL A  95
PHE A  82
PHE A  78
 None
 1.33A 3u9fN-3mvsA:
undetectable
3u9fO-3mvsA:
undetectable		 3u9fN-3mvsA:
21.65
3u9fO-3mvsA:
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.
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
 1.25A 3u9fN-3o82A:
undetectable
3u9fO-3o82A:
undetectable		 3u9fN-3o82A:
17.72
3u9fO-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
 1.02A 3u9fN-3o8lA:
undetectable
3u9fO-3o8lA:
undetectable		 3u9fN-3o8lA:
15.81
3u9fO-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
 1.45A 3u9fN-3p1iA:
undetectable
3u9fO-3p1iA:
undetectable		 3u9fN-3p1iA:
17.94
3u9fO-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.
3p3l CYTOCHROME P450

(Streptomyces
thioluteus) 		PF00067
(p450) 		5 THR A  20
PHE A  19
LEU A 179
VAL A  75
PHE A 316
 None
 1.46A 3u9fN-3p3lA:
undetectable
3u9fO-3p3lA:
undetectable		 3u9fN-3p3lA:
20.29
3u9fO-3p3lA:
20.29
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.
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 3u9fN-3r2jA:
undetectable
3u9fO-3r2jA:
undetectable		 3u9fN-3r2jA:
20.00
3u9fO-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.
3r4v PUTATIVE
UNCHARACTERIZED
PROTEIN

(Pseudomonas
phage 201phi2-1) 		PF00091
(Tubulin) 		5 SER A 228
TYR A 247
LEU A 178
VAL A 179
PHE A  83
 None
 1.15A 3u9fN-3r4vA:
undetectable
3u9fO-3r4vA:
undetectable		 3u9fN-3r4vA:
18.99
3u9fO-3r4vA:
18.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3sgg HYPOTHETICAL
HYDROLASE

(Bacteroides
thetaiotaomicron) 		PF14323
(GxGYxYP_C)
PF16216
(GxGYxYP_N) 		5 LEU A 534
VAL A 540
PHE A 327
VAL A 530
HIS A 323
 None
 1.33A 3u9fN-3sggA:
undetectable
3u9fO-3sggA:
undetectable		 3u9fN-3sggA:
18.24
3u9fO-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.
3vr1 PEPTIDE CHAIN
RELEASE FACTOR 3

(Desulfovibrio
vulgaris) 		PF00009
(GTP_EFTU)
PF03144
(GTP_EFTU_D2)
PF16658
(RF3_C) 		5 PHE A  76
LEU A  28
VAL A 111
VAL A 263
PHE A  15
 None
 1.45A 3u9fN-3vr1A:
undetectable
3u9fO-3vr1A:
undetectable		 3u9fN-3vr1A:
18.89
3u9fO-3vr1A:
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.
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
 1.45A 3u9fN-4f92B:
undetectable
3u9fO-4f92B:
undetectable		 3u9fN-4f92B:
9.26
3u9fO-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 SER A 122
LEU A 212
VAL A 205
VAL A  93
PHE A 114
 None
 1.16A 3u9fN-4gelA:
undetectable
3u9fO-4gelA:
undetectable		 3u9fN-4gelA:
19.03
3u9fO-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.
4igo OS05G0196500 PROTEIN

(Oryza sativa) 		PF02373
(JmjC)
PF02375
(JmjN) 		5 PHE A 164
SER A 352
LEU A 359
VAL A 495
PHE A 473
 None
 1.48A 3u9fN-4igoA:
undetectable
3u9fO-4igoA:
undetectable		 3u9fN-4igoA:
19.46
3u9fO-4igoA:
19.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4j2h SHORT CHAIN ALCOHOL
DEHYDROGENASE-RELATE
D DEHYDROGENASE

(Sinorhizobium
meliloti) 		PF13561
(adh_short_C2) 		5 TYR A 150
LEU A 232
VAL A 142
VAL A 228
HIS A 243
 EDO  A 302 ( 4.2A)
None
None
None
EDO  A 304 ( 3.9A)
 1.17A 3u9fN-4j2hA:
undetectable
3u9fO-4j2hA:
undetectable		 3u9fN-4j2hA:
23.36
3u9fO-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.
4mfi SN-GLYCEROL-3-PHOSPH
ATE ABC TRANSPORTER
SUBSTRATE-BINDING
PROTEIN USPB

(Mycobacterium
tuberculosis) 		PF13416
(SBP_bac_8) 		5 SER A  49
LEU A 309
VAL A  97
PHE A 326
VAL A 330
 None
 1.20A 3u9fN-4mfiA:
undetectable
3u9fO-4mfiA:
undetectable		 3u9fN-4mfiA:
18.92
3u9fO-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.
4nfn TAU-TUBULIN KINASE 1

(Homo sapiens) 		PF00069
(Pkinase) 		5 PHE A  93
LEU A  62
VAL A  64
PHE A 102
VAL A  30
 None
 1.35A 3u9fN-4nfnA:
undetectable
3u9fO-4nfnA:
undetectable		 3u9fN-4nfnA:
20.83
3u9fO-4nfnA:
20.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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
 1.37A 3u9fN-4od7A:
undetectable
3u9fO-4od7A:
undetectable		 3u9fN-4od7A:
24.44
3u9fO-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.
4opu CONSERVED ARCHAEAL
PROTEIN

(Sulfolobus
acidocaldarius) 		PF01266
(DAO) 		5 THR A 157
SER A 162
LEU A   9
VAL A 148
VAL A  34
 FDA  A 501 (-3.8A)
FDA  A 501 (-2.9A)
None
None
None
 1.20A 3u9fN-4opuA:
undetectable
3u9fO-4opuA:
undetectable		 3u9fN-4opuA:
17.65
3u9fO-4opuA:
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.
4q73 PROLINE
DEHYDROGENASE

(Bradyrhizobium
diazoefficiens) 		PF00171
(Aldedh)
PF01619
(Pro_dh)
PF14850
(Pro_dh-DNA_bdg) 		5 THR A 910
LEU A 916
VAL A 918
VAL A 933
PHE A 799
 None
 1.36A 3u9fN-4q73A:
undetectable
3u9fO-4q73A:
undetectable		 3u9fN-4q73A:
11.97
3u9fO-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
 1.05A 3u9fN-4qhsA:
undetectable
3u9fO-4qhsA:
undetectable		 3u9fN-4qhsA:
20.43
3u9fO-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.
4v0h METALLO-BETA-LACTAMA
SE DOMAIN-CONTAINING
PROTEIN 1 1

(Homo sapiens) 		PF00753
(Lactamase_B) 		5 THR A 169
SER A 179
LEU A 224
VAL A 240
PHE A 238
 None
 1.32A 3u9fN-4v0hA:
undetectable
3u9fO-4v0hA:
undetectable		 3u9fN-4v0hA:
20.63
3u9fO-4v0hA:
20.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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)
 1.35A 3u9fN-4v3dB:
undetectable
3u9fO-4v3dB:
undetectable		 3u9fN-4v3dB:
21.62
3u9fO-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.
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
 1.22A 3u9fN-4w91A:
undetectable
3u9fO-4w91A:
undetectable		 3u9fN-4w91A:
18.98
3u9fO-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.
4xcv NADP-DEPENDENT
2-HYDROXYACID
DEHYDROGENASE

(Rhizobium etli) 		PF02826
(2-Hacid_dh_C) 		5 LEU A  51
VAL A   9
PHE A  26
VAL A 296
PHE A  13
 None
 1.36A 3u9fN-4xcvA:
undetectable
3u9fO-4xcvA:
undetectable		 3u9fN-4xcvA:
21.17
3u9fO-4xcvA:
21.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xf5 TWIN-ARGININE
TRANSLOCATION
PATHWAY SIGNAL

(Chromohalobacter
salexigens) 		PF03480
(DctP) 		5 PHE A 179
TYR A 113
LEU A  46
VAL A 224
VAL A  50
 2A1  A 403 (-4.5A)
None
2A1  A 403 (-4.9A)
None
None
 1.49A 3u9fN-4xf5A:
undetectable
3u9fO-4xf5A:
undetectable		 3u9fN-4xf5A:
19.51
3u9fO-4xf5A:
19.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4y9w ASPARTIC ACID
ENDOPEPTIDASE SAPP2

(Candida
parapsilosis) 		PF00026
(Asp) 		5 SER A 217
LEU A 304
VAL A 309
PHE A 311
PHE A 261
 None
 1.21A 3u9fN-4y9wA:
undetectable
3u9fO-4y9wA:
undetectable		 3u9fN-4y9wA:
18.97
3u9fO-4y9wA:
18.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5d7z LACTOYLGLUTATHIONE
LYASE

(Zea mays) 		PF00903
(Glyoxalase) 		5 THR A 231
TYR A 198
SER A 237
PHE A 171
VAL A 241
 None
 1.47A 3u9fN-5d7zA:
undetectable
3u9fO-5d7zA:
undetectable		 3u9fN-5d7zA:
21.07
3u9fO-5d7zA:
21.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dkx ALPHA
GLUCOSIDASE-LIKE
PROTEIN

(Chaetomium
thermophilum) 		PF01055
(Glyco_hydro_31)
PF13802
(Gal_mutarotas_2)
PF17137
(DUF5110) 		5 THR A 341
SER A 371
LEU A 376
VAL A 110
PHE A 196
 None
 1.49A 3u9fN-5dkxA:
undetectable
3u9fO-5dkxA:
undetectable		 3u9fN-5dkxA:
12.87
3u9fO-5dkxA:
12.87
Potential target for repurposing, i.e. matched protein structure has less than 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 THR A  79
SER A  78
LEU A 107
VAL A 166
PHE A 160
 None
 1.49A 3u9fN-5dy1A:
undetectable
3u9fO-5dy1A:
undetectable		 3u9fN-5dy1A:
20.82
3u9fO-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.
5eur UNCHARACTERIZED
PROTEIN

(Shigella
flexneri) 		no annotation 5 THR A  43
SER A  42
LEU A   8
VAL A  21
PHE A  31
 None
 1.05A 3u9fN-5eurA:
undetectable
3u9fO-5eurA:
undetectable		 3u9fN-5eurA:
19.63
3u9fO-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.
5grs STEROL REGULATORY
ELEMENT-BINDING
PROTEIN
CLEAVAGE-ACTIVATING
PROTEIN

(Schizosaccharomyces
pombe) 		no annotation 5 PHE A 854
LEU A 880
PHE A 847
VAL A 849
PHE A 802
 None
 1.44A 3u9fN-5grsA:
undetectable
3u9fO-5grsA:
undetectable		 3u9fN-5grsA:
19.44
3u9fO-5grsA:
19.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5gt5 PECTATE LYASE

(Paenibacillus
sp. 0602) 		no annotation 5 PHE A 193
SER A 191
LEU A 156
VAL A 119
VAL A 186
 None
 1.37A 3u9fN-5gt5A:
undetectable
3u9fO-5gt5A:
undetectable		 3u9fN-5gt5A:
17.56
3u9fO-5gt5A:
17.56
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.
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
 0.99A 3u9fN-5hkjA:
undetectable
3u9fO-5hkjA:
undetectable		 3u9fN-5hkjA:
20.76
3u9fO-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.
5iai SUGAR ABC
TRANSPORTER

(Agrobacterium
tumefaciens) 		PF01547
(SBP_bac_1) 		5 THR A  97
PHE A 151
SER A  44
VAL A  70
PHE A 348
 None
 1.41A 3u9fN-5iaiA:
undetectable
3u9fO-5iaiA:
undetectable		 3u9fN-5iaiA:
19.29
3u9fO-5iaiA:
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.
5ijg CYS/MET METABOLISM
PYRIDOXAL-PHOSPHATE-
DEPENDENT ENZYME

(Brucella
melitensis) 		PF01053
(Cys_Met_Meta_PP) 		5 SER A 100
LEU A 234
PHE A 118
VAL A 260
PHE A 104
 None
 1.37A 3u9fN-5ijgA:
undetectable
3u9fO-5ijgA:
undetectable		 3u9fN-5ijgA:
17.95
3u9fO-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.
5jjq AMP-DEPENDENT
SYNTHETASE AND
LIGASE

(Streptomyces
sp. ML694-90F3) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		5 THR A  77
PHE A 213
SER A  78
LEU A  49
VAL A  33
 None
 1.45A 3u9fN-5jjqA:
undetectable
3u9fO-5jjqA:
undetectable		 3u9fN-5jjqA:
16.51
3u9fO-5jjqA:
16.51
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.
5lfd ALLANTOIN RACEMASE

(Pseudomonas
fluorescens) 		no annotation 5 THR A 102
PHE A 105
SER A 101
LEU A 212
VAL A  93
 None
 1.39A 3u9fN-5lfdA:
undetectable
3u9fO-5lfdA:
undetectable		 3u9fN-5lfdA:
18.82
3u9fO-5lfdA:
18.82
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.
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
 1.18A 3u9fN-5ti1A:
undetectable
3u9fO-5ti1A:
undetectable		 3u9fN-5ti1A:
18.45
3u9fO-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.
5w3f TUBULIN ALPHA-1
CHAIN

(Saccharomyces
cerevisiae) 		PF00091
(Tubulin)
PF03953
(Tubulin_C) 		5 PHE A 256
SER A 166
LEU A 137
PHE A  53
VAL A   4
 None
 1.29A 3u9fN-5w3fA:
undetectable
3u9fO-5w3fA:
undetectable		 3u9fN-5w3fA:
19.09
3u9fO-5w3fA:
19.09
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.
5woz REGULATOR OF TY1
TRANSPOSITION
PROTEIN 103

(Saccharomyces
cerevisiae) 		no annotation 5 SER A   1
LEU A  25
VAL A  63
PHE A  79
VAL A  35
 None
 1.48A 3u9fN-5wozA:
undetectable
3u9fO-5wozA:
undetectable		 3u9fN-5wozA:
undetectable
3u9fO-5wozA:
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.
5y4g AMBP3

(Fischerella
ambigua) 		no annotation 5 PHE A  31
VAL A 278
PHE A 245
VAL A  14
PHE A  43
 None
 1.43A 3u9fN-5y4gA:
undetectable
3u9fO-5y4gA:
undetectable		 3u9fN-5y4gA:
undetectable
3u9fO-5y4gA:
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
 1.43A 3u9fN-6a91A:
undetectable
3u9fO-6a91A:
undetectable		 3u9fN-6a91A:
undetectable
3u9fO-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.
6bp2 ENVELOPE
GLYCOPROTEIN
MR191 FAB HEAVY
CHAIN

(Marburg
marburgvirus;
Homo sapiens) 		no annotation
no annotation 		5 THR A 152
SER A 151
TYR A 146
VAL A  97
PHE H 106
 None
 1.45A 3u9fN-6bp2A:
undetectable
3u9fO-6bp2A:
undetectable		 3u9fN-6bp2A:
undetectable
3u9fO-6bp2A:
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
 1.35A 3u9fN-6coyA:
undetectable
3u9fO-6coyA:
undetectable		 3u9fN-6coyA:
undetectable
3u9fO-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.
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 3u9fN-6fpeB:
undetectable
3u9fO-6fpeB:
undetectable		 3u9fN-6fpeB:
undetectable
3u9fO-6fpeB:
undetectable