SIMILAR PATTERNS OF AMINO ACIDS FOR 1BU5_B_RBFB302

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
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ag9 FLAVODOXIN

(Escherichia
coli) 		PF00258
(Flavodoxin_1) 		6 THR A  12
ASN A  14
THR A  56
GLY A  89
ASP A  90
TYR A  94
 FMN  A 177 (-3.5A)
FMN  A 177 (-3.9A)
FMN  A 177 (-3.9A)
FMN  A 177 (-3.2A)
None
FMN  A 177 (-3.4A)
 0.48A 1bu5B-1ag9A:
20.2		 1bu5B-1ag9A:
34.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ag9 FLAVODOXIN

(Escherichia
coli) 		PF00258
(Flavodoxin_1) 		5 THR A  56
TRP A  57
GLY A  89
ASP A  90
TYR A  94
 FMN  A 177 (-3.9A)
FMN  A 177 (-3.7A)
FMN  A 177 (-3.2A)
None
FMN  A 177 (-3.4A)
 0.63A 1bu5B-1ag9A:
20.2		 1bu5B-1ag9A:
34.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1akw FLAVODOXIN

(Desulfovibrio
vulgaris) 		PF00258
(Flavodoxin_1) 		4 THR A  12
ASN A  14
ASP A  62
GLY A  94
 FMN  A 149 (-3.1A)
FMN  A 149 (-3.8A)
None
FMN  A 149 (-3.2A)
 0.82A 1bu5B-1akwA:
30.8		 1bu5B-1akwA:
99.32
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1akw FLAVODOXIN

(Desulfovibrio
vulgaris) 		PF00258
(Flavodoxin_1) 		7 THR A  12
ASN A  14
THR A  59
TRP A  60
GLY A  94
ASP A  95
TYR A  98
 FMN  A 149 (-3.1A)
FMN  A 149 (-3.8A)
FMN  A 149 (-3.9A)
FMN  A 149 (-4.6A)
FMN  A 149 (-3.2A)
None
FMN  A 149 (-3.5A)
 0.29A 1bu5B-1akwA:
30.8		 1bu5B-1akwA:
99.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1cbk PROTEIN
(7,8-DIHYDRO-6-HYDRO
XYMETHYLPTERIN-PYROP
HOSPHOKINASE)

(Haemophilus
influenzae) 		PF01288
(HPPK) 		4 ASN A  11
ASP A 117
GLY A   9
ASP A  95
 None
None
ROI  A 601 ( 3.8A)
ROI  A 601 (-4.6A)
 0.90A 1bu5B-1cbkA:
undetectable		 1bu5B-1cbkA:
19.51
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1czk FLAVODOXIN

(Synechococcus
elongatus) 		PF00258
(Flavodoxin_1) 		5 THR A  11
THR A  56
GLY A  89
ASP A  90
TYR A  94
 FMN  A 170 (-3.5A)
FMN  A 170 (-3.8A)
FMN  A 170 (-3.4A)
None
FMN  A 170 (-3.4A)
 0.47A 1bu5B-1czkA:
20.6		 1bu5B-1czkA:
32.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1czk FLAVODOXIN

(Synechococcus
elongatus) 		PF00258
(Flavodoxin_1) 		5 THR A  56
TRP A  57
GLY A  89
ASP A  90
TYR A  94
 FMN  A 170 (-3.8A)
FMN  A 170 (-3.9A)
FMN  A 170 (-3.4A)
None
FMN  A 170 (-3.4A)
 0.62A 1bu5B-1czkA:
20.6		 1bu5B-1czkA:
32.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ftg APOFLAVODOXIN

(Nostoc sp. PCC
7119) 		PF00258
(Flavodoxin_1) 		4 THR A  12
GLY A  89
ASP A  90
TYR A  94
 SO4  A 700 (-3.7A)
None
None
None
 0.73A 1bu5B-1ftgA:
20.2		 1bu5B-1ftgA:
31.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ftg APOFLAVODOXIN

(Nostoc sp. PCC
7119) 		PF00258
(Flavodoxin_1) 		4 THR A  12
THR A  56
GLY A  89
ASP A  90
 SO4  A 700 (-3.7A)
None
None
None
 0.48A 1bu5B-1ftgA:
20.2		 1bu5B-1ftgA:
31.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1fue FLAVODOXIN

(Helicobacter
pylori) 		PF00258
(Flavodoxin_1) 		5 ASN A  14
THR A  54
GLY A  87
ASP A  88
TYR A  92
 FMN  A 165 (-3.6A)
FMN  A 165 (-4.0A)
FMN  A 165 (-3.3A)
None
FMN  A 165 (-3.4A)
 0.61A 1bu5B-1fueA:
18.8		 1bu5B-1fueA:
30.00
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.
1g3r CELL DIVISION
INHIBITOR

(Pyrococcus
furiosus) 		PF13614
(AAA_31) 		5 THR A  18
ASN A  22
ASP A 179
GLY A 222
ASP A 200
 ACP  A 238 (-3.7A)
None
None
None
None
 1.05A 1bu5B-1g3rA:
5.3		 1bu5B-1g3rA:
22.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1gt9 KUMAMOLYSIN

(Bacillus
subtilis) 		PF00082
(Peptidase_S8) 		4 THR 1 217
ASN 1 322
THR 1 206
GLY 1 320
 None
 1.02A 1bu5B-1gt91:
undetectable		 1bu5B-1gt91:
17.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ion PROBABLE CELL
DIVISION INHIBITOR
MIND

(Pyrococcus
horikoshii) 		PF13614
(AAA_31) 		5 THR A  18
ASN A  22
ASP A 179
GLY A 222
ASP A 200
 ADP  A 301 (-3.6A)
None
None
None
None
 1.16A 1bu5B-1ionA:
4.8		 1bu5B-1ionA:
20.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1k1d D-HYDANTOINASE

(Geobacillus
stearothermophilus) 		PF01979
(Amidohydro_1) 		4 ASN A 186
THR A 211
ASP A 200
ASP A 191
 None
 0.99A 1bu5B-1k1dA:
undetectable		 1bu5B-1k1dA:
16.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1k7h ALKALINE PHOSPHATASE

(Pandalus
borealis) 		PF00245
(Alk_phosphatase) 		4 THR A  43
THR A 354
GLY A  36
ASP A  37
 None
None
None
ZN  A 478 ( 2.1A)
 1.02A 1bu5B-1k7hA:
undetectable		 1bu5B-1k7hA:
15.20
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.
1ofm CHONDROITINASE B

(Pedobacter
heparinus) 		PF14592
(Chondroitinas_B) 		4 ASN A 178
THR A 182
GLY A 221
TYR A 223
 None
 0.77A 1bu5B-1ofmA:
undetectable		 1bu5B-1ofmA:
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.
1t1e KUMAMOLISIN

(Bacillus sp.
MN-32) 		PF00082
(Peptidase_S8)
PF09286
(Pro-kuma_activ) 		4 THR A 406
ASN A 511
THR A 395
GLY A 509
 None
 1.00A 1bu5B-1t1eA:
undetectable		 1bu5B-1t1eA:
16.43
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.
1tll NITRIC-OXIDE
SYNTHASE, BRAIN

(Rattus
norvegicus) 		PF00175
(NAD_binding_1)
PF00258
(Flavodoxin_1)
PF00667
(FAD_binding_1) 		4 THR A 763
THR A 808
GLY A 885
TYR A 889
 FMN  A1451 (-3.1A)
FMN  A1451 (-4.0A)
FMN  A1451 (-3.1A)
FMN  A1451 (-3.7A)
 0.64A 1bu5B-1tllA:
18.2		 1bu5B-1tllA:
12.84
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.
1xf1 C5A PEPTIDASE

(Streptococcus
pyogenes) 		PF00082
(Peptidase_S8)
PF02225
(PA)
PF06280
(fn3_5)
PF13585
(CHU_C) 		4 THR A 763
ASP A 803
GLY A1017
TYR A 960
 None
 0.90A 1bu5B-1xf1A:
undetectable		 1bu5B-1xf1A:
10.42
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.
1ykg SULFITE REDUCTASE
[NADPH] FLAVOPROTEIN
ALPHA-COMPONENT

(Escherichia
coli) 		PF00258
(Flavodoxin_1) 		4 THR A  71
ASN A  73
THR A 117
TYR A 157
 FMN  A 300 (-3.2A)
FMN  A 300 (-3.2A)
FMN  A 300 (-4.0A)
FMN  A 300 (-3.4A)
 0.53A 1bu5B-1ykgA:
20.4		 1bu5B-1ykgA:
29.94
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.
1ykg SULFITE REDUCTASE
[NADPH] FLAVOPROTEIN
ALPHA-COMPONENT

(Escherichia
coli) 		PF00258
(Flavodoxin_1) 		5 THR A  71
THR A 117
GLY A 153
ASP A 154
TYR A 157
 FMN  A 300 (-3.2A)
FMN  A 300 (-4.0A)
FMN  A 300 (-2.5A)
FMN  A 300 (-4.9A)
FMN  A 300 (-3.4A)
 0.78A 1bu5B-1ykgA:
20.4		 1bu5B-1ykgA:
29.94
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.
1yob FLAVODOXIN 2

(Azotobacter
vinelandii) 		PF00258
(Flavodoxin_1) 		5 THR A  11
THR A  56
GLY A  97
ASP A  98
TYR A 102
 FMN  A1200 (-3.5A)
FMN  A1200 (-3.7A)
FMN  A1200 (-3.3A)
None
FMN  A1200 (-3.4A)
 0.49A 1bu5B-1yobA:
18.0		 1bu5B-1yobA:
28.49
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.
1za4 THROMBOSPONDIN 1

(Homo sapiens) 		PF02210
(Laminin_G_2) 		4 THR A 109
THR A  82
GLY A  84
ASP A 188
 None
 1.02A 1bu5B-1za4A:
undetectable		 1bu5B-1za4A:
22.92
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.
1zcc GLYCEROPHOSPHODIESTE
R PHOSPHODIESTERASE

(Agrobacterium
fabrum) 		PF03009
(GDPD) 		4 ASN A  17
THR A  57
TRP A  79
ASP A  50
 None
 0.98A 1bu5B-1zccA:
undetectable		 1bu5B-1zccA:
25.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zef ALKALINE PHOSPHATASE

(Homo sapiens) 		PF00245
(Alk_phosphatase) 		4 THR A  48
THR A 355
GLY A  41
ASP A  42
 None
None
None
ZN  A 902 ( 2.1A)
 1.02A 1bu5B-1zefA:
undetectable		 1bu5B-1zefA:
14.83
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.
2bf4 NADPH-CYTOCHROME
P450 REDUCTASE

(Saccharomyces
cerevisiae) 		PF00175
(NAD_binding_1)
PF00258
(Flavodoxin_1)
PF00667
(FAD_binding_1) 		4 THR A  71
THR A 117
GLY A 153
TYR A 157
 FMN  A 751 (-3.5A)
FMN  A 751 (-3.9A)
FMN  A 751 (-3.2A)
FMN  A 751 (-3.5A)
 0.76A 1bu5B-2bf4A:
18.1		 1bu5B-2bf4A:
13.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2dxb THIOCYANATE
HYDROLASE SUBUNIT
GAMMA

(Thiobacillus
thioparus) 		PF02979
(NHase_alpha) 		4 THR C 185
ASN C 112
ASP C 118
GLY C  85
 None
 0.70A 1bu5B-2dxbC:
undetectable		 1bu5B-2dxbC:
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.
2es3 THROMBOSPONDIN-1

(Homo sapiens) 		PF02210
(Laminin_G_2) 		4 THR A 109
THR A  82
GLY A  84
ASP A 188
 None
 1.00A 1bu5B-2es3A:
undetectable		 1bu5B-2es3A:
21.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2fcr FLAVODOXIN

(Chondrus
crispus) 		PF00258
(Flavodoxin_1) 		6 THR A  10
ASN A  12
THR A  55
GLY A  93
ASP A  94
TYR A  98
 FMN  A 174 (-3.6A)
FMN  A 174 (-3.5A)
FMN  A 174 (-3.8A)
FMN  A 174 (-3.1A)
None
FMN  A 174 (-3.4A)
 0.52A 1bu5B-2fcrA:
19.4		 1bu5B-2fcrA:
31.28
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2fcr FLAVODOXIN

(Chondrus
crispus) 		PF00258
(Flavodoxin_1) 		5 THR A  55
TRP A  56
GLY A  93
ASP A  94
TYR A  98
 FMN  A 174 (-3.8A)
FMN  A 174 (-3.9A)
FMN  A 174 (-3.1A)
None
FMN  A 174 (-3.4A)
 0.78A 1bu5B-2fcrA:
19.4		 1bu5B-2fcrA:
31.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ivd PROTOPORPHYRINOGEN
OXIDASE

(Myxococcus
xanthus) 		PF01593
(Amino_oxidase) 		4 THR A 181
THR A 166
GLY A 171
ASP A 172
 None
 0.76A 1bu5B-2ivdA:
5.8		 1bu5B-2ivdA:
16.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2kq8 CELL WALL HYDROLASE

(Bacillus
thuringiensis) 		PF08239
(SH3_3) 		4 THR A  20
ASN A  21
TRP A  43
GLY A  53
 None
 0.91A 1bu5B-2kq8A:
undetectable		 1bu5B-2kq8A:
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.
2mt9 FLAVODOXIN-2

(Escherichia
coli) 		PF00258
(Flavodoxin_1) 		4 THR A  55
GLY A  88
ASP A  89
TYR A  93
 FMN  A 201 (-3.9A)
FMN  A 201 (-3.1A)
None
FMN  A 201 (-3.5A)
 0.70A 1bu5B-2mt9A:
20.4		 1bu5B-2mt9A:
27.43
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.
2r4j AEROBIC
GLYCEROL-3-PHOSPHATE
DEHYDROGENASE

(Escherichia
coli) 		PF01266
(DAO)
PF16901
(DAO_C) 		4 THR A 206
THR A 173
GLY A 217
ASP A 216
 FAD  A 600 (-4.0A)
None
None
None
 0.78A 1bu5B-2r4jA:
undetectable		 1bu5B-2r4jA:
15.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wc1 FLAVODOXIN

(Rhodobacter
capsulatus) 		PF00258
(Flavodoxin_1) 		4 THR A  12
ASP A  60
ASP A  99
TYR A 103
 FMN  A 183 (-3.6A)
None
None
FMN  A 183 (-3.4A)
 0.93A 1bu5B-2wc1A:
17.8		 1bu5B-2wc1A:
26.18
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.
2wc1 FLAVODOXIN

(Rhodobacter
capsulatus) 		PF00258
(Flavodoxin_1) 		4 THR A  12
THR A  57
ASP A  99
TYR A 103
 FMN  A 183 (-3.6A)
FMN  A 183 (-3.7A)
None
FMN  A 183 (-3.4A)
 0.48A 1bu5B-2wc1A:
17.8		 1bu5B-2wc1A:
26.18
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.
2wc1 FLAVODOXIN

(Rhodobacter
capsulatus) 		PF00258
(Flavodoxin_1) 		4 THR A  14
THR A  57
ASP A  99
TYR A 103
 FMN  A 183 (-3.3A)
FMN  A 183 (-3.7A)
None
FMN  A 183 (-3.4A)
 0.81A 1bu5B-2wc1A:
17.8		 1bu5B-2wc1A:
26.18
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.
2wc1 FLAVODOXIN

(Rhodobacter
capsulatus) 		PF00258
(Flavodoxin_1) 		4 THR A  57
GLY A  98
ASP A  99
TYR A 103
 FMN  A 183 (-3.7A)
FMN  A 183 (-3.2A)
None
FMN  A 183 (-3.4A)
 0.41A 1bu5B-2wc1A:
17.8		 1bu5B-2wc1A:
26.18
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.
2wed PENICILLOPEPSIN

(Penicillium
janthinellum) 		PF00026
(Asp) 		4 THR A 131
ASN A 130
ASP A  77
GLY A 123
 None
None
PP6  A 327 (-3.5A)
None
 0.98A 1bu5B-2wedA:
undetectable		 1bu5B-2wedA:
18.15
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.
2yfs LEVANSUCRASE

(Lactobacillus
johnsonii) 		PF02435
(Glyco_hydro_68) 		4 THR A 555
ASN A 556
ASP A 471
ASP A 549
 None
 1.03A 1bu5B-2yfsA:
undetectable		 1bu5B-2yfsA:
14.31
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.
2yyo SPRY
DOMAIN-CONTAINING
PROTEIN 3

(Homo sapiens) 		PF00622
(SPRY) 		4 THR A 126
ASP A 105
GLY A 133
TYR A  80
 None
 1.03A 1bu5B-2yyoA:
undetectable		 1bu5B-2yyoA:
25.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2z2x TK-SUBTILISIN

(Thermococcus
kodakarensis) 		PF00082
(Peptidase_S8) 		4 THR A 323
ASN A 264
ASP A 379
GLY A 266
 MIS  A 324 ( 3.9A)
MIS  A 324 ( 3.0A)
CA  A1001 (-3.5A)
None
 0.99A 1bu5B-2z2xA:
2.1		 1bu5B-2z2xA:
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.
2z2z TK-SUBTILISIN
PRECURSOR

(Thermococcus
kodakarensis) 		PF00082
(Peptidase_S8) 		4 THR A 323
ASN A 264
ASP A 379
GLY A 266
 None
None
CA  A1006 (-3.0A)
None
 0.95A 1bu5B-2z2zA:
2.2		 1bu5B-2z2zA:
17.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cgh SUSD HOMOLOG

(Bacteroides
thetaiotaomicron) 		PF12741
(SusD-like) 		4 THR A 295
THR A  66
ASP A  97
GLY A  71
 None
 1.02A 1bu5B-3cghA:
undetectable		 1bu5B-3cghA:
15.32
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3f6r FLAVODOXIN

(Desulfovibrio
desulfuricans) 		PF00258
(Flavodoxin_1) 		6 THR A  12
ASN A  14
TRP A  60
GLY A  94
ASP A  95
TYR A  98
 FMN  A 149 (-3.1A)
FMN  A 149 (-3.9A)
FMN  A 149 (-4.0A)
FMN  A 149 (-2.9A)
None
FMN  A 149 (-3.5A)
 0.31A 1bu5B-3f6rA:
28.2		 1bu5B-3f6rA:
45.95
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.
3fjo NADPH-CYTOCHROME
P450 REDUCTASE

(Homo sapiens;
Saccharomyces
cerevisiae) 		PF00175
(NAD_binding_1)
PF00258
(Flavodoxin_1)
PF00667
(FAD_binding_1) 		4 THR A  71
THR A 117
GLY A 153
TYR A 157
 FMN  A 751 (-3.6A)
FMN  A 751 (-3.9A)
FMN  A 751 (-3.2A)
FMN  A 751 (-3.7A)
 0.73A 1bu5B-3fjoA:
17.9		 1bu5B-3fjoA:
13.84
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.
3gcw PROPROTEIN
CONVERTASE
SUBTILISIN/KEXIN
TYPE 9

(Homo sapiens) 		PF00082
(Peptidase_S8) 		4 ASN A 354
THR A 339
ASP A 367
GLY A 337
 None
 0.77A 1bu5B-3gcwA:
3.0		 1bu5B-3gcwA:
15.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3h5c PROTEIN Z-DEPENDENT
PROTEASE INHIBITOR

(Homo sapiens) 		PF00079
(Serpin) 		4 ASN A 134
THR A 140
ASP A 213
GLY A 138
 None
 1.02A 1bu5B-3h5cA:
undetectable		 1bu5B-3h5cA:
15.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hr4 NITRIC OXIDE
SYNTHASE, INDUCIBLE

(Homo sapiens) 		PF00258
(Flavodoxin_1) 		4 THR A 547
THR A 592
GLY A 627
TYR A 631
 FMN  A 999 (-3.3A)
FMN  A 999 (-3.9A)
FMN  A 999 (-3.1A)
FMN  A 999 (-3.5A)
 0.56A 1bu5B-3hr4A:
19.0		 1bu5B-3hr4A:
28.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3k11 PUTATIVE GLYCOSYL
HYDROLASE

(Bacteroides
thetaiotaomicron) 		PF07470
(Glyco_hydro_88) 		4 THR A 117
GLY A 119
ASP A 120
TYR A 123
 None
 1.02A 1bu5B-3k11A:
undetectable		 1bu5B-3k11A:
18.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3kaq FLAVODOXIN

(Desulfovibrio
desulfuricans) 		PF00258
(Flavodoxin_1) 		6 THR A  12
ASN A  14
TRP A  60
GLY A  94
ASP A  95
TYR A  98
 FMN  A 150 (-3.1A)
FMN  A 150 (-4.0A)
FMN  A 150 (-4.5A)
FMN  A 150 (-3.3A)
None
FMN  A 150 (-3.5A)
 0.48A 1bu5B-3kaqA:
28.3		 1bu5B-3kaqA:
47.62
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.
3m6m RPFF PROTEIN

(Xanthomonas
campestris) 		PF00378
(ECH_1) 		4 ASN A  83
ASP A 105
GLY A  86
ASP A  87
 None
None
EDO  A 902 (-3.9A)
None
 0.90A 1bu5B-3m6mA:
undetectable		 1bu5B-3m6mA:
19.37
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.
3nfv ALGINATE LYASE

(Bacteroides
ovatus) 		PF05426
(Alginate_lyase) 		4 ASP A  54
GLY A 137
ASP A 138
TYR A 141
 None
 0.63A 1bu5B-3nfvA:
undetectable		 1bu5B-3nfvA:
18.23
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.
3prx COBRA VENOM FACTOR

(Naja kaouthia) 		PF00207
(A2M)
PF01759
(NTR)
PF01821
(ANATO)
PF01835
(A2M_N)
PF07677
(A2M_recep)
PF07678
(A2M_comp)
PF07703
(A2M_N_2)
PF10569
(Thiol-ester_cl) 		4 THR B 543
THR B 511
GLY B 457
ASP B 458
 None
 0.99A 1bu5B-3prxB:
undetectable		 1bu5B-3prxB:
7.17
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.
3qvq PHOSPHODIESTERASE
OLEI02445

(Oleispira
antarctica) 		PF03009
(GDPD) 		4 ASN A  24
THR A  64
TRP A  86
ASP A  57
 None
 1.01A 1bu5B-3qvqA:
undetectable		 1bu5B-3qvqA:
22.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3r1j ALPHA-KETOGLUTARATE-
DEPENDENT TAURINE
DIOXYGENASE

(Mycobacterium
avium) 		PF02668
(TauD) 		4 THR A 228
THR A 100
GLY A 202
ASP A 203
 None
 0.89A 1bu5B-3r1jA:
undetectable		 1bu5B-3r1jA:
19.87
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.
3swt TAURINE CATABOLISM
DIOXYGENASE, TAUD

(Mycobacterium
marinum) 		PF02668
(TauD) 		4 THR A 230
THR A  99
GLY A 204
ASP A 205
 None
 0.92A 1bu5B-3swtA:
undetectable		 1bu5B-3swtA:
19.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wlx LOW SPECIFICITY
L-THREONINE ALDOLASE

(Escherichia
coli) 		no annotation 4 ASN B 137
ASP B 254
GLY B 141
ASP B 274
 None
 0.78A 1bu5B-3wlxB:
undetectable		 1bu5B-3wlxB:
18.58
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.
3wrt BETA-LACTAMASE

(Chromohalobacter
sp. 560) 		PF00144
(Beta-lactamase) 		4 ASN A 297
THR A 267
GLY A 264
ASP A 265
 None
 0.91A 1bu5B-3wrtA:
undetectable		 1bu5B-3wrtA:
21.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3x1j PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE

(Pseudomonas
aeruginosa) 		PF01467
(CTP_transf_like) 		4 THR A  14
GLY A  18
ASP A  19
TYR A 123
 ACO  A 201 ( 4.6A)
DMS  A 208 (-3.5A)
None
DMS  A 208 (-4.1A)
 1.01A 1bu5B-3x1jA:
2.8		 1bu5B-3x1jA:
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.
3zyx AMINE OXIDASE
[FLAVIN-CONTAINING]
B

(Homo sapiens) 		PF01593
(Amino_oxidase) 		4 THR A 201
THR A 327
GLY A 313
ASP A 329
 None
 0.72A 1bu5B-3zyxA:
2.6		 1bu5B-3zyxA:
14.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4amc GLUCANSUCRASE

(Lactobacillus
reuteri) 		PF01473
(CW_binding_1)
PF02324
(Glyco_hydro_70) 		4 THR A 834
TRP A 835
ASP A 837
GLY A 832
 None
 1.00A 1bu5B-4amcA:
undetectable		 1bu5B-4amcA:
9.33
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.
4cp6 CHOLINE BINDING
PROTEIN PCPA

(Streptococcus
pneumoniae) 		PF13306
(LRR_5) 		4 THR A  38
THR A  90
GLY A  92
ASP A  93
 None
 0.82A 1bu5B-4cp6A:
2.0		 1bu5B-4cp6A:
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.
4cvy DIOXYGENASE
RV3406/MT3514

(Mycobacterium
tuberculosis) 		PF02668
(TauD) 		4 THR A 226
THR A  98
GLY A 200
ASP A 201
 None
 0.89A 1bu5B-4cvyA:
undetectable		 1bu5B-4cvyA:
19.11
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.
4f88 PLYCA

(Streptococcus
virus C1) 		PF05257
(CHAP) 		4 ASN 1 228
ASP 1 284
GLY 1 362
ASP 1 363
 None
 0.79A 1bu5B-4f881:
undetectable		 1bu5B-4f881:
17.82
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.
4h2d NADPH-DEPENDENT
DIFLAVIN
OXIDOREDUCTASE 1

(Homo sapiens) 		PF00258
(Flavodoxin_1) 		5 THR A  14
THR A  60
GLY A  98
ASP A  99
TYR A 102
 FMN  A 200 (-3.5A)
FMN  A 200 (-3.9A)
FMN  A 200 (-3.3A)
None
FMN  A 200 (-3.5A)
 0.78A 1bu5B-4h2dA:
19.0		 1bu5B-4h2dA:
29.11
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.
4h2d NADPH-DEPENDENT
DIFLAVIN
OXIDOREDUCTASE 1

(Homo sapiens) 		PF00258
(Flavodoxin_1) 		5 THR A  16
THR A  60
GLY A  98
ASP A  99
TYR A 102
 FMN  A 200 (-3.5A)
FMN  A 200 (-3.9A)
FMN  A 200 (-3.3A)
None
FMN  A 200 (-3.5A)
 0.73A 1bu5B-4h2dA:
19.0		 1bu5B-4h2dA:
29.11
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4heq FLAVODOXIN

(Desulfovibrio
gigas) 		PF00258
(Flavodoxin_1) 		7 ASN A  14
THR A  59
TRP A  60
ASP A  62
GLY A  94
ASP A  95
TYR A  98
 FMN  A 201 (-3.8A)
FMN  A 201 (-3.9A)
FMN  A 201 (-3.9A)
None
FMN  A 201 (-3.3A)
None
FMN  A 201 (-3.5A)
 0.85A 1bu5B-4heqA:
29.4		 1bu5B-4heqA:
57.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4heq FLAVODOXIN

(Desulfovibrio
gigas) 		PF00258
(Flavodoxin_1) 		7 THR A  12
ASN A  14
THR A  59
TRP A  60
GLY A  94
ASP A  95
TYR A  98
 FMN  A 201 (-3.2A)
FMN  A 201 (-3.8A)
FMN  A 201 (-3.9A)
FMN  A 201 (-3.9A)
FMN  A 201 (-3.3A)
None
FMN  A 201 (-3.5A)
 0.64A 1bu5B-4heqA:
29.4		 1bu5B-4heqA:
57.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4heq FLAVODOXIN

(Desulfovibrio
gigas) 		PF00258
(Flavodoxin_1) 		4 THR A  59
ASP A  63
GLY A  94
TYR A  98
 FMN  A 201 (-3.9A)
None
FMN  A 201 (-3.3A)
FMN  A 201 (-3.5A)
 0.71A 1bu5B-4heqA:
29.4		 1bu5B-4heqA:
57.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4id7 ACTIVATED CDC42
KINASE 1

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		4 THR A 205
ASP A 134
GLY A 269
ASP A 270
 1G0  A 401 (-3.2A)
None
None
None
 0.88A 1bu5B-4id7A:
undetectable		 1bu5B-4id7A:
21.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ii0 CRATABL

(Crateva tapia) 		PF00197
(Kunitz_legume) 		4 THR A  54
ASN A  70
THR A  73
ASP A  76
 None
None
CSX  A  74 ( 3.6A)
None
 0.99A 1bu5B-4ii0A:
undetectable		 1bu5B-4ii0A:
22.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ij2 IRON-REGULATED
SURFACE DETERMINANT
PROTEIN H

(Staphylococcus
aureus) 		PF05031
(NEAT) 		4 ASN E 613
THR E 588
ASP E 566
ASP E 590
 None
 1.03A 1bu5B-4ij2E:
undetectable		 1bu5B-4ij2E:
17.79
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.
4kqn D-HYDANTOINASE

(Bacillus sp.
AR9) 		PF01979
(Amidohydro_1) 		4 THR A  16
ASN A 362
ASP A 397
TYR A 350
 THR  A  16 ( 0.8A)
ASN  A 362 ( 0.6A)
ASP  A 397 ( 0.6A)
TYR  A 350 ( 1.3A)
 1.03A 1bu5B-4kqnA:
undetectable		 1bu5B-4kqnA:
16.81
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.
4opf NRPS/PKS

(Streptomyces
albus) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		4 THR A6374
THR A6515
GLY A6513
ASP A6512
 None
 0.90A 1bu5B-4opfA:
undetectable		 1bu5B-4opfA:
17.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4oxx CINDOXIN

(Citrobacter
braakii) 		PF00258
(Flavodoxin_1) 		6 THR A  11
ASN A  13
THR A  58
GLY A  93
ASP A  94
TYR A  97
 FMN  A 200 (-3.4A)
FMN  A 200 (-3.5A)
FMN  A 200 (-3.8A)
FMN  A 200 (-3.1A)
None
FMN  A 200 (-3.5A)
 0.85A 1bu5B-4oxxA:
20.7		 1bu5B-4oxxA:
33.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4r1d UNCHARACTERIZED
PROTEIN

(Pseudomonas
aeruginosa) 		no annotation 4 THR A 477
GLY A 465
ASP A 461
TYR A 467
 None
 0.92A 1bu5B-4r1dA:
3.5		 1bu5B-4r1dA:
14.94
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.
4yry DIHYDROOROTATE
DEHYDROGENASE B
(NAD(+)), ELECTRON
TRANSFER SUBUNIT
HOMOLOG
DIHYDROPYRIMIDINE
DEHYDROGENASE
SUBUNIT A

(Thermotoga
maritima) 		PF00175
(NAD_binding_1)
PF00970
(FAD_binding_6)
PF07992
(Pyr_redox_2)
PF10418
(DHODB_Fe-S_bind)
PF14691
(Fer4_20) 		4 THR B 259
THR B 237
ASP B 433
GLY A 223
 None
None
FAD  B 503 (-2.8A)
FES  A 501 (-3.4A)
 1.01A 1bu5B-4yryB:
4.0		 1bu5B-4yryB:
17.36
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.
4zoq INTRACELLULAR SERINE
PROTEASE

(Bacillus
licheniformis) 		PF00082
(Peptidase_S8) 		4 THR I 375
ASN I 275
ASP I 423
GLY I 277
 None
 0.98A 1bu5B-4zoqI:
2.5		 1bu5B-4zoqI:
17.34
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5b3k UNCHARACTERIZED
PROTEIN PA3435

(Pseudomonas
aeruginosa) 		PF00258
(Flavodoxin_1) 		4 THR A  13
THR A  57
GLY A  92
ASP A  93
 SO4  A 201 (-3.9A)
None
None
None
 0.73A 1bu5B-5b3kA:
20.0		 1bu5B-5b3kA:
31.45
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.
5fvn OMPC PORIN

(Enterobacter
cloacae) 		PF00267
(Porin_1) 		4 THR A 162
ASN A 164
THR A 167
ASP A 205
 None
 0.91A 1bu5B-5fvnA:
undetectable		 1bu5B-5fvnA:
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.
5fwm HEAT SHOCK PROTEIN
HSP 90 BETA

(Homo sapiens) 		PF00183
(HSP90)
PF02518
(HATPase_c) 		4 ASN A 150
THR A 179
ASP A  74
GLY A  92
 None
ATP  A1691 (-4.4A)
None
ATP  A1691 ( 4.4A)
 0.98A 1bu5B-5fwmA:
undetectable		 1bu5B-5fwmA:
12.48
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.
5jfc NADH-DEPENDENT
FERREDOXIN:NADP
OXIDOREDUCTASE
SUBUNIT ALPHA
NADH-DEPENDENT
FERREDOXIN:NADP
OXIDOREDUCTASE
SUBUNIT BETA

(Pyrococcus
furiosus) 		PF07992
(Pyr_redox_2)
PF10418
(DHODB_Fe-S_bind)
PF14691
(Fer4_20) 		4 THR L 273
THR L 251
ASP L 444
GLY S 226
 None
None
FAD  L 503 (-2.7A)
FES  S 501 (-3.5A)
 0.91A 1bu5B-5jfcL:
4.3		 1bu5B-5jfcL:
16.06
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5lji FLAVODOXIN

(Streptococcus
pneumoniae) 		PF00258
(Flavodoxin_1) 		6 THR A  12
ASN A  14
THR A  58
GLY A  91
ASP A  92
TYR A  95
 FMN  A 201 (-3.3A)
FMN  A 201 (-3.7A)
FMN  A 201 (-3.6A)
FMN  A 201 (-3.3A)
None
FMN  A 201 (-3.5A)
 0.55A 1bu5B-5ljiA:
23.8		 1bu5B-5ljiA:
32.48
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.
5nd1 CAPSID PROTEIN

(Rosellinia
necatrix
quadrivirus 1) 		no annotation 4 THR B 514
THR B 629
GLY B 646
ASP B 644
 None
 0.91A 1bu5B-5nd1B:
undetectable		 1bu5B-5nd1B:
18.62
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.
5ndf POLYPEPTIDE
N-ACETYLGALACTOSAMIN
YLTRANSFERASE 2

(Homo sapiens) 		no annotation 4 THR A 459
ASN A 479
ASP A 444
GLY A 477
 None
 1.00A 1bu5B-5ndfA:
undetectable		 1bu5B-5ndfA:
14.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ojs TRANSCRIPTION-ASSOCI
ATED PROTEIN 1

(Saccharomyces
cerevisiae) 		PF00454
(PI3_PI4_kinase)
PF02259
(FAT) 		4 THR T3647
ASN T3644
GLY T3639
TYR T2676
 None
 0.79A 1bu5B-5ojsT:
undetectable		 1bu5B-5ojsT:
3.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5olc GALACTONATE
DEHYDRATASE

(Zobellia
galactanivorans) 		no annotation 4 THR A 333
THR A 297
GLY A 299
TYR A  49
 None
 0.88A 1bu5B-5olcA:
undetectable		 1bu5B-5olcA:
18.42
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.
5opj RHAMNOGALACTURONAN
LYASE

(Bacteroides
thetaiotaomicron) 		no annotation 4 ASP A 193
GLY A 233
ASP A 234
TYR A 237
 None
 1.03A 1bu5B-5opjA:
undetectable		 1bu5B-5opjA:
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.
5p60 ENDOTHIAPEPSIN

(Cryphonectria
parasitica) 		PF00026
(Asp) 		4 THR A 135
ASN A 134
ASP A  81
GLY A 127
 None
 1.02A 1bu5B-5p60A:
undetectable		 1bu5B-5p60A:
20.45
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.
5v57 SMOOTHENED
HOMOLOG,FLAVODOXIN,S
MOOTHENED HOMOLOG

(Desulfovibrio
vulgaris;
Homo sapiens) 		PF00258
(Flavodoxin_1)
PF01392
(Fz)
PF01534
(Frizzled) 		6 THR A1012
ASN A1014
THR A1059
TRP A1060
GLY A1094
ASP A1095
 FMN  A1202 (-3.5A)
FMN  A1202 (-3.8A)
FMN  A1202 (-3.9A)
FMN  A1202 (-4.2A)
FMN  A1202 (-3.3A)
None
 0.42A 1bu5B-5v57A:
31.0		 1bu5B-5v57A:
27.92
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.
5v57 SMOOTHENED
HOMOLOG,FLAVODOXIN,S
MOOTHENED HOMOLOG

(Desulfovibrio
vulgaris;
Homo sapiens) 		PF00258
(Flavodoxin_1)
PF01392
(Fz)
PF01534
(Frizzled) 		4 THR A1012
THR A1059
TRP A1060
ASP A1062
 FMN  A1202 (-3.5A)
FMN  A1202 (-3.9A)
FMN  A1202 (-4.2A)
None
 0.67A 1bu5B-5v57A:
31.0		 1bu5B-5v57A:
27.92
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.
5veg FLAVODOXIN

(Lactobacillus
reuteri) 		no annotation 6 THR A  12
ASN A  14
THR A  58
GLY A  91
ASP A  92
TYR A  95
 FMN  A 201 (-3.6A)
FMN  A 201 (-3.8A)
FMN  A 201 (-3.8A)
FMN  A 201 (-3.4A)
None
FMN  A 201 (-3.4A)
 0.42A 1bu5B-5vegA:
22.5		 1bu5B-5vegA:
25.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5xra CANNABINOID RECEPTOR
1,FLAVODOXIN,CANNABI
NOID RECEPTOR 1

(Desulfovibrio
vulgaris;
Homo sapiens) 		PF00001
(7tm_1)
PF00258
(Flavodoxin_1) 		5 THR A1012
ASN A1014
THR A1059
GLY A1094
ASP A1095
 FMN  A 601 ( 3.2A)
FMN  A 601 ( 4.1A)
FMN  A 601 ( 3.8A)
FMN  A 601 ( 3.4A)
None
 0.52A 1bu5B-5xraA:
29.6		 1bu5B-5xraA:
42.82
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5xra CANNABINOID RECEPTOR
1,FLAVODOXIN,CANNABI
NOID RECEPTOR 1

(Desulfovibrio
vulgaris;
Homo sapiens) 		PF00001
(7tm_1)
PF00258
(Flavodoxin_1) 		5 THR A1012
THR A1059
TRP A1060
GLY A1094
ASP A1095
 FMN  A 601 ( 3.2A)
FMN  A 601 ( 3.8A)
FMN  A 601 ( 4.2A)
FMN  A 601 ( 3.4A)
None
 0.71A 1bu5B-5xraA:
29.6		 1bu5B-5xraA:
42.82
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.
5xyi 40S RIBOSOMAL
PROTEIN S4

(Trichomonas
vaginalis) 		PF00900
(Ribosomal_S4e)
PF01479
(S4)
PF08071
(RS4NT)
PF16121
(40S_S4_C) 		4 ASN E 127
THR E 146
GLY E 144
ASP E 143
 None
G  2 112 ( 3.6A)
U  2 228 ( 4.7A)
None
 0.96A 1bu5B-5xyiE:
undetectable		 1bu5B-5xyiE:
19.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5zkp PLATELET-ACTIVATING
FACTOR
RECEPTOR,FLAVODOXIN,
PLATELET-ACTIVATING
FACTOR RECEPTOR

(Desulfovibrio
vulgaris;
Homo sapiens) 		no annotation 7 THR A1011
ASN A1013
THR A1058
TRP A1059
ASP A1061
GLY A1093
ASP A1094
 FMN  A1202 (-3.7A)
FMN  A1202 (-4.1A)
FMN  A1202 (-3.7A)
FMN  A1202 (-4.3A)
FMN  A1202 ( 4.2A)
FMN  A1202 (-3.2A)
None
 0.69A 1bu5B-5zkpA:
30.3		 1bu5B-5zkpA:
18.80
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.
6c0b TOXIN B

(Clostridioides
difficile) 		no annotation 4 THR A1543
ASN A1553
THR A1520
ASP A1522
 None
 0.99A 1bu5B-6c0bA:
undetectable		 1bu5B-6c0bA:
20.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6en4 SPLICING FACTOR 3B
SUBUNIT 3

(Homo sapiens) 		no annotation 4 THR A 420
TRP A 720
ASP A1203
GLY A 441
 None
 0.89A 1bu5B-6en4A:
undetectable		 1bu5B-6en4A:
19.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6ft1 FLAVODOXIN

(Bacillus cereus) 		no annotation 4 ASN A  14
THR A  59
ASP A  93
TYR A  96
 FMN  A1001 (-3.6A)
FMN  A1001 (-3.8A)
FMN  A1001 (-4.8A)
FMN  A1001 (-3.5A)
 0.40A 1bu5B-6ft1A:
24.1		 1bu5B-6ft1A:
29.37