SIMILAR PATTERNS OF AMINO ACIDS FOR 3KU9_B_SPMB700

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.
1bii MHC CLASS I H-2DD

(Mus musculus) 		PF00129
(MHC_I)
PF07654
(C1-set) 		4 GLU A  24
TYR A 159
PHE A  74
TYR A  22
 None
 1.36A 3ku9B-1biiA:
undetectable		 3ku9B-1biiA:
22.06
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.
1bii MHC CLASS I H-2DD

(Mus musculus) 		PF00129
(MHC_I)
PF07654
(C1-set) 		4 GLU A  63
TYR A 171
PHE A  33
TYR A  45
 None
 0.94A 3ku9B-1biiA:
undetectable		 3ku9B-1biiA:
22.06
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.
1bjw ASPARTATE
AMINOTRANSFERASE

(Thermus
thermophilus) 		PF00155
(Aminotran_1_2) 		4 GLU A  84
GLU A 207
TYR A 245
PHE A  81
 None
 1.05A 3ku9B-1bjwA:
undetectable		 3ku9B-1bjwA:
23.44
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.
1c7j PROTEIN
(PARA-NITROBENZYL
ESTERASE)

(Bacillus
subtilis) 		PF00135
(COesterase) 		4 GLU A 115
TYR A 109
TYR A 136
TYR A 118
 None
 1.38A 3ku9B-1c7jA:
undetectable		 3ku9B-1c7jA:
21.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1c7t BETA-N-ACETYLHEXOSAM
INIDASE

(Serratia
marcescens) 		PF00728
(Glyco_hydro_20)
PF02838
(Glyco_hydro_20b)
PF03173
(CHB_HEX)
PF03174
(CHB_HEX_C) 		4 GLU A 739
TYR A 669
PHE A 672
TYR A 683
 CBS  A1001 (-2.7A)
CBS  A1001 (-4.4A)
CBS  A1001 (-4.7A)
CBS  A1001 (-4.1A)
 1.32A 3ku9B-1c7tA:
undetectable		 3ku9B-1c7tA:
20.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1chm CREATINE
AMIDINOHYDROLASE

(Pseudomonas
putida) 		PF00557
(Peptidase_M24)
PF01321
(Creatinase_N) 		4 TYR A  54
TYR A  53
GLU A  23
TYR A 257
 None
 1.36A 3ku9B-1chmA:
undetectable		 3ku9B-1chmA:
21.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ddh MHC CLASS I H-2DD
HEAVY CHAIN

(Mus musculus) 		PF00129
(MHC_I)
PF07654
(C1-set) 		4 GLU A  24
TYR A 159
PHE A  74
TYR A  22
 None
 1.33A 3ku9B-1ddhA:
undetectable		 3ku9B-1ddhA:
20.50
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.
1dk8 AXIN

(Homo sapiens) 		PF00615
(RGS) 		4 TYR A 119
TYR A 244
PHE A 238
TYR A 235
 GOL  A 604 (-4.5A)
None
None
DTT  A 701 (-4.3A)
 1.37A 3ku9B-1dk8A:
undetectable		 3ku9B-1dk8A:
14.41
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.
1ff9 SACCHAROPINE
REDUCTASE

(Magnaporthe
grisea) 		PF03435
(Sacchrp_dh_NADP)
PF16653
(Sacchrp_dh_C) 		4 GLU A 140
TYR A 133
GLU A 446
PHE A 364
 None
 1.01A 3ku9B-1ff9A:
4.1		 3ku9B-1ff9A:
22.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1h1a ENDO-1,4-BETA-XYLANA
SE

(Chaetomium
thermophilum) 		PF00457
(Glyco_hydro_11) 		4 TYR A  89
TYR A  78
TYR A 172
TYR A  36
 None
 1.29A 3ku9B-1h1aA:
undetectable		 3ku9B-1h1aA:
17.70
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1h81 POLYAMINE OXIDASE

(Zea mays) 		PF01593
(Amino_oxidase) 		7 GLU A  62
TYR A 165
TYR A 169
GLU A 170
TYR A 298
PHE A 403
TYR A 439
 FAD  A 579 (-4.4A)
None
None
None
FAD  A 579 (-4.4A)
FAD  A 579 (-4.7A)
FAD  A 579 (-4.8A)
 0.28A 3ku9B-1h81A:
62.7		 3ku9B-1h81A:
99.79
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.
1hn0 CHONDROITIN ABC
LYASE I

(Proteus
vulgaris) 		PF02278
(Lyase_8)
PF02884
(Lyase_8_C)
PF09092
(Lyase_N)
PF09093
(Lyase_catalyt) 		4 GLU A 272
TYR A 594
TYR A 576
TYR A 521
 None
 1.14A 3ku9B-1hn0A:
undetectable		 3ku9B-1hn0A:
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.
1hn0 CHONDROITIN ABC
LYASE I

(Proteus
vulgaris) 		PF02278
(Lyase_8)
PF02884
(Lyase_8_C)
PF09092
(Lyase_N)
PF09093
(Lyase_catalyt) 		4 TYR A 594
TYR A 576
GLU A 272
TYR A 521
 None
 1.34A 3ku9B-1hn0A:
undetectable		 3ku9B-1hn0A:
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.
1j31 HYPOTHETICAL PROTEIN
PH0642

(Pyrococcus
horikoshii) 		PF00795
(CN_hydrolase) 		4 GLU A 120
TYR A 111
GLU A  42
TYR A  48
 None
 1.36A 3ku9B-1j31A:
undetectable		 3ku9B-1j31A:
22.25
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.
1l9x GAMMA-GLUTAMYL
HYDROLASE

(Homo sapiens) 		PF07722
(Peptidase_C26) 		4 TYR A 226
GLU A  41
TYR A 291
TYR A 274
 None
 1.12A 3ku9B-1l9xA:
undetectable		 3ku9B-1l9xA:
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.
1m76 3-HYDROXYACYL-COA
DEHYDROGENASE

(Homo sapiens) 		PF00725
(3HCDH)
PF02737
(3HCDH_N) 		4 GLU A 230
TYR A 222
PHE A 247
TYR A 299
 None
 1.12A 3ku9B-1m76A:
3.5		 3ku9B-1m76A:
20.62
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.
1sq5 PANTOTHENATE KINASE

(Escherichia
coli) 		PF00485
(PRK) 		4 TYR A1258
TYR A1262
PHE A1244
TYR A1240
 None
None
None
PAU  A6001 (-4.3A)
 1.25A 3ku9B-1sq5A:
undetectable		 3ku9B-1sq5A:
21.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1te1 ENDO-1,4-XYLANASE

(Talaromyces
funiculosus) 		PF00457
(Glyco_hydro_11) 		4 TYR B  87
TYR B  76
TYR B 170
TYR B  35
 None
 1.24A 3ku9B-1te1B:
undetectable		 3ku9B-1te1B:
15.87
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.
1uwi BETA-GALACTOSIDASE

(Sulfolobus
solfataricus) 		PF00232
(Glyco_hydro_1) 		4 GLU A  54
TYR A 431
PHE A  17
TYR A  34
 None
 1.34A 3ku9B-1uwiA:
undetectable		 3ku9B-1uwiA:
22.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1y79 PEPTIDYL-DIPEPTIDASE
DCP

(Escherichia
coli) 		PF01432
(Peptidase_M3) 		4 GLU 1 549
TYR 1 598
TYR 1 594
TYR 1 611
 None
None
ASP  1 704 (-4.1A)
ASP  1 704 (-4.7A)
 1.27A 3ku9B-1y791:
undetectable		 3ku9B-1y791:
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.
1yna ENDO-1,4-BETA-XYLANA
SE

(Thermomyces
lanuginosus) 		PF00457
(Glyco_hydro_11) 		4 TYR A  88
TYR A  77
TYR A 172
TYR A  35
 None
 1.35A 3ku9B-1ynaA:
undetectable		 3ku9B-1ynaA:
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.
2fo1 LIN-12 PROTEIN

(Caenorhabditis
elegans) 		PF00023
(Ank)
PF12796
(Ank_2) 		4 GLU E1203
TYR E1123
GLU E1127
TYR E1205
 None
 1.33A 3ku9B-2fo1E:
undetectable		 3ku9B-2fo1E:
21.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hy5 INTRACELLULAR SULFUR
OXIDATION PROTEIN
DSRF
PUTATIVE
SULFURTRANSFERASE
DSRE

(Allochromatium
vinosum) 		PF02635
(DrsE) 		4 TYR B 275
TYR B 210
PHE B 336
TYR A  40
 None
 1.05A 3ku9B-2hy5B:
undetectable		 3ku9B-2hy5B:
15.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jep XYLOGLUCANASE

(Paenibacillus
pabuli) 		PF00150
(Cellulase) 		4 GLU A 182
TYR A 188
PHE A 184
TYR A 135
 CA  A1398 ( 4.5A)
None
None
None
 1.30A 3ku9B-2jepA:
undetectable		 3ku9B-2jepA:
21.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2kfl MAJOR PRION PROTEIN

(Notamacropus
eugenii) 		PF00377
(Prion) 		4 TYR A 222
GLU A 221
TYR A 218
PHE A 175
 None
 1.27A 3ku9B-2kflA:
undetectable		 3ku9B-2kflA:
13.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2khq INTEGRASE

(Staphylococcus
saprophyticus) 		PF14659
(Phage_int_SAM_3) 		4 TYR A  28
TYR A  59
PHE A  55
TYR A  52
 None
 1.29A 3ku9B-2khqA:
2.4		 3ku9B-2khqA:
13.12
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.
2lh9 TUDOR
DOMAIN-CONTAINING
PROTEIN 7

(Mus musculus) 		PF12872
(OST-HTH) 		4 GLU A  36
TYR A  79
TYR A  85
TYR A  64
 None
 1.38A 3ku9B-2lh9A:
undetectable		 3ku9B-2lh9A:
11.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2nq5 5-METHYLTETRAHYDROPT
EROYLTRIGLUTAMATE--H
OMOCYSTEINE
METHYLTRANSFERASE

(Streptococcus
mutans) 		PF01717
(Meth_synt_2)
PF08267
(Meth_synt_1) 		4 GLU A 200
TYR A 181
PHE A 222
TYR A 219
 None
 1.26A 3ku9B-2nq5A:
undetectable		 3ku9B-2nq5A:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2p7v REGULATOR OF SIGMA D

(Escherichia
coli) 		PF04353
(Rsd_AlgQ) 		4 TYR A  34
TYR A  33
PHE A 123
TYR A 120
 None
 1.35A 3ku9B-2p7vA:
undetectable		 3ku9B-2p7vA:
15.27
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.
2pff FATTY ACID SYNTHASE
SUBUNIT ALPHA

(Saccharomyces
cerevisiae) 		PF00106
(adh_short)
PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		4 GLU A 994
GLU A1681
TYR A1673
TYR A1401
 None
 1.26A 3ku9B-2pffA:
3.0		 3ku9B-2pffA:
13.15
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.
2uxy ALIPHATIC AMIDASE

(Pseudomonas
aeruginosa) 		PF00795
(CN_hydrolase) 		4 GLU A  59
GLU A 142
TYR A 192
TYR A  60
 C3Y  A 166 ( 2.8A)
C3Y  A 166 ( 3.4A)
C3Y  A 166 ( 3.3A)
C3Y  A 166 ( 4.9A)
 1.15A 3ku9B-2uxyA:
undetectable		 3ku9B-2uxyA:
20.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2v28 PHENYLALANINE-4-HYDR
OXYLASE

(Colwellia
psychrerythraea) 		PF00351
(Biopterin_H) 		4 GLU A 117
TYR A 114
GLU A 111
TYR A   7
 None
 0.96A 3ku9B-2v28A:
undetectable		 3ku9B-2v28A:
20.04
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.
2vul GH11 XYLANASE

(Escherichia
coli) 		PF00457
(Glyco_hydro_11) 		4 TYR A  91
TYR A  80
TYR A 175
TYR A  39
 None
None
12P  A1199 (-4.2A)
None
 1.31A 3ku9B-2vulA:
undetectable		 3ku9B-2vulA:
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.
2wan PULLULANASE

(Bacillus
acidopullulyticus) 		PF00128
(Alpha-amylase)
PF02922
(CBM_48) 		4 GLU A 492
TYR A 614
PHE A 619
TYR A 554
 None
 1.32A 3ku9B-2wanA:
undetectable		 3ku9B-2wanA:
19.16
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.
2yd0 ENDOPLASMIC
RETICULUM
AMINOPEPTIDASE 1

(Homo sapiens) 		PF01433
(Peptidase_M1)
PF11838
(ERAP1_C) 		4 GLU A 354
TYR A 245
PHE A 314
TYR A 327
 BES  A1950 (-3.3A)
None
None
None
 1.31A 3ku9B-2yd0A:
undetectable		 3ku9B-2yd0A:
19.36
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.
3a68 FERRITIN-4,
CHLOROPLASTIC

(Glycine max) 		PF00210
(Ferritin) 		4 GLU A  91
GLU A 140
PHE A  83
TYR A  63
 CA  A 214 (-2.4A)
CA  A 214 ( 4.6A)
None
None
 0.92A 3ku9B-3a68A:
undetectable		 3ku9B-3a68A:
18.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3a7s UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE ISOZYME L5

(Homo sapiens) 		PF01088
(Peptidase_C12) 		4 GLU A 177
TYR A 211
PHE A  54
TYR A 168
 None
 1.32A 3ku9B-3a7sA:
undetectable		 3ku9B-3a7sA:
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.
3bm7 PROTEIN OF UNKNOWN
FUNCTION WITH
FERREDOXIN-LIKE FOLD

(Caulobacter
vibrioides) 		PF03992
(ABM) 		4 TYR A  57
GLU A  33
TYR A  39
TYR A  71
 None
 1.27A 3ku9B-3bm7A:
undetectable		 3ku9B-3bm7A:
13.06
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.
3cgh SUSD HOMOLOG

(Bacteroides
thetaiotaomicron) 		PF12741
(SusD-like) 		4 TYR A 304
TYR A 308
TYR A 407
PHE A 396
 None
 1.17A 3ku9B-3cghA:
0.9		 3ku9B-3cghA:
22.97
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.
3chl ALPHA-14 GIARDIN

(Giardia
intestinalis) 		PF00191
(Annexin) 		4 TYR A 212
TYR A 208
PHE A 201
TYR A 196
 None
 1.19A 3ku9B-3chlA:
undetectable		 3ku9B-3chlA:
21.14
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.
3ehm SUSD HOMOLOG

(Bacteroides
thetaiotaomicron) 		PF12741
(SusD-like) 		4 TYR A 277
TYR A 281
TYR A 385
PHE A 374
 None
 1.18A 3ku9B-3ehmA:
2.3		 3ku9B-3ehmA:
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.
3en8 UNCHARACTERIZED
NTF-2 LIKE PROTEIN

(Paraburkholderia
xenovorans) 		PF12680
(SnoaL_2) 		4 GLU A  25
TYR A  37
TYR A  80
PHE A  64
 None
PG4  A 131 ( 4.1A)
None
None
 1.16A 3ku9B-3en8A:
undetectable		 3ku9B-3en8A:
15.03
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.
3gzs UNCHARACTERIZED SUSD
SUPERFAMILY PROTEIN

(Bacteroides
fragilis) 		PF12741
(SusD-like) 		4 TYR A 308
TYR A 312
TYR A 406
PHE A 393
 None
 1.22A 3ku9B-3gzsA:
undetectable		 3ku9B-3gzsA:
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.
3h7l ENDOGLUCANASE

(Vibrio
parahaemolyticus) 		PF00759
(Glyco_hydro_9)
PF02927
(CelD_N) 		4 GLU A 547
TYR A 232
PHE A 507
TYR A 501
 GOL  A 586 (-3.6A)
None
None
None
 1.23A 3ku9B-3h7lA:
undetectable		 3ku9B-3h7lA:
23.06
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.
3i45 TWIN-ARGININE
TRANSLOCATION
PATHWAY SIGNAL
PROTEIN

(Rhodospirillum
rubrum) 		PF13458
(Peripla_BP_6) 		4 GLU A 237
TYR A 154
PHE A 208
TYR A 240
 None
NIO  A 500 (-3.6A)
NIO  A 500 (-3.4A)
None
 1.30A 3ku9B-3i45A:
2.5		 3ku9B-3i45A:
23.95
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.
3i7f ASPARTYL-TRNA
SYNTHETASE

(Entamoeba
histolytica) 		PF00152
(tRNA-synt_2)
PF01336
(tRNA_anti-codon) 		4 GLU A 336
TYR A 445
TYR A 498
PHE A 502
 None
 1.29A 3ku9B-3i7fA:
undetectable		 3ku9B-3i7fA:
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.
3i9v NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT 4
NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT 5

(Thermus
thermophilus) 		PF00329
(Complex1_30kDa)
PF00346
(Complex1_49kDa) 		4 GLU 5  73
GLU 4 352
TYR 4 252
TYR 4 343
 None
 0.81A 3ku9B-3i9v5:
undetectable		 3ku9B-3i9v5:
20.95
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.
3i9v NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT 4
NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT 5

(Thermus
thermophilus) 		PF00329
(Complex1_30kDa)
PF00346
(Complex1_49kDa) 		4 GLU 5 117
TYR 4 355
GLU 4  67
PHE 5 122
 None
 1.32A 3ku9B-3i9v5:
undetectable		 3ku9B-3i9v5:
20.95
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.
3ilv GLUTAMINE-DEPENDENT
NAD(+) SYNTHETASE

(Cytophaga
hutchinsonii) 		PF00795
(CN_hydrolase)
PF02540
(NAD_synthase) 		4 GLU A 164
TYR A 230
GLU A  44
TYR A 217
 None
 1.13A 3ku9B-3ilvA:
undetectable		 3ku9B-3ilvA:
23.46
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.
3ki8 BETA
UREIDOPROPIONASE
(BETA-ALANINE
SYNTHASE)

(Pyrococcus
abyssi) 		PF00795
(CN_hydrolase) 		4 GLU A 120
TYR A 111
GLU A  42
TYR A  48
 None
 1.33A 3ku9B-3ki8A:
undetectable		 3ku9B-3ki8A:
22.30
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.
3mes CHOLINE KINASE

(Cryptosporidium
parvum) 		PF01633
(Choline_kinase) 		4 GLU A 271
TYR A 301
GLU A 304
TYR A 309
 MG  A 430 (-1.9A)
None
DME  A 427 ( 3.8A)
DME  A 427 (-4.4A)
 1.37A 3ku9B-3mesA:
undetectable		 3ku9B-3mesA:
24.00
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.
3o6u UNCHARACTERIZED
PROTEIN CPE2226

(Clostridium
perfringens) 		PF04205
(FMN_bind) 		4 GLU A  97
TYR A  46
GLU A  66
TYR A  64
 None
 1.34A 3ku9B-3o6uA:
undetectable		 3ku9B-3o6uA:
14.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pqy ALPHA CHAIN OF THE
6218-TCR
BETA CHAIN OF THE
6218-TCR

(Homo sapiens;
Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set)
PF09291
(DUF1968) 		4 TYR D  33
TYR D  40
TYR D  42
TYR E  40
 None
 1.15A 3ku9B-3pqyD:
undetectable		 3ku9B-3pqyD:
16.98
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.
3qky OUTER MEMBRANE
ASSEMBLY LIPOPROTEIN
YFIO

(Rhodothermus
marinus) 		PF13525
(YfiO) 		4 GLU A 113
TYR A  45
TYR A  76
PHE A  97
 None
 1.31A 3ku9B-3qkyA:
undetectable		 3ku9B-3qkyA:
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.
3sgh SUSD HOMOLOG

(Bacteroides
thetaiotaomicron) 		PF12741
(SusD-like) 		4 TYR A 280
TYR A 284
TYR A 385
PHE A 374
 None
 1.13A 3ku9B-3sghA:
undetectable		 3ku9B-3sghA:
22.53
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.
3umv DEOXYRIBODIPYRIMIDIN
E PHOTO-LYASE

(Oryza sativa) 		PF00875
(DNA_photolyase) 		4 TYR A 363
GLU A 405
TYR A 398
TYR A 460
 None
EDO  A 706 (-3.7A)
None
EDO  A 706 (-4.7A)
 1.31A 3ku9B-3umvA:
undetectable		 3ku9B-3umvA:
21.24
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.
3waj TRANSMEMBRANE
OLIGOSACCHARYL
TRANSFERASE

(Archaeoglobus
fulgidus) 		PF02516
(STT3) 		4 GLU A 166
TYR A 276
PHE A 427
TYR A 430
 SO4  A 902 ( 4.8A)
None
None
None
 1.28A 3ku9B-3wajA:
undetectable		 3ku9B-3wajA:
18.66
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.
3zse ENDO-1,4-BETA-XYLANA
SE

(Thermobifida
fusca) 		PF00457
(Glyco_hydro_11) 		4 TYR A 129
TYR A 118
TYR A 210
TYR A  77
 None
FXP  A1207 (-4.7A)
FXP  A1207 (-4.7A)
None
 1.26A 3ku9B-3zseA:
undetectable		 3ku9B-3zseA:
16.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bx9 VACUOLAR PROTEIN
SORTING-ASSOCIATED
PROTEIN 33A

(Homo sapiens) 		PF00995
(Sec1) 		4 TYR A 492
TYR A 489
GLU A 377
PHE A 370
 None
 1.01A 3ku9B-4bx9A:
undetectable		 3ku9B-4bx9A:
21.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ha4 BETA-GALACTOSIDASE

(Acidilobus
saccharovorans) 		PF00232
(Glyco_hydro_1) 		4 GLU A  55
TYR A 429
PHE A  18
TYR A  35
 None
 1.37A 3ku9B-4ha4A:
undetectable		 3ku9B-4ha4A:
22.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4i1a RESPONSE REGULATOR
ASPARTATE
PHOSPHATASE I

(Bacillus
subtilis) 		PF13424
(TPR_12) 		4 TYR A 179
GLU A 141
PHE A 107
TYR A 104
 None
 0.94A 3ku9B-4i1aA:
undetectable		 3ku9B-4i1aA:
20.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ivf PUTATIVE
UNCHARACTERIZED
PROTEIN

(Lodderomyces
elongisporus) 		PF00043
(GST_C)
PF02798
(GST_N) 		4 TYR A  19
TYR A 186
TYR A 205
TYR A 151
 None
 1.32A 3ku9B-4ivfA:
undetectable		 3ku9B-4ivfA:
18.83
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.
4l37 ARYLPHORIN

(Bombyx mori) 		PF00372
(Hemocyanin_M)
PF03722
(Hemocyanin_N)
PF03723
(Hemocyanin_C) 		4 TYR B 222
TYR B 402
TYR B 126
PHE B  81
 None
SCN  B 708 (-4.8A)
None
None
 1.38A 3ku9B-4l37B:
undetectable		 3ku9B-4l37B:
21.11
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.
4la2 DIMETHYLSULPHONIOPRO
PIONATE (DMSP) LYASE
DDDQ

(Ruegeria
lacuscaerulensis) 		PF16867
(DMSP_lyase) 		4 TYR A 110
TYR A  92
TYR A  90
PHE A  86
 MES  A 202 ( 4.3A)
MES  A 202 (-3.8A)
None
None
 1.17A 3ku9B-4la2A:
undetectable		 3ku9B-4la2A:
19.54
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.
4mru SUSD HOMOLOG

(Bacteroides
thetaiotaomicron) 		PF12741
(SusD-like) 		4 TYR A 290
TYR A 294
TYR A 394
PHE A 383
 None
 1.17A 3ku9B-4mruA:
undetectable		 3ku9B-4mruA:
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.
4oo2 CHLOROPHENOL-4-MONOO
XYGENASE

(Streptomyces
globisporus) 		PF03241
(HpaB)
PF11794
(HpaB_N) 		4 TYR A 465
GLU A 462
TYR A 382
PHE A 353
 None
 1.20A 3ku9B-4oo2A:
undetectable		 3ku9B-4oo2A:
20.37
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.
4puc SUSD HOMOLOG

(Bacteroides
uniformis) 		PF12741
(SusD-like) 		4 TYR A 295
TYR A 299
TYR A 398
PHE A 387
 None
 1.21A 3ku9B-4pucA:
undetectable		 3ku9B-4pucA:
22.99
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.
4q1v PUTATIVE DIPEPTIDYL
AMINOPEPTIDASE IV

(Bacteroides
ovatus) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		4 TYR A 497
GLU A 482
TYR A 591
PHE A 505
 None
 1.21A 3ku9B-4q1vA:
undetectable		 3ku9B-4q1vA:
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.
4ryk LMO0325 PROTEIN

(Listeria
monocytogenes) 		PF01381
(HTH_3) 		4 GLU A 185
GLU A 226
TYR A 189
TYR A 184
 None
None
TLA  A 402 (-3.6A)
None
 1.04A 3ku9B-4rykA:
undetectable		 3ku9B-4rykA:
18.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4utf GLYCOSYL HYDROLASE
FAMILY 71

(Bacteroides
xylanisolvens) 		PF16317
(Glyco_hydro_99) 		4 GLU A 156
TYR A 198
TYR A 250
PHE A  44
 IFM  A 501 (-2.8A)
MAN  A 510 (-4.5A)
None
None
 1.35A 3ku9B-4utfA:
undetectable		 3ku9B-4utfA:
19.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4w79 PROTEIN N-TERMINAL
GLUTAMINE
AMIDOHYDROLASE

(Homo sapiens) 		PF09764
(Nt_Gln_amidase) 		4 TYR A 163
GLU A  29
TYR A 138
TYR A  80
 EDO  A 303 (-4.9A)
None
None
None
 1.37A 3ku9B-4w79A:
undetectable		 3ku9B-4w79A:
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.
4z9d PERTUSSIS TOXIN-LIKE
SUBUNIT ARTA

(Escherichia
coli) 		PF02917
(Pertussis_S1) 		4 GLU A  17
TYR A  78
TYR A  80
PHE A  23
 None
 0.97A 3ku9B-4z9dA:
undetectable		 3ku9B-4z9dA:
18.78
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.
5dl6 PUTATIVE PORIN FOR
VANILLATE
TRAFFICKING (VANP)

(Acinetobacter
baumannii) 		PF03573
(OprD) 		4 TYR A 149
TYR A 182
TYR A 200
TYR A 207
 None
 1.12A 3ku9B-5dl6A:
undetectable		 3ku9B-5dl6A:
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.
5e6k POLYKETIDE SYNTHASE
PKSL

(Bacillus
subtilis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		4 GLU A 483
TYR A 455
TYR A 581
PHE A 155
 None
 1.37A 3ku9B-5e6kA:
undetectable		 3ku9B-5e6kA:
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.
5e72 N2,
N2-DIMETHYLGUANOSINE
TRNA
METHYLTRANSFERASE

(Thermococcus
kodakarensis) 		PF01170
(UPF0020)
PF02926
(THUMP) 		4 GLU A  91
GLU A   5
TYR A 143
TYR A 130
 None
 1.16A 3ku9B-5e72A:
3.2		 3ku9B-5e72A:
21.18
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.
5eny POLYKETIDE SYNTHASE
PKSL

(Bacillus
subtilis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		4 GLU A 483
TYR A 455
TYR A 581
PHE A 155
 None
 1.36A 3ku9B-5enyA:
undetectable		 3ku9B-5enyA:
19.79
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.
5f7u CYCLOALTERNAN-FORMIN
G ENZYME

(Listeria
monocytogenes) 		PF01055
(Glyco_hydro_31)
PF13802
(Gal_mutarotas_2)
PF16338
(DUF4968)
PF16990
(CBM_35) 		4 TYR A 436
TYR A 598
PHE A 537
TYR A 590
 GLC  A1118 (-4.8A)
None
None
None
 1.28A 3ku9B-5f7uA:
undetectable		 3ku9B-5f7uA:
18.06
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.
5foe GDP-FUCOSE PROTEIN
O-FUCOSYLTRANSFERASE
2,THROMBOSPONDIN-1

(Caenorhabditis
elegans;
Homo sapiens) 		PF00090
(TSP_1)
PF10250
(O-FucT) 		4 TYR A 133
TYR A 162
PHE A 174
TYR A 175
 None
 1.17A 3ku9B-5foeA:
undetectable		 3ku9B-5foeA:
22.65
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.
5g3p FORMAMIDASE

(Bacillus cereus) 		PF00795
(CN_hydrolase) 		4 GLU A  60
GLU A 140
TYR A 191
TYR A  61
 SCY  A 165 ( 3.2A)
SCY  A 165 ( 3.7A)
SCY  A 165 ( 3.4A)
None
 1.05A 3ku9B-5g3pA:
undetectable		 3ku9B-5g3pA:
22.42
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.
5hi9 TRANSIENT RECEPTOR
POTENTIAL CATION
CHANNEL SUBFAMILY V
MEMBER 2

(Rattus
norvegicus) 		PF00520
(Ion_trans)
PF12796
(Ank_2) 		4 GLU A 670
TYR A 447
TYR A 515
PHE A 393
 None
 1.33A 3ku9B-5hi9A:
undetectable		 3ku9B-5hi9A:
19.07
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.
5hy5 TRYPTOPHAN
6-HALOGENASE

(Streptomyces
toxytricini) 		PF04820
(Trp_halogenase) 		4 GLU A  68
TYR A 176
TYR A  78
TYR A 515
 None
 1.36A 3ku9B-5hy5A:
8.2		 3ku9B-5hy5A:
23.69
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.
5i6h ACETYL-COA
CARBOXYLASE-LIKE
PROTEIN

(Chaetomium
thermophilum) 		PF01039
(Carboxyl_trans)
PF08326
(ACC_central) 		4 TYR A1113
TYR A1110
TYR A1105
PHE A1083
 None
 1.26A 3ku9B-5i6hA:
1.2		 3ku9B-5i6hA:
14.69
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.
5i77 ENDO-BETA-1,
4-GLUCANASE

(Aspergillus
niger) 		PF00150
(Cellulase) 		4 GLU A  82
TYR A  97
PHE A 139
TYR A 125
 None
 1.36A 3ku9B-5i77A:
undetectable		 3ku9B-5i77A:
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.
5jqn ALIPHATIC AMIDASE

(Nesterenkonia
sp. AN1) 		PF00795
(CN_hydrolase) 		4 GLU A 119
TYR A 109
GLU A  41
TYR A  47
 None
 1.38A 3ku9B-5jqnA:
undetectable		 3ku9B-5jqnA:
19.35
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.
5k9h 0940_GH29

(unidentified) 		PF00754
(F5_F8_type_C)
PF01120
(Alpha_L_fucos) 		4 GLU A 257
GLU A 158
PHE A  25
TYR A  23
 None
 1.26A 3ku9B-5k9hA:
undetectable		 3ku9B-5k9hA:
22.42
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.
5l44 K-26 DIPEPTIDYL
CARBOXYPEPTIDASE

(Astrosporangium
hypotensionis) 		PF01432
(Peptidase_M3) 		4 GLU A 543
TYR A 590
TYR A 586
TYR A 603
 None
None
SO4  A1004 (-4.4A)
SO4  A1004 (-4.8A)
 1.28A 3ku9B-5l44A:
2.4		 3ku9B-5l44A:
21.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5lun 2-OXOGLUTARATE-DEPEN
DENT
ETHYLENE/SUCCINATE-F
ORMING ENZYME

(Pseudomonas
savastanoi) 		PF03171
(2OG-FeII_Oxy)
PF14226
(DIOX_N) 		4 GLU A  84
TYR A 192
PHE A 314
TYR A 318
 ARG  A 403 (-3.5A)
ARG  A 403 (-4.0A)
ARG  A 403 (-3.9A)
None
 1.20A 3ku9B-5lunA:
undetectable		 3ku9B-5lunA:
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.
5oc9 -

(-) 		no annotation 4 GLU A 529
TYR A 491
GLU A 448
PHE A 450
 CA  A 701 ( 2.2A)
None
CA  A 702 ( 2.6A)
None
 1.29A 3ku9B-5oc9A:
3.4		 3ku9B-5oc9A:
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.
5sy1 STRA6

(Danio rerio) 		PF14752
(RBP_receptor) 		4 GLU A  37
TYR A 135
TYR A 131
PHE A 113
 None
 1.20A 3ku9B-5sy1A:
undetectable		 3ku9B-5sy1A:
20.03
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.
5tu4 PAGF
PRENYLTRANSFERASE

(Planktothrix
agardhii) 		no annotation 4 GLU A  51
TYR A 186
TYR A 235
TYR A 292
 B1C  A 403 (-2.9A)
DST  A 401 (-4.3A)
DST  A 401 (-3.4A)
None
 1.18A 3ku9B-5tu4A:
undetectable		 3ku9B-5tu4A:
20.46
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.
5voc ENVELOPE
GLYCOPROTEIN H
ENVELOPE
GLYCOPROTEIN L

(Human
betaherpesvirus
5) 		PF01801
(Cytomega_gL)
PF02489
(Herpes_glycop_H)
PF17488
(Herpes_glycoH_C) 		4 GLU B 182
TYR A  45
PHE A  81
TYR A  87
 None
 1.31A 3ku9B-5vocB:
undetectable		 3ku9B-5vocB:
20.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5wu7 UNCHARACTERIZED
PROTEIN

(Pyrococcus
horikoshii) 		PF03065
(Glyco_hydro_57)
PF09210
(DUF1957) 		4 GLU A 365
TYR A 110
PHE A 106
TYR A 313
 None
 1.05A 3ku9B-5wu7A:
undetectable		 3ku9B-5wu7A:
23.70
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.
5x7h CYCLOISOMALTOOLIGOSA
CCHARIDE
GLUCANOTRANSFERASE

(Paenibacillus
sp. 598K) 		PF13199
(Glyco_hydro_66)
PF16990
(CBM_35) 		4 GLU A 170
TYR A 519
TYR A 470
TYR A 175
 None
GLC  A 818 ( 3.8A)
GLC  A 820 ( 4.7A)
None
 1.09A 3ku9B-5x7hA:
undetectable		 3ku9B-5x7hA:
21.27
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.
5xtd NADH-UBIQUINONE
OXIDOREDUCTASE CHAIN
1

(Homo sapiens) 		PF15879
(MWFE) 		4 GLU s 202
TYR s 228
GLU s 227
PHE s 220
 None
 1.37A 3ku9B-5xtds:
2.2		 3ku9B-5xtds:
20.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5yvs ALCOHOL
DEHYDROGENASE

(candidate
divison MSBL1
archaeon
SCGC-AAA259E19) 		no annotation 4 TYR A 236
TYR A 232
GLU A 231
TYR A 259
 None
 1.11A 3ku9B-5yvsA:
undetectable		 3ku9B-5yvsA:
10.16
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.
6bqh 5-HYDROXYTRYPTAMINE
RECEPTOR 2C,SOLUBLE
CYTOCHROME B562

(Escherichia
coli;
Homo sapiens) 		no annotation 4 TYR A  90
TYR A 375
PHE A 379
TYR A 382
 OLA  A1210 (-3.9A)
None
None
None
 1.24A 3ku9B-6bqhA:
undetectable		 3ku9B-6bqhA:
9.11
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.
6cr0 (S)-6-HYDROXYNICOTIN
E OXIDASE

(Shinella sp.
HZN7) 		no annotation 4 GLU A 166
TYR A 414
GLU A 201
TYR A 111
 MPD  A 504 (-3.5A)
MPD  A 505 ( 3.8A)
MPD  A 504 (-3.2A)
MPD  A 503 (-3.8A)
 1.10A 3ku9B-6cr0A:
35.1		 3ku9B-6cr0A:
10.72
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.
6evj RNA-DIRECTED RNA
POLYMERASE CATALYTIC
SUBUNIT

(Influenza A
virus) 		no annotation 4 GLU B 608
TYR B 555
PHE B 551
TYR B 599
 None
 1.31A 3ku9B-6evjB:
0.6		 3ku9B-6evjB:
10.24
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.
6exn PRE-MRNA-SPLICING
FACTOR CLF1

(Saccharomyces
cerevisiae) 		no annotation 4 GLU S  53
TYR S  46
PHE S  74
TYR S  54
 G  6  86 ( 4.3A)
None
None
G  6  86 ( 4.5A)
 1.35A 3ku9B-6exnS:
undetectable		 3ku9B-6exnS:
10.32
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.
6f5o RNA-DIRECTED RNA
POLYMERASE CATALYTIC
SUBUNIT

(Influenza B
virus) 		no annotation 4 GLU B 607
TYR B 554
PHE B 550
TYR B 598
 None
 1.23A 3ku9B-6f5oB:
3.0		 3ku9B-6f5oB:
9.47