SIMILAR PATTERNS OF AMINO ACIDS FOR 2FQY_A_ADNA400

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.
1cgs IGG2B-KAPPA NC6.8
FAB (HEAVY CHAIN)

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		5 ASP H  90
PHE H  64
MET H  81
PHE H  70
GLY H  66
 None
 1.29A 2fqyA-1cgsH:
undetectable		 2fqyA-1cgsH:
19.08
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.
1dcq PYK2-ASSOCIATED
PROTEIN BETA

(Mus musculus) 		PF01412
(ArfGap)
PF12796
(Ank_2) 		5 ASP A 266
PHE A 325
ASN A 326
PHE A 434
GLY A 321
 None
 1.38A 2fqyA-1dcqA:
undetectable		 2fqyA-1dcqA:
21.73
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.
1f2d 1-AMINOCYCLOPROPANE-
1-CARBOXYLATE
DEAMINASE

(Cyberlindnera
saturnus) 		PF00291
(PALP) 		5 ASN A 118
GLY A 325
ASP A 292
GLY A  75
VAL A 103
 None
PLP  A 342 (-3.6A)
PLP  A 342 ( 4.5A)
None
None
 1.26A 2fqyA-1f2dA:
2.1		 2fqyA-1f2dA:
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.
1lmk ANTI-PHOSPHATIDYLINO
SITOL SPECIFIC
PHOSPHOLIPASE C
DIABODY

(Mus musculus) 		PF07686
(V-set) 		5 ASP A  90
PHE A  64
MET A  81
PHE A  70
GLY A  66
 None
 1.26A 2fqyA-1lmkA:
undetectable		 2fqyA-1lmkA:
19.48
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.
1m53 ISOMALTULOSE
SYNTHASE

(Klebsiella sp.
LX3) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		5 ASP A 426
PHE A 432
PHE A 263
PHE A 186
GLY A 187
 None
 1.41A 2fqyA-1m53A:
undetectable		 2fqyA-1m53A:
19.08
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.
1pkq (8-18C5) CHIMERIC
FAB, HEAVY CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		5 ASP B  86
PHE B  63
MET B  80
PHE B  69
GLY B  65
 None
 1.25A 2fqyA-1pkqB:
undetectable		 2fqyA-1pkqB:
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.
1poi GLUTACONATE COENZYME
A-TRANSFERASE

(Acidaminococcus
fermentans) 		PF01144
(CoA_trans) 		5 PHE A 196
ASN B  84
GLY B  70
ASP A  29
ASP A 198
 None
 1.13A 2fqyA-1poiA:
undetectable		 2fqyA-1poiA:
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.
1q0y FAB 9B1, HEAVY CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		5 ASP H  86
PHE H  63
MET H  80
PHE H  69
GLY H  65
 None
 1.24A 2fqyA-1q0yH:
undetectable		 2fqyA-1q0yH:
20.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qvz YDR533C PROTEIN

(Saccharomyces
cerevisiae) 		PF01965
(DJ-1_PfpI) 		5 ASP A 206
ASN A 220
GLY A 203
GLY A 164
VAL A 187
 None
None
None
CSO  A 138 ( 3.6A)
CSO  A 138 ( 4.9A)
 1.45A 2fqyA-1qvzA:
4.4		 2fqyA-1qvzA:
21.66
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.
1r4p SHIGA-LIKE TOXIN
TYPE II A SUBUNIT

(Escherichia
coli) 		PF00161
(RIP) 		5 ASP A  94
MET A 150
PHE A 145
PHE A  92
GLY A  80
 None
None
None
FMT  A3015 ( 4.9A)
None
 1.44A 2fqyA-1r4pA:
undetectable		 2fqyA-1r4pA:
23.71
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.
1rh9 ENDO-BETA-MANNANASE

(Solanum
lycopersicum) 		PF00150
(Cellulase) 		5 PHE A 359
ASN A  53
GLY A  51
PHE A 319
GLY A 320
 None
 1.20A 2fqyA-1rh9A:
undetectable		 2fqyA-1rh9A:
22.40
Potential target for repurposing, i.e. matched protein structure has less than 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) 		5 ASN A 291
GLY A 295
MET A 333
PHE A 337
GLY A 319
 None
 1.42A 2fqyA-1t1eA:
6.8		 2fqyA-1t1eA:
20.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1tf0 SERUM ALBUMIN

(Homo sapiens) 		PF00273
(Serum_albumin) 		5 ASP A 249
ASN A  99
GLY A 248
PHE A  70
GLY A  71
 None
 1.27A 2fqyA-1tf0A:
undetectable		 2fqyA-1tf0A:
20.14
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.
1ua2 CELL DIVISION
PROTEIN KINASE 7

(Homo sapiens) 		PF00069
(Pkinase) 		5 ASP A 137
ASN A 141
ASP A 155
GLY A  21
VAL A  26
 None
ATP  A 381 ( 4.6A)
ATP  A 381 ( 4.4A)
TPO  A 170 (-3.1A)
ATP  A 381 (-4.0A)
 1.25A 2fqyA-1ua2A:
undetectable		 2fqyA-1ua2A:
22.87
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.
1xqs HEAT SHOCK 70 KDA
PROTEIN 1

(Homo sapiens) 		PF00012
(HSP70) 		5 ASP C 206
GLY C 224
ASP C 225
GLY C 203
ASP C 232
 None
 1.29A 2fqyA-1xqsC:
undetectable		 2fqyA-1xqsC:
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.
2b4c ANTI-HIV-1 GP120
IMMUNOGLOBULIN X5
HEAVY CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		5 ASP H  86
PHE H  63
MET H  80
PHE H  69
GLY H  65
 None
 1.15A 2fqyA-2b4cH:
undetectable		 2fqyA-2b4cH:
22.88
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2fqx MEMBRANE LIPOPROTEIN
TMPC

(Treponema
pallidum) 		PF02608
(Bmp) 		12 ASP A  27
PHE A  36
ASN A  37
GLY A  85
ASP A 108
MET A 158
PHE A 161
PHE A 186
GLY A 212
VAL A 237
ASP A 238
LYS A 260
 GMP  A 400 (-2.9A)
GMP  A 400 (-3.8A)
GMP  A 400 (-3.3A)
GMP  A 400 ( 3.7A)
GMP  A 400 (-3.3A)
GMP  A 400 (-3.5A)
GMP  A 400 ( 4.8A)
GMP  A 400 (-3.4A)
GMP  A 400 (-3.3A)
GMP  A 400 (-4.7A)
GMP  A 400 (-2.9A)
GMP  A 400 (-2.8A)
 0.73A 2fqyA-2fqxA:
54.3		 2fqyA-2fqxA:
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.
2kb3 OXOGLUTARATE
DEHYDROGENASE
INHIBITOR

(Corynebacterium
glutamicum) 		PF00498
(FHA) 		5 ASP A 103
GLY A 105
GLY A 131
VAL A  83
ASP A  82
 None
 0.88A 2fqyA-2kb3A:
undetectable		 2fqyA-2kb3A:
20.77
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.
2ofx BIFUNCTIONAL
3'-PHOSPHOADENOSINE
5'-PHOSPHOSULFATE
SYNTHETASE 1

(Homo sapiens) 		PF01583
(APS_kinase) 		5 ASN A  96
GLY A  88
ASP A  89
PHE A 101
GLY A 100
 None
PPS  A1100 (-3.6A)
PPS  A1100 (-2.7A)
PPS  A1100 (-3.5A)
None
 1.48A 2fqyA-2ofxA:
4.2		 2fqyA-2ofxA:
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.
2pwh SUCROSE ISOMERASE

([Pseudomonas]
mesoacidophila) 		PF00128
(Alpha-amylase)
PF11941
(DUF3459) 		5 ASP A 384
PHE A 390
PHE A 222
PHE A 145
GLY A 146
 None
 1.25A 2fqyA-2pwhA:
undetectable		 2fqyA-2pwhA:
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.
2qfv ISOCITRATE
DEHYDROGENASE [NADP]

(Saccharomyces
cerevisiae) 		PF00180
(Iso_dh) 		5 PHE A 194
GLY A 132
PHE A 199
GLY A 193
VAL A 232
 None
 1.44A 2fqyA-2qfvA:
3.5		 2fqyA-2qfvA:
21.33
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.
2qlv PROTEIN SIP2

(Saccharomyces
cerevisiae) 		PF04739
(AMPKBI)
PF16561
(AMPK1_CBM) 		5 ASP B 220
PHE B 202
GLY B 174
GLY B 191
VAL B 204
 None
 1.24A 2fqyA-2qlvB:
undetectable		 2fqyA-2qlvB:
22.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2rhp THROMBOSPONDIN-2

(Homo sapiens) 		PF02412
(TSP_3)
PF05735
(TSP_C)
PF07645
(EGF_CA)
PF12947
(EGF_3) 		5 ASP A 806
ASN A 810
GLY A 805
ASP A 791
ASP A 797
 CA  A  20 ( 2.7A)
None
None
CA  A  16 (-2.7A)
None
 1.48A 2fqyA-2rhpA:
undetectable		 2fqyA-2rhpA:
18.05
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.
2vk4 PYRUVATE
DECARBOXYLASE

(Kluyveromyces
lactis) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		5 ASN A  83
GLY A 416
GLY A  87
VAL A  93
ASP A  59
 None
 1.47A 2fqyA-2vk4A:
4.4		 2fqyA-2vk4A:
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.
2xf4 HYDROXYACYLGLUTATHIO
NE HYDROLASE

(Salmonella
enterica) 		PF00753
(Lactamase_B) 		5 GLY A 135
PHE A 139
GLY A 150
VAL A  29
ASP A  30
 None
 1.20A 2fqyA-2xf4A:
undetectable		 2fqyA-2xf4A:
19.81
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.
2y0k PYROGLUTATMATE PORIN
OPDO

(Pseudomonas
aeruginosa) 		PF03573
(OprD) 		5 PHE A 288
ASN A 281
PHE A 366
GLY A 289
VAL A 324
 None
 1.42A 2fqyA-2y0kA:
undetectable		 2fqyA-2y0kA:
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.
3any ETHANOLAMINE
AMMONIA-LYASE HEAVY
CHAIN

(Escherichia
coli) 		PF06751
(EutB) 		5 ASN A 376
ASP A 399
GLY A 328
VAL A 326
ASP A 362
 None
None
None
2A3  A 602 (-4.7A)
2A3  A 602 (-3.8A)
 1.29A 2fqyA-3anyA:
undetectable		 2fqyA-3anyA:
21.88
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.
3dan CYTOCHROME P450 74A2

(Parthenium
argentatum) 		PF00067
(p450) 		5 ASN A 184
GLY A 191
PHE A 173
GLY A 177
VAL A 247
 None
 1.16A 2fqyA-3danA:
undetectable		 2fqyA-3danA:
21.66
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.
3dme CONSERVED EXPORTED
PROTEIN

(Bordetella
pertussis) 		PF01266
(DAO) 		5 ASP A 281
ASP A 285
PHE A 235
GLY A 232
ASP A 273
 None
None
None
FAD  A 500 ( 4.6A)
None
 1.29A 2fqyA-3dmeA:
undetectable		 2fqyA-3dmeA:
23.10
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.
3edn PHENAZINE
BIOSYNTHESIS
PROTEIN, PHZF FAMILY

(Bacillus
anthracis) 		PF02567
(PhzC-PhzF) 		5 PHE A  12
ASN A  20
GLY A 230
MET A 121
GLY A  79
 None
SO4  A 300 ( 4.7A)
SO4  A 300 (-3.5A)
None
None
 1.16A 2fqyA-3ednA:
undetectable		 2fqyA-3ednA:
24.05
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.
3eh7 4-HYDROXYBUTYRATE
COA-TRANSFERASE

(Porphyromonas
gingivalis) 		PF02550
(AcetylCoA_hydro)
PF13336
(AcetylCoA_hyd_C) 		5 ASP A 222
GLY A 218
MET A 240
PHE A 270
GLY A 273
 None
 1.09A 2fqyA-3eh7A:
undetectable		 2fqyA-3eh7A:
22.27
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.
3fby CARTILAGE OLIGOMERIC
MATRIX PROTEIN

(Homo sapiens) 		PF02412
(TSP_3)
PF05735
(TSP_C) 		5 ASP A 378
ASN A 382
GLY A 377
ASP A 363
ASP A 369
 CA  A 812 ( 2.9A)
CA  A 811 ( 4.8A)
CA  A 810 ( 4.1A)
CA  A 810 ( 3.0A)
CA  A 809 ( 4.9A)
 1.49A 2fqyA-3fbyA:
undetectable		 2fqyA-3fbyA:
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.
3iwa FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULPHID
E OXIDOREDUCTASE

(Desulfovibrio
vulgaris) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 ASP A 327
PHE A  21
PHE A 289
VAL A   5
LYS A   3
 None
 1.39A 2fqyA-3iwaA:
5.1		 2fqyA-3iwaA:
23.38
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.
3loo ANOPHELES GAMBIAE
ADENOSINE KINASE

(Anopheles
gambiae) 		PF00294
(PfkB) 		5 PHE A 169
ASN A  14
PHE A 191
PHE A 170
GLY A 167
 None
B4P  A 349 ( 4.0A)
None
None
None
 1.32A 2fqyA-3looA:
3.0		 2fqyA-3looA:
22.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3o5a PERIPLASMIC NITRATE
REDUCTASE

(Cupriavidus
necator) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4) 		5 ASN A 511
GLY A 629
PHE A 604
GLY A 389
VAL A 126
 None
 1.43A 2fqyA-3o5aA:
2.2		 2fqyA-3o5aA:
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.
3ogk CORONATINE-INSENSITI
VE PROTEIN 1

(Arabidopsis
thaliana) 		no annotation 5 GLY B 486
MET B 468
PHE B 441
PHE B 483
VAL B 428
 None
 1.38A 2fqyA-3ogkB:
2.6		 2fqyA-3ogkB:
20.57
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.
3q3u LIGNIN PEROXIDASE

(Trametopsis
cervina) 		PF00141
(peroxidase)
PF11895
(Peroxidase_ext) 		5 GLY A  51
MET A 158
PHE A 163
PHE A  46
VAL A 266
 CA  A 340 ( 4.8A)
HEM  A 338 ( 4.7A)
None
HEM  A 338 (-3.4A)
None
 1.48A 2fqyA-3q3uA:
undetectable		 2fqyA-3q3uA:
25.20
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.
3uow GMP SYNTHETASE

(Plasmodium
falciparum) 		PF00117
(GATase)
PF00958
(GMP_synt_C)
PF02540
(NAD_synthase) 		5 MET A 220
PHE A 156
PHE A  86
GLY A 204
VAL A 184
 None
 1.42A 2fqyA-3uowA:
3.6		 2fqyA-3uowA:
19.30
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.
3uow GMP SYNTHETASE

(Plasmodium
falciparum) 		PF00117
(GATase)
PF00958
(GMP_synt_C)
PF02540
(NAD_synthase) 		5 PHE A 433
GLY A 435
PHE A 286
GLY A 264
VAL A 300
 None
XMP  A 556 (-4.1A)
None
None
None
 1.33A 2fqyA-3uowA:
3.6		 2fqyA-3uowA:
19.30
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.
3uow GMP SYNTHETASE

(Plasmodium
falciparum) 		PF00117
(GATase)
PF00958
(GMP_synt_C)
PF02540
(NAD_synthase) 		5 PHE A 433
GLY A 437
PHE A 286
GLY A 264
VAL A 300
 None
 1.20A 2fqyA-3uowA:
3.6		 2fqyA-3uowA:
19.30
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.
3wh7 BETA-GLUCOSIDASE

(metagenomes) 		PF00232
(Glyco_hydro_1) 		5 ASP A  47
GLY A  48
PHE A 405
VAL A  25
ASP A  52
 None
 1.02A 2fqyA-3wh7A:
undetectable		 2fqyA-3wh7A:
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.
3wh7 BETA-GLUCOSIDASE

(metagenomes) 		PF00232
(Glyco_hydro_1) 		5 ASP A  47
PHE A 405
GLY A  51
VAL A  25
ASP A  52
 None
 1.50A 2fqyA-3wh7A:
undetectable		 2fqyA-3wh7A:
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.
3x3y PHENYLETHYLAMINE
OXIDASE

(Arthrobacter
globiformis) 		PF01179
(Cu_amine_oxid)
PF02728
(Cu_amine_oxidN3) 		5 ASP A 266
GLY A 265
ASP A 264
VAL A 510
ASP A 444
 None
 1.43A 2fqyA-3x3yA:
undetectable		 2fqyA-3x3yA:
19.97
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.
4bnq NON-CANONICAL PURINE
NTP PYROPHOSPHATASE

(Staphylococcus
aureus) 		PF01725
(Ham1p_like) 		5 ASP A  94
ASN A  10
GLY A 150
ASP A 152
ASP A  16
 None
PO4  A 800 (-4.9A)
None
None
None
 1.17A 2fqyA-4bnqA:
undetectable		 2fqyA-4bnqA:
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.
4c51 CATALASE-PEROXIDASE

(Mycobacterium
tuberculosis) 		PF00141
(peroxidase) 		5 ASP A 573
GLY A 495
GLY A 570
VAL A 739
ASP A 738
 GLC  A1742 (-3.5A)
None
None
None
None
 1.31A 2fqyA-4c51A:
undetectable		 2fqyA-4c51A:
17.96
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.
4fc2 POLY(ADP-RIBOSE)
GLYCOHYDROLASE

(Mus musculus) 		PF05028
(PARG_cat) 		5 PHE A 893
GLY A 717
PHE A 895
GLY A 861
VAL A 729
 None
 1.43A 2fqyA-4fc2A:
undetectable		 2fqyA-4fc2A:
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.
4fhb NB179

(Lama glama) 		PF07686
(V-set) 		5 ASP D 117
ASN D 110
GLY D 100
GLY D  35
VAL D  79
 None
 1.45A 2fqyA-4fhbD:
undetectable		 2fqyA-4fhbD:
18.31
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.
4fo0 ACTIN-RELATED
PROTEIN 8

(Homo sapiens) 		PF00022
(Actin) 		5 ASP A 283
GLY A 539
PHE A 544
GLY A 310
VAL A 314
 MG  A 701 ( 3.9A)
ATP  A 702 (-3.6A)
ATP  A 702 (-4.0A)
None
None
 1.44A 2fqyA-4fo0A:
2.2		 2fqyA-4fo0A:
18.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ki5 MURINE MONOCLONAL
G99 FAB HEAVY CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		5 ASP E  90
PHE E  64
MET E  81
PHE E  70
GLY E  66
 ASP  E  90 ( 0.6A)
PHE  E  64 ( 1.3A)
MET  E  81 ( 0.0A)
PHE  E  70 ( 1.3A)
GLY  E  66 ( 0.0A)
 1.27A 2fqyA-4ki5E:
undetectable		 2fqyA-4ki5E:
20.89
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.
4kjr CATION EXCHANGER
YFKE

(Bacillus
subtilis) 		PF01699
(Na_Ca_ex) 		5 GLY A 327
ASP A 328
MET A 268
PHE A 108
GLY A 334
 None
 1.31A 2fqyA-4kjrA:
undetectable		 2fqyA-4kjrA:
21.98
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.
4me8 SIGNAL PEPTIDASE I

(Enterococcus
faecalis) 		PF00717
(Peptidase_S24) 		5 ASP A 142
GLY A 141
ASP A 149
PHE A 119
VAL A  83
 EDO  A 200 (-3.9A)
EDO  A 200 (-3.4A)
None
None
None
 1.28A 2fqyA-4me8A:
undetectable		 2fqyA-4me8A:
17.34
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.
4mn8 FLG22
LRR RECEPTOR-LIKE
SERINE/THREONINE-PRO
TEIN KINASE FLS2

(;
Arabidopsis
thaliana) 		PF00560
(LRR_1)
PF00669
(Flagellin_N)
PF08263
(LRRNT_2)
PF13516
(LRR_6)
PF13855
(LRR_8) 		5 ASP A 150
GLY A 174
ASP A 176
GLY C  70
ASP A 220
 None
 1.34A 2fqyA-4mn8A:
undetectable		 2fqyA-4mn8A:
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.
4pev MEMBRANE LIPOPROTEIN
FAMILY PROTEIN

(Aeropyrum
pernix) 		PF02608
(Bmp) 		5 ASP A  85
GLY A 144
ASP A 167
PHE A 226
GLY A 217
 ADN  A 501 (-3.8A)
ADN  A 501 ( 4.1A)
ADN  A 501 (-3.2A)
ADN  A 501 (-4.7A)
None
 1.49A 2fqyA-4pevA:
40.2		 2fqyA-4pevA:
28.05
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.
4pev MEMBRANE LIPOPROTEIN
FAMILY PROTEIN

(Aeropyrum
pernix) 		PF02608
(Bmp) 		10 ASP A  85
PHE A  94
ASN A  95
GLY A 144
ASP A 167
PHE A 226
PHE A 255
GLY A 281
ASP A 307
LYS A 324
 ADN  A 501 (-3.8A)
ADN  A 501 (-3.9A)
ADN  A 501 (-3.5A)
ADN  A 501 ( 4.1A)
ADN  A 501 (-3.2A)
ADN  A 501 (-4.7A)
ADN  A 501 (-3.4A)
ADN  A 501 (-3.2A)
ADN  A 501 (-2.6A)
ADN  A 501 (-3.0A)
 0.63A 2fqyA-4pevA:
40.2		 2fqyA-4pevA:
28.05
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.
4pev MEMBRANE LIPOPROTEIN
FAMILY PROTEIN

(Aeropyrum
pernix) 		PF02608
(Bmp) 		6 PHE A  94
ASN A  95
GLY A 144
ASP A 167
GLY A 281
VAL A 279
 ADN  A 501 (-3.9A)
ADN  A 501 (-3.5A)
ADN  A 501 ( 4.1A)
ADN  A 501 (-3.2A)
ADN  A 501 (-3.2A)
ADN  A 501 ( 4.2A)
 1.49A 2fqyA-4pevA:
40.2		 2fqyA-4pevA:
28.05
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.
4po0 SERUM ALBUMIN

(Oryctolagus
cuniculus) 		PF00273
(Serum_albumin) 		5 ASP A 249
ASN A  99
GLY A 248
PHE A  70
GLY A  71
 None
 1.24A 2fqyA-4po0A:
undetectable		 2fqyA-4po0A:
18.71
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.
4qti ANTI-UPAR ANTIBODY,
HEAVY CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		5 ASP H  90
PHE H  64
MET H  81
PHE H  70
GLY H  66
 None
 1.30A 2fqyA-4qtiH:
undetectable		 2fqyA-4qtiH:
20.55
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.
4r6y PUTATIVE
2-AMINOETHYLPHOSPHON
ATE-BINDING
PERIPLASMIC PROTEIN

(Salmonella
enterica) 		PF13343
(SBP_bac_6) 		5 ASP A  35
GLY A  32
ASP A  31
GLY A 199
ASP A 162
 None
GOL  A 401 ( 4.5A)
GOL  A 401 (-4.0A)
None
ACT  A 402 (-3.4A)
 1.40A 2fqyA-4r6yA:
2.6		 2fqyA-4r6yA:
25.00
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.
4rtf CHAPERONE PROTEIN
DNAK

(Mycobacterium
tuberculosis) 		PF00012
(HSP70) 		5 ASP D 202
ASN D  13
GLY D 174
VAL D 345
ASP D   8
 None
None
None
None
ATP  D 601 (-3.6A)
 1.46A 2fqyA-4rtfD:
undetectable		 2fqyA-4rtfD:
22.69
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.
4v2x ENDO-BETA-1,4-GLUCAN
ASE (CELLULASE B)

(Bacillus
halodurans) 		PF00150
(Cellulase)
PF03442
(CBM_X2) 		5 ASN A  47
GLY A  45
MET A 357
PHE A 297
GLY A 298
 None
 1.28A 2fqyA-4v2xA:
2.5		 2fqyA-4v2xA:
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.
4wb7 DNAJ HOMOLOG
SUBFAMILY B MEMBER
1,CAMP-DEPENDENT
PROTEIN KINASE
CATALYTIC SUBUNIT
ALPHA

(Homo sapiens) 		PF00069
(Pkinase)
PF00226
(DnaJ) 		5 GLY A 107
PHE A 109
GLY A 241
ASP A 221
LYS A 223
 ATP  A 501 (-3.2A)
ATP  A 501 (-4.6A)
ZN  A 503 ( 4.3A)
ATP  A 501 (-4.2A)
ATP  A 501 (-2.7A)
 1.49A 2fqyA-4wb7A:
undetectable		 2fqyA-4wb7A:
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.
4xhf NA-TRANSLOCATING
NADH-QUINONE
REDUCTASE SUBUNIT C
NQRC

(Shewanella
oneidensis) 		PF04205
(FMN_bind) 		5 GLY A 151
MET A 235
PHE A 239
GLY A 164
VAL A 155
 None
 1.30A 2fqyA-4xhfA:
undetectable		 2fqyA-4xhfA:
23.89
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.
4xqk LLABIII

(Lactococcus
lactis) 		PF00271
(Helicase_C)
PF02384
(N6_Mtase)
PF04851
(ResIII)
PF13156
(Mrr_cat_2) 		5 ASP A1235
ASN A1360
GLY A1233
ASP A1318
GLY A1229
 None
 1.41A 2fqyA-4xqkA:
2.2		 2fqyA-4xqkA:
11.39
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.
4y9v PARTICLE-ASSOCIATED
LYASE

(Acinetobacter
virus AP22) 		no annotation 5 ASP A 461
PHE A 488
GLY A 460
MET A 438
VAL A 478
 EDO  A 802 (-4.0A)
None
EDO  A 802 ( 3.8A)
None
None
 1.39A 2fqyA-4y9vA:
undetectable		 2fqyA-4y9vA:
21.34
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.
5b58 PUTATIVE HEMIN ABC
TRANSPORT SYSTEM,
MEMBRANE PROTEIN

(Burkholderia
cenocepacia) 		PF01032
(FecCD) 		5 ASP A 112
GLY A 114
PHE A  95
GLY A  94
VAL A 229
 None
 0.92A 2fqyA-5b58A:
undetectable		 2fqyA-5b58A:
23.89
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.
5bza BETA-N-ACETYLHEXOSAM
INIDASE

(Thermotoga
neapolitana) 		PF00933
(Glyco_hydro_3) 		5 PHE A 278
ASN A 277
PHE A  48
GLY A  12
VAL A  32
 None
 1.41A 2fqyA-5bzaA:
2.8		 2fqyA-5bzaA:
22.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5exk LIPOYL SYNTHASE

(Mycobacterium
tuberculosis) 		PF04055
(Radical_SAM)
PF16881
(LIAS_N) 		5 PHE A 159
GLY A 132
PHE A 170
GLY A 161
VAL A 203
 None
 1.33A 2fqyA-5exkA:
undetectable		 2fqyA-5exkA:
23.64
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.
5ey7 FRUCTOKINASE

(Vibrio cholerae) 		PF00294
(PfkB) 		5 ASP A 260
PHE A 113
GLY A  44
VAL A 101
ASP A  30
 NA  A 401 (-3.5A)
None
None
None
None
 1.47A 2fqyA-5ey7A:
4.3		 2fqyA-5ey7A:
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.
5h3h ABHYDROLASE
DOMAIN-CONTAINING
PROTEIN

(Exiguobacterium
antarcticum) 		PF00561
(Abhydrolase_1)
PF08386
(Abhydrolase_4) 		5 ASP A 253
GLY A 247
ASP A 220
PHE A 164
GLY A 161
 None
None
None
F50  A 301 (-4.7A)
None
 1.11A 2fqyA-5h3hA:
3.2		 2fqyA-5h3hA:
22.55
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.
5h4r BETA-1,3-1,4-GLUCANA
SE

(Caldicellulosiruptor
sp. F32) 		PF00150
(Cellulase) 		5 ASN A  52
GLY A  50
MET A 391
PHE A 327
GLY A 328
 None
 1.08A 2fqyA-5h4rA:
undetectable		 2fqyA-5h4rA:
23.13
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.
5jz8 ASPARTYL/ASPARAGINYL
BETA-HYDROXYLASE
COAGULATION FACTOR X

(Homo sapiens) 		PF00008
(EGF)
PF05118
(Asp_Arg_Hydrox)
PF13181
(TPR_8)
PF13432
(TPR_16) 		5 GLY A 663
ASP A 741
PHE A 719
GLY A 681
ASP B 103
 None
None
OGA  A 802 (-4.9A)
None
OGA  A 802 ( 3.2A)
 1.25A 2fqyA-5jz8A:
undetectable		 2fqyA-5jz8A:
22.37
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.
5k2y PROBABLE PERIPLASMIC
SUGAR-BINDING
LIPOPROTEIN USPC

(Mycobacterium
tuberculosis) 		PF01547
(SBP_bac_1) 		5 ASP A 216
PHE A 287
ASN A 212
PHE A 385
VAL A 307
 None
 1.38A 2fqyA-5k2yA:
undetectable		 2fqyA-5k2yA:
22.14
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.
5ori ALBUMIN

(Capra hircus) 		no annotation 5 ASP A 248
ASN A  99
GLY A 247
PHE A  70
GLY A  71
 None
 1.24A 2fqyA-5oriA:
undetectable		 2fqyA-5oriA:
19.56
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.
5wu3 SPECKLE TARGETED
PIP5K1A-REGULATED
POLY(A) POLYMERASE

(Homo sapiens) 		PF03828
(PAP_assoc) 		5 GLY A 354
MET A 187
PHE A 191
PHE A 371
VAL A 344
 None
 1.31A 2fqyA-5wu3A:
undetectable		 2fqyA-5wu3A:
20.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5wu6 SPECKLE TARGETED
PIP5K1A-REGULATED
POLY(A) POLYMERASE

(Homo sapiens) 		PF00076
(RRM_1)
PF03828
(PAP_assoc) 		5 GLY A 354
MET A 187
PHE A 191
PHE A 371
VAL A 344
 None
 1.34A 2fqyA-5wu6A:
undetectable		 2fqyA-5wu6A:
21.21
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.
5y3r X-RAY REPAIR
CROSS-COMPLEMENTING
PROTEIN 5
X-RAY REPAIR
CROSS-COMPLEMENTING
PROTEIN 6

(Homo sapiens) 		PF02735
(Ku)
PF03730
(Ku_C)
PF03731
(Ku_N) 		5 PHE B 426
ASN A 480
GLY B 406
VAL A 277
ASP B 429
 None
 1.35A 2fqyA-5y3rB:
5.2		 2fqyA-5y3rB:
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.
6a0x ANTIBODY 13D4, FAB
HEAVY CHAIN

(Mus musculus) 		no annotation 5 ASP A  86
PHE A  63
MET A  77
PHE A  69
GLY A  65
 None
 1.22A 2fqyA-6a0xA:
undetectable		 2fqyA-6a0xA:
11.91
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.
6al7 12-EPI-HAPALINDOLE
C/U SYNTHASE

(Fischerella sp.
ATCC 43239) 		no annotation 5 ASN A 137
GLY A 140
PHE A 210
GLY A 212
ASP A 214
 CA  A 301 (-3.1A)
None
None
None
None
 1.02A 2fqyA-6al7A:
undetectable		 2fqyA-6al7A:
13.50
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.
6byn WD REPEAT-CONTAINING
PROTEIN 5
WDR5-BINDING
MONOBODY, MB(S4)

(Homo sapiens) 		no annotation 5 ASP W 107
PHE W 133
GLY M  79
GLY W 147
VAL W 177
 None
 1.31A 2fqyA-6bynW:
undetectable		 2fqyA-6bynW:
13.23
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.
6fn4 UIC2 ANTIGEN BINDING
FRAGMENT HEAVY CHAIN

(Mus musculus) 		no annotation 5 ASP C  90
PHE C  64
MET C  81
PHE C  70
GLY C  66
 None
 1.23A 2fqyA-6fn4C:
undetectable		 2fqyA-6fn4C:
15.83
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.
6gu8 -

(-) 		no annotation 5 ASP A 292
GLY A 294
MET A 322
PHE A 324
GLY A 284
 EDO  A 507 ( 4.7A)
None
None
None
None
 1.33A 2fqyA-6gu8A:
3.9		 2fqyA-6gu8A:
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.
6gu8 -

(-) 		no annotation 5 ASP A 292
GLY A 294
PHE A 324
GLY A 284
VAL A  68
 EDO  A 507 ( 4.7A)
None
None
None
None
 0.99A 2fqyA-6gu8A:
3.9		 2fqyA-6gu8A:
undetectable