SIMILAR PATTERNS OF AMINO ACIDS FOR 6FGD_A_ACTA825

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.
1dkr PHOSPHORIBOSYL
PYROPHOSPHATE
SYNTHETASE

(Bacillus
subtilis) 		PF13793
(Pribosyltran_N)
PF14572
(Pribosyl_synth) 		3 LYS A 217
VAL A 169
ASP A 167
 None
 0.69A 6fgdA-1dkrA:
undetectable		 6fgdA-1dkrA:
24.57
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.
1iok CHAPERONIN 60

(Paracoccus
denitrificans) 		PF00118
(Cpn60_TCP1) 		3 LYS A  28
VAL A  94
ASP A  25
 None
 0.70A 6fgdA-1iokA:
undetectable		 6fgdA-1iokA:
22.24
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.
1ir0 FERREDOXIN

(Bacillus
thermoproteolyticus) 		PF13370
(Fer4_13) 		3 LYS A   2
VAL A  68
ASP A  70
 None
 0.36A 6fgdA-1ir0A:
undetectable		 6fgdA-1ir0A:
13.07
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.
1q3b ENDONUCLEASE VIII

(Escherichia
coli) 		PF01149
(Fapy_DNA_glyco)
PF06827
(zf-FPG_IleRS)
PF06831
(H2TH) 		3 LYS A  98
VAL A  76
ASP A  78
 None
GOL  A 351 (-4.2A)
None
 0.65A 6fgdA-1q3bA:
undetectable		 6fgdA-1q3bA:
22.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1rz2 CONSERVED
HYPOTHETICAL PROTEIN
BA4783

(Bacillus
anthracis) 		PF04203
(Sortase) 		3 LYS A 249
VAL A 251
ASP A 225
 None
 0.69A 6fgdA-1rz2A:
undetectable		 6fgdA-1rz2A:
19.95
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.
1vcl HEMOLYTIC LECTIN
CEL-III

(Cucumaria
echinata) 		PF00652
(Ricin_B_lectin) 		3 LYS A 118
VAL A 133
ASP A 135
 None
 0.58A 6fgdA-1vclA:
undetectable		 6fgdA-1vclA:
23.00
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.
1vdc NADPH DEPENDENT
THIOREDOXIN
REDUCTASE

(Arabidopsis
thaliana) 		PF07992
(Pyr_redox_2) 		3 LYS A 222
VAL A 231
ASP A 233
 None
 0.42A 6fgdA-1vdcA:
1.6		 6fgdA-1vdcA:
21.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1w18 LEVANSUCRASE

(Gluconacetobacter
diazotrophicus) 		PF02435
(Glyco_hydro_68) 		3 LYS A 411
VAL A 437
ASP A 439
 None
 0.64A 6fgdA-1w18A:
undetectable		 6fgdA-1w18A:
21.92
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.
1wkm METHIONINE
AMINOPEPTIDASE

(Pyrococcus
furiosus) 		PF00557
(Peptidase_M24) 		3 LYS A  74
VAL A  72
ASP A  77
 None
 0.70A 6fgdA-1wkmA:
undetectable		 6fgdA-1wkmA:
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.
1wta 5'-METHYLTHIOADENOSI
NE PHOSPHORYLASE

(Aeropyrum
pernix) 		PF01048
(PNP_UDP_1) 		3 LYS A  56
VAL A  49
ASP A  51
 None
 0.48A 6fgdA-1wtaA:
2.2		 6fgdA-1wtaA:
22.04
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.
1xcr HYPOTHETICAL PROTEIN
PTD012

(Homo sapiens) 		PF08925
(DUF1907) 		3 LYS A 169
VAL A  35
ASP A  37
 None
 0.45A 6fgdA-1xcrA:
undetectable		 6fgdA-1xcrA:
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.
1y89 DEVB PROTEIN

(Vibrio cholerae) 		PF01182
(Glucosamine_iso) 		3 LYS A 185
VAL A 131
ASP A 133
 None
 0.64A 6fgdA-1y89A:
undetectable		 6fgdA-1y89A:
20.47
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.
1yr2 PROLYL
OLIGOPEPTIDASE

(Novosphingobium
capsulatum) 		PF00326
(Peptidase_S9)
PF02897
(Peptidase_S9_N) 		3 LYS A  56
VAL A  49
ASP A  51
 None
 0.28A 6fgdA-1yr2A:
2.6		 6fgdA-1yr2A:
20.72
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.
2as0 HYPOTHETICAL PROTEIN
PH1915

(Pyrococcus
horikoshii) 		PF01472
(PUA)
PF10672
(Methyltrans_SAM) 		3 LYS A 358
VAL A 392
ASP A 394
 None
 0.51A 6fgdA-2as0A:
undetectable		 6fgdA-2as0A:
23.61
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.
2b5u COLICIN E3

(Escherichia
coli) 		PF03515
(Cloacin)
PF09000
(Cytotoxic)
PF11570
(E2R135) 		3 LYS A 154
VAL A 287
ASP A 289
 None
 0.61A 6fgdA-2b5uA:
undetectable		 6fgdA-2b5uA:
21.42
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.
2ckc CHROMODOMAIN-HELICAS
E-DNA-BINDING
PROTEIN 7

(Homo sapiens) 		PF07533
(BRK) 		3 LYS A2611
VAL A2609
ASP A2614
 None
 0.51A 6fgdA-2ckcA:
undetectable		 6fgdA-2ckcA:
11.06
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.
2dpg GLUCOSE 6-PHOSPHATE
DEHYDROGENASE

(Leuconostoc
mesenteroides) 		PF00479
(G6PD_N)
PF02781
(G6PD_C) 		3 LYS A 408
VAL A 403
ASP A 405
 None
 0.50A 6fgdA-2dpgA:
2.8		 6fgdA-2dpgA:
23.00
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.
2f8q ALKALINE
THERMOSTABLE
ENDOXYLANASE

(Bacillus sp.
NG-27) 		PF00331
(Glyco_hydro_10) 		3 LYS A 204
VAL A 151
ASP A 153
 None
 0.70A 6fgdA-2f8qA:
undetectable		 6fgdA-2f8qA:
23.34
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.
2g5d GNA33

(Neisseria
gonorrhoeae) 		PF03562
(MltA)
PF06725
(3D) 		3 LYS A 436
VAL A  54
ASP A  48
 None
 0.70A 6fgdA-2g5dA:
undetectable		 6fgdA-2g5dA:
23.73
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.
2gc1 GLUCOSE-6-PHOSPHATE
ISOMERASE

(Pyrococcus
furiosus) 		PF06560
(GPI) 		3 LYS A 170
VAL A 181
ASP A 183
 None
 0.55A 6fgdA-2gc1A:
undetectable		 6fgdA-2gc1A:
19.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2h9f HYPOTHETICAL PROTEIN

(Pseudomonas
aeruginosa) 		PF04303
(PrpF) 		3 LYS A 210
VAL A 198
ASP A 200
 None
 0.21A 6fgdA-2h9fA:
undetectable		 6fgdA-2h9fA:
25.91
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.
2ivp O-SIALOGLYCOPROTEIN
ENDOPEPTIDASE

(Pyrococcus
abyssi) 		PF00814
(Peptidase_M22) 		3 LYS A 245
VAL A 124
ASP A 122
 None
 0.56A 6fgdA-2ivpA:
undetectable		 6fgdA-2ivpA:
21.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jwp MALECTIN

(Xenopus laevis) 		PF11721
(Malectin) 		3 LYS A 113
VAL A 101
ASP A 103
 None
 0.71A 6fgdA-2jwpA:
undetectable		 6fgdA-2jwpA:
18.38
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.
2mvb UNCHARACTERIZED
PROTEIN

(Streptococcus
pneumoniae) 		no annotation 3 LYS A  69
VAL A  64
ASP A  66
 None
 0.63A 6fgdA-2mvbA:
undetectable		 6fgdA-2mvbA:
18.16
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.
2mvz PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE

(Geobacillus
kaustophilus) 		PF00160
(Pro_isomerase) 		3 LYS A   3
VAL A 142
ASP A 144
 None
 0.50A 6fgdA-2mvzA:
undetectable		 6fgdA-2mvzA:
16.11
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.
2okk GLUTAMATE
DECARBOXYLASE 2

(Homo sapiens) 		PF00282
(Pyridoxal_deC) 		3 LYS A 454
VAL A 400
ASP A 194
 None
 0.51A 6fgdA-2okkA:
2.2		 6fgdA-2okkA:
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.
2oqz SORTASE B

(Bacillus
anthracis) 		PF04203
(Sortase) 		3 LYS A 249
VAL A 251
ASP A 225
 None
 0.70A 6fgdA-2oqzA:
undetectable		 6fgdA-2oqzA:
20.71
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.
2qe8 UNCHARACTERIZED
PROTEIN

(Trichormus
variabilis) 		PF03022
(MRJP) 		3 LYS A  93
VAL A  91
ASP A  83
 None
 0.70A 6fgdA-2qe8A:
undetectable		 6fgdA-2qe8A:
23.43
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.
2r5k MAJOR CAPSID PROTEIN
L1

(Alphapapillomavirus
10) 		PF00500
(Late_protein_L1) 		3 LYS A 227
VAL A 225
ASP A 196
 None
 0.64A 6fgdA-2r5kA:
undetectable		 6fgdA-2r5kA:
24.19
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.
2ra1 SURFACE LAYER
PROTEIN

(Geobacillus
stearothermophilus) 		PF13205
(Big_5) 		3 LYS A 242
VAL A 237
ASP A 239
 None
 0.58A 6fgdA-2ra1A:
undetectable		 6fgdA-2ra1A:
22.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2v7b BENZOATE-COENZYME A
LIGASE

(Paraburkholderia
xenovorans) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		3 LYS A 413
VAL A 378
ASP A 380
 None
 0.28A 6fgdA-2v7bA:
3.5		 6fgdA-2v7bA:
22.88
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.
2vp3 VP39

(Vaccinia virus) 		PF01358
(PARP_regulatory) 		3 LYS A 246
VAL A   4
ASP A   2
 None
 0.60A 6fgdA-2vp3A:
undetectable		 6fgdA-2vp3A:
23.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wbp L-ARGININE
BETA-HYDROXYLASE

(Streptomyces
vinaceus) 		PF02668
(TauD) 		3 LYS A 333
VAL A 143
ASP A 145
 None
 0.49A 6fgdA-2wbpA:
undetectable		 6fgdA-2wbpA:
23.33
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.
2zc8 N-ACYLAMINO ACID
RACEMASE

(Thermus
thermophilus) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 LYS A 113
VAL A 345
ASP A 109
 None
 0.70A 6fgdA-2zc8A:
3.2		 6fgdA-2zc8A:
24.03
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.
2zu0 PROTEIN SUFD

(Escherichia
coli) 		PF01458
(UPF0051) 		3 LYS A 150
VAL A  84
ASP A  82
 None
 0.54A 6fgdA-2zu0A:
undetectable		 6fgdA-2zu0A:
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.
3dh9 THIOREDOXIN
REDUCTASE 1

(Drosophila
melanogaster) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		3 LYS A 260
VAL A 277
ASP A 279
 None
 0.32A 6fgdA-3dh9A:
3.8		 6fgdA-3dh9A:
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.
3e8t TAKEOUT-LIKE PROTEIN
1

(Epiphyas
postvittana) 		PF06585
(JHBP) 		3 LYS A  62
VAL A  41
ASP A  43
 None
 0.63A 6fgdA-3e8tA:
undetectable		 6fgdA-3e8tA:
18.96
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.
3ec3 PROTEIN
DISULFIDE-ISOMERASE
A4

(Rattus
norvegicus) 		PF13848
(Thioredoxin_6) 		3 LYS A 352
VAL A 371
ASP A 373
 None
 0.61A 6fgdA-3ec3A:
2.5		 6fgdA-3ec3A:
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.
3eef N-CARBAMOYLSARCOSINE
AMIDASE RELATED
PROTEIN

(Thermoplasma
acidophilum) 		PF00857
(Isochorismatase) 		3 LYS A  90
VAL A  48
ASP A  50
 None
None
ZN  A 183 (-2.6A)
 0.63A 6fgdA-3eefA:
2.3		 6fgdA-3eefA:
20.10
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.
3eno PUTATIVE
O-SIALOGLYCOPROTEIN
ENDOPEPTIDASE

(Thermoplasma
acidophilum) 		PF00814
(Peptidase_M22) 		3 LYS A 245
VAL A 125
ASP A 123
 None
 0.58A 6fgdA-3enoA:
undetectable		 6fgdA-3enoA:
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.
3ez4 3-METHYL-2-OXOBUTANO
ATE
HYDROXYMETHYLTRANSFE
RASE

(Burkholderia
pseudomallei) 		PF02548
(Pantoate_transf) 		3 LYS A 110
VAL A  80
ASP A  82
 None
 0.62A 6fgdA-3ez4A:
undetectable		 6fgdA-3ez4A:
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.
3frn FLAGELLAR PROTEIN
FLGA

(Thermotoga
maritima) 		PF13144
(ChapFlgA) 		3 LYS A 202
VAL A 219
ASP A 221
 None
 0.56A 6fgdA-3frnA:
undetectable		 6fgdA-3frnA:
22.58
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.
3ge2 LIPOPROTEIN,
PUTATIVE

(Streptococcus
pneumoniae) 		PF12182
(DUF3642) 		3 LYS A 127
VAL A 138
ASP A 140
 GOL  A 203 ( 3.0A)
None
GOL  A 203 (-3.6A)
 0.45A 6fgdA-3ge2A:
undetectable		 6fgdA-3ge2A:
16.14
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.
3gqi PHOSPHOLIPASE
C-GAMMA-1

(Rattus
norvegicus) 		PF00017
(SH2) 		3 LYS B 620
VAL B 628
ASP B 630
 None
 0.68A 6fgdA-3gqiB:
undetectable		 6fgdA-3gqiB:
19.23
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.
3jaz VIRAL STRUCTURAL
PROTEIN 5

(Cypovirus 1) 		no annotation 3 LYS D  47
VAL D  45
ASP D 151
 None
 0.65A 6fgdA-3jazD:
undetectable		 6fgdA-3jazD:
23.81
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.
3k4z GLYCOSIDE HYDROLASE
FAMILY 9

(Ruminiclostridium
thermocellum) 		PF02018
(CBM_4_9)
PF02927
(CelD_N) 		3 LYS A  54
VAL A  44
ASP A  46
 None
 0.44A 6fgdA-3k4zA:
undetectable		 6fgdA-3k4zA:
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.
3k6c UNCHARACTERIZED
PROTEIN NE0167

(Nitrosomonas
europaea) 		no annotation 3 LYS A  61
VAL A  34
ASP A  58
 None
 0.68A 6fgdA-3k6cA:
undetectable		 6fgdA-3k6cA:
11.46
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.
3kv6 JMJC
DOMAIN-CONTAINING
HISTONE
DEMETHYLATION
PROTEIN 1D

(Homo sapiens) 		PF00628
(PHD)
PF02373
(JmjC) 		3 LYS A 204
VAL A 191
ASP A 193
 None
 0.37A 6fgdA-3kv6A:
undetectable		 6fgdA-3kv6A:
22.31
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.
3l3f PROTEIN DOA1

(Saccharomyces
cerevisiae) 		PF08324
(PUL)
PF09070
(PFU) 		3 LYS X 401
VAL X 388
ASP X 390
 None
 0.38A 6fgdA-3l3fX:
undetectable		 6fgdA-3l3fX:
23.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lim FRAGACEATOXIN C

(Actinia
fragacea) 		PF06369
(Anemone_cytotox) 		3 LYS A  69
VAL A   8
ASP A  10
 None
 0.52A 6fgdA-3limA:
undetectable		 6fgdA-3limA:
17.32
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.
3o5t PII-LIKE PROTEIN PZ

(Azospirillum
brasilense) 		PF00543
(P-II) 		3 LYS B   2
VAL B  93
ASP B  95
 None
 0.71A 6fgdA-3o5tB:
undetectable		 6fgdA-3o5tB:
13.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3p6b CELLULOSE
1,4-BETA-CELLOBIOSID
ASE

(Ruminiclostridium
thermocellum) 		PF02018
(CBM_4_9) 		3 LYS A  74
VAL A  64
ASP A  66
 None
 0.42A 6fgdA-3p6bA:
undetectable		 6fgdA-3p6bA:
18.14
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.
3pst PROTEIN DOA1

(Saccharomyces
cerevisiae) 		PF08324
(PUL)
PF09070
(PFU) 		3 LYS A 401
VAL A 388
ASP A 390
 None
 0.33A 6fgdA-3pstA:
undetectable		 6fgdA-3pstA:
22.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3uaj ENVELOPE PROTEIN

(Dengue virus) 		no annotation 3 LYS B 110
VAL B  96
ASP B  98
 None
 0.70A 6fgdA-3uajB:
undetectable		 6fgdA-3uajB:
20.79
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.
3vss BETA-FRUCTOFURANOSID
ASE

(Microbacterium
saccharophilum) 		PF02435
(Glyco_hydro_68) 		3 LYS A 384
VAL A 410
ASP A 412
 None
 0.53A 6fgdA-3vssA:
undetectable		 6fgdA-3vssA:
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.
3zlb PHOSPHOGLYCERATE
KINASE

(Streptococcus
pneumoniae) 		PF00162
(PGK) 		3 LYS A 271
VAL A 282
ASP A 284
 None
 0.58A 6fgdA-3zlbA:
2.2		 6fgdA-3zlbA:
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.
4bop OTU
DOMAIN-CONTAINING
PROTEIN 1

(Homo sapiens) 		PF02338
(OTU) 		3 LYS A 309
VAL A 435
ASP A 437
 None
 0.67A 6fgdA-4bopA:
undetectable		 6fgdA-4bopA:
14.70
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.
4chb KELCH-LIKE PROTEIN 2

(Homo sapiens) 		PF01344
(Kelch_1) 		3 LYS A 307
VAL A 588
ASP A 590
 None
 0.32A 6fgdA-4chbA:
undetectable		 6fgdA-4chbA:
23.08
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.
4d47 LEVANSUCRASE

(Erwinia
amylovora) 		PF02435
(Glyco_hydro_68) 		3 LYS A 297
VAL A 323
ASP A 325
 None
 0.61A 6fgdA-4d47A:
undetectable		 6fgdA-4d47A:
23.59
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.
4fg0 POLYPROTEIN

(Saint Louis
encephalitis
virus) 		PF00869
(Flavi_glycoprot)
PF02832
(Flavi_glycop_C) 		3 LYS A 110
VAL A  96
ASP A  98
 None
 0.63A 6fgdA-4fg0A:
undetectable		 6fgdA-4fg0A:
20.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fx5 VON WILLEBRAND
FACTOR TYPE A

(Catenulispora
acidiphila) 		PF13768
(VWA_3) 		3 LYS A 318
VAL A 316
ASP A 240
 None
 0.71A 6fgdA-4fx5A:
3.7		 6fgdA-4fx5A:
23.21
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.
4lgl GLYCINE
DEHYDROGENASE
[DECARBOXYLATING]

(Synechocystis
sp. PCC 6803) 		PF02347
(GDC-P) 		3 LYS A 550
VAL A  99
ASP A 110
 None
 0.71A 6fgdA-4lglA:
3.7		 6fgdA-4lglA:
19.22
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.
4lut ALANINE RACEMASE

(Clostridioides
difficile) 		PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N) 		3 LYS A 299
VAL A 306
ASP A 308
 None
 0.63A 6fgdA-4lutA:
undetectable		 6fgdA-4lutA:
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.
4m1x UNCHARACTERIZED
PROTEIN
201PHI2-1P060

(Pseudomonas
phage 201phi2-1) 		no annotation 3 LYS A  93
VAL A  74
ASP A  72
 None
 0.64A 6fgdA-4m1xA:
undetectable		 6fgdA-4m1xA:
12.73
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.
4m2g L-ARGININE
BETA-HYDROXYLASE

(Streptomyces
lavendulae) 		PF02668
(TauD) 		3 LYS A 320
VAL A 129
ASP A 131
 None
 0.45A 6fgdA-4m2gA:
undetectable		 6fgdA-4m2gA:
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.
4n0g PROTEIN PHOSPHATASE
2C 37

(Arabidopsis
thaliana) 		PF00481
(PP2C) 		3 LYS A 233
VAL A 312
ASP A 314
 None
 0.67A 6fgdA-4n0gA:
undetectable		 6fgdA-4n0gA:
21.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4o48 UNCHARACTERIZED
PROTEIN

(Cavia porcellus) 		PF01112
(Asparaginase_2) 		3 LYS A 293
VAL A 305
ASP A 307
 None
 0.61A 6fgdA-4o48A:
undetectable		 6fgdA-4o48A:
21.86
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4u90 GEPHYRIN

(Rattus
norvegicus) 		PF00994
(MoCF_biosynth)
PF03453
(MoeA_N)
PF03454
(MoeA_C) 		3 LYS A 658
VAL A 727
ASP A 729
 None
 0.50A 6fgdA-4u90A:
50.7		 6fgdA-4u90A:
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.
4uu2 FERULIC ACID
DECARBOXYLASE

(Enterobacter
sp.) 		PF05870
(PA_decarbox) 		3 LYS A  15
VAL A 141
ASP A 143
 None
 0.68A 6fgdA-4uu2A:
undetectable		 6fgdA-4uu2A:
15.95
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.
4wgx MOLINATE HYDROLASE

(Gulosibacter
molinativorax) 		PF01979
(Amidohydro_1) 		3 LYS A  56
VAL A 418
ASP A 420
 None
 0.65A 6fgdA-4wgxA:
undetectable		 6fgdA-4wgxA:
22.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4x9u KIWELLIN

(Actinidia
deliciosa) 		no annotation 3 LYS A  77
VAL A 181
ASP A 183
 None
 0.49A 6fgdA-4x9uA:
undetectable		 6fgdA-4x9uA:
18.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xb3 GLUCAN
1,6-ALPHA-GLUCOSIDAS
E

(Streptococcus
mutans) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		3 LYS A 270
VAL A 279
ASP A 277
 None
 0.65A 6fgdA-4xb3A:
undetectable		 6fgdA-4xb3A:
22.01
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.
4xfj ARGININOSUCCINATE
SYNTHASE

(Mycolicibacterium
thermoresistibile) 		PF00764
(Arginosuc_synth) 		3 LYS A 267
VAL A 259
ASP A 261
 None
 0.35A 6fgdA-4xfjA:
2.3		 6fgdA-4xfjA:
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.
4yrd CAPSULAR
POLYSACCHARIDE
SYNTHESIS ENZYME
CAP5F

(Staphylococcus
aureus) 		PF01370
(Epimerase) 		3 LYS A 296
VAL A 328
ASP A 330
 None
 0.70A 6fgdA-4yrdA:
3.3		 6fgdA-4yrdA:
23.29
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.
4yry DIHYDROOROTATE
DEHYDROGENASE B
(NAD(+)), ELECTRON
TRANSFER SUBUNIT
HOMOLOG

(Thermotoga
maritima) 		PF00175
(NAD_binding_1)
PF00970
(FAD_binding_6)
PF10418
(DHODB_Fe-S_bind) 		3 LYS A  69
VAL A  71
ASP A  18
 NAD  A 503 ( 3.3A)
FAD  A 502 (-4.8A)
None
 0.52A 6fgdA-4yryA:
3.1		 6fgdA-4yryA:
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.
4zm6 N-ACETYL-BETA-D
GLUCOSAMINIDASE

(Rhizomucor
miehei) 		PF00583
(Acetyltransf_1)
PF00933
(Glyco_hydro_3) 		3 LYS A 585
VAL A 541
ASP A 543
 None
 0.22A 6fgdA-4zm6A:
5.1		 6fgdA-4zm6A:
18.84
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.
5b2h HA-33

(Clostridium
botulinum) 		PF14200
(RicinB_lectin_2) 		3 LYS A 252
VAL A 269
ASP A 271
 None
 0.58A 6fgdA-5b2hA:
undetectable		 6fgdA-5b2hA:
20.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5cxp POSSIBLE XYLAN
DEGRADATION ENZYME
(GLYCOSYL HYDROLASE
FAMILY 30-LIKE
DOMAIN AND RICIN
B-LIKE DOMAIN)

(Clostridium
acetobutylicum) 		PF02055
(Glyco_hydro_30) 		3 LYS A 321
VAL A 386
ASP A 388
 None
NA  A 605 (-4.6A)
None
 0.55A 6fgdA-5cxpA:
undetectable		 6fgdA-5cxpA:
23.76
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.
5cyb LIPOPROTEIN

(Streptococcus
pneumoniae) 		PF12182
(DUF3642) 		3 LYS A 126
VAL A 137
ASP A 139
 GOL  A 201 ( 3.2A)
None
CA  A 205 ( 4.9A)
 0.60A 6fgdA-5cybA:
undetectable		 6fgdA-5cybA:
17.92
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.
5d4o NITROGEN REGULATORY
PROTEIN P-II

(Thiomonas
intermedia) 		PF00543
(P-II) 		3 LYS A  10
VAL A  95
ASP A  97
 None
 0.46A 6fgdA-5d4oA:
undetectable		 6fgdA-5d4oA:
16.18
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.
5dzz DESMOPLAKIN

(Homo sapiens) 		PF00681
(Plectin) 		3 LYS A1974
VAL A1967
ASP A1969
 None
 0.51A 6fgdA-5dzzA:
undetectable		 6fgdA-5dzzA:
22.91
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.
5e31 PENICILLIN BINDING
PROTEIN 2 PRIME

(Enterococcus
faecium) 		PF00905
(Transpeptidase)
PF03717
(PBP_dimer)
PF05223
(MecA_N) 		3 LYS A 297
VAL A 278
ASP A 280
 None
 0.29A 6fgdA-5e31A:
undetectable		 6fgdA-5e31A:
21.49
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.
5g3p FORMAMIDASE

(Bacillus cereus) 		PF00795
(CN_hydrolase) 		3 LYS A 159
VAL A 151
ASP A 153
 None
 0.64A 6fgdA-5g3pA:
undetectable		 6fgdA-5g3pA:
22.76
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.
5gw5 T-COMPLEX PROTEIN 1
SUBUNIT THETA

(Saccharomyces
cerevisiae) 		PF00118
(Cpn60_TCP1) 		3 LYS q 497
VAL q 509
ASP q 511
 None
 0.42A 6fgdA-5gw5q:
undetectable		 6fgdA-5gw5q:
23.01
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.
5jri PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE

(Synechocystis
sp. PCC 6803) 		no annotation 3 LYS A 125
VAL A  19
ASP A  21
 SO4  A 404 (-4.4A)
None
None
 0.70A 6fgdA-5jriA:
4.9		 6fgdA-5jriA:
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.
5jvk UNCHARACTERIZED
PROTEIN

(Bacteroides
cellulosilyticus) 		no annotation 3 LYS A  50
VAL A  88
ASP A  90
 None
 0.44A 6fgdA-5jvkA:
undetectable		 6fgdA-5jvkA:
23.11
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.
5k8f ACETYL-COENZYME A
SYNTHETASE

(Cryptococcus
neoformans) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C)
PF16177
(ACAS_N) 		3 LYS A 226
VAL A 252
ASP A 230
 None
 0.54A 6fgdA-5k8fA:
4.5		 6fgdA-5k8fA:
20.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5kzl HEME OXYGENASE

(Leptospira
interrogans) 		PF01126
(Heme_oxygenase) 		3 LYS A 184
VAL A 179
ASP A 181
 None
 0.58A 6fgdA-5kzlA:
undetectable		 6fgdA-5kzlA:
17.84
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.
5mp7 RIBOSE-PHOSPHATE
PYROPHOSPHOKINASE

(Mycolicibacterium
smegmatis) 		PF13793
(Pribosyltran_N)
PF14572
(Pribosyl_synth) 		3 LYS A 224
VAL A 173
ASP A 171
 None
 0.62A 6fgdA-5mp7A:
undetectable		 6fgdA-5mp7A:
24.43
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.
5mqp GLYCOSIDE HYDROLASE
BT_1002

(Bacteroides
thetaiotaomicron) 		no annotation 3 LYS A 272
VAL A 123
ASP A 125
 None
 0.62A 6fgdA-5mqpA:
undetectable		 6fgdA-5mqpA:
21.86
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.
5msx PUTATIVE
ENDO-1,4-BETA-XYLANA
SE

(Bacteroides
thetaiotaomicron) 		PF00754
(F5_F8_type_C)
PF04616
(Glyco_hydro_43) 		3 LYS A 104
VAL A 119
ASP A 121
 None
 0.66A 6fgdA-5msxA:
undetectable		 6fgdA-5msxA:
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.
5n2g DNA POLYMERASE

(Vaccinia virus) 		no annotation 3 LYS A  62
VAL A  85
ASP A  87
 None
 0.65A 6fgdA-5n2gA:
undetectable		 6fgdA-5n2gA:
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.
5tqr POLYCOMB PROTEIN EED

(Chaetomium
thermophilum) 		PF00400
(WD40) 		3 LYS A 408
VAL A 383
ASP A 385
 None
 0.45A 6fgdA-5tqrA:
undetectable		 6fgdA-5tqrA:
21.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5umh CATECHOL
1,2-DIOXYGENASE

(Burkholderia
multivorans) 		PF00775
(Dioxygenase_C)
PF04444
(Dioxygenase_N) 		3 LYS A 282
VAL A 265
ASP A 267
 None
 0.56A 6fgdA-5umhA:
undetectable		 6fgdA-5umhA:
22.54
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.
5w0s 60 KDA CHAPERONIN

(Escherichia
coli) 		PF00118
(Cpn60_TCP1) 		3 LYS A   4
VAL A 521
ASP A 523
 None
 0.59A 6fgdA-5w0sA:
undetectable		 6fgdA-5w0sA:
23.27
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.
5wc3 SPOIIIAG, STAGE III
SPORULATION
ENGULFMENT
ASSEMBLYPROTEIN

(Bacillus
subtilis) 		no annotation 3 LYS A 224
VAL A 189
ASP A 116
 None
 0.55A 6fgdA-5wc3A:
undetectable		 6fgdA-5wc3A:
19.71
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.
5xav INTRACELLULAR
POLYHYDROXYALKANOATE
SYNTHASE

(Chromobacterium
sp. USM2) 		PF07167
(PhaC_N) 		3 LYS A 221
VAL A 397
ASP A 395
 None
 0.65A 6fgdA-5xavA:
2.4		 6fgdA-5xavA:
22.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5yfb DIPEPTIDYL PEPTIDASE
3

(Armillaria
tabescens) 		no annotation 3 LYS A 238
VAL A 227
ASP A 229
 None
 0.54A 6fgdA-5yfbA:
undetectable		 6fgdA-5yfbA:
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.
6cjq -

(-) 		no annotation 3 LYS A 114
VAL A 118
ASP A  84
 None
 0.68A 6fgdA-6cjqA:
undetectable		 6fgdA-6cjqA:
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.
6daw NON-HEME IRON
HYDROXYLASE

(Streptomyces
lusitanus) 		no annotation 3 LYS A 310
VAL A 122
ASP A 124
 None
 0.38A 6fgdA-6dawA:
undetectable		 6fgdA-6dawA:
undetectable