SIMILAR PATTERNS OF AMINO ACIDS FOR 3KO0_S_TFPS202_2

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.
1c2y PROTEIN (LUMAZINE
SYNTHASE)

(Spinacia
oleracea) 		PF00885
(DMRL_synthase) 		3 GLU A  33
LEU A  36
ASP A  37
 None
 0.32A 3ko0T-1c2yA:
undetectable		 3ko0T-1c2yA:
20.86
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.
1kcz BETA-METHYLASPARTASE

(Clostridium
tetanomorphum) 		PF05034
(MAAL_N)
PF07476
(MAAL_C) 		3 GLU A 294
LEU A 291
ASP A 290
 None
 0.39A 3ko0T-1kczA:
undetectable		 3ko0T-1kczA:
13.08
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.
1l1j HEAT SHOCK PROTEASE
HTRA

(Thermotoga
maritima) 		PF13365
(Trypsin_2) 		3 GLU A 125
LEU A 126
ASP A 127
 None
 0.42A 3ko0T-1l1jA:
undetectable		 3ko0T-1l1jA:
16.31
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.
1obb ALPHA-GLUCOSIDASE

(Thermotoga
maritima) 		PF02056
(Glyco_hydro_4)
PF11975
(Glyco_hydro_4C) 		3 GLU A 343
LEU A 346
ASP A 347
 None
 0.14A 3ko0T-1obbA:
undetectable		 3ko0T-1obbA:
12.19
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.
1rw2 ATP-DEPENDENT DNA
HELICASE II, 80 KDA
SUBUNIT

(Homo sapiens) 		PF08785
(Ku_PK_bind) 		3 GLU A  63
LEU A  66
ASP A  67
 None
 0.25A 3ko0T-1rw2A:
undetectable		 3ko0T-1rw2A:
20.13
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.
1tdh NEI ENDONUCLEASE
VIII-LIKE 1

(Homo sapiens) 		PF01149
(Fapy_DNA_glyco)
PF06831
(H2TH)
PF09292
(Neil1-DNA_bind) 		3 GLU A 163
LEU A 166
ASP A 167
 None
 0.39A 3ko0T-1tdhA:
undetectable		 3ko0T-1tdhA:
14.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1vjk MOLYBDOPTERIN
CONVERTING FACTOR,
SUBUNIT 1

(Pyrococcus
furiosus) 		PF02597
(ThiS) 		3 GLU A  37
LEU A  34
ASP A  33
 None
 0.43A 3ko0T-1vjkA:
undetectable		 3ko0T-1vjkA:
18.00
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.
1vki HYPOTHETICAL PROTEIN
ATU3699

(Agrobacterium
fabrum) 		PF04073
(tRNA_edit) 		3 GLU A  67
LEU A 127
ASP A 126
 None
 0.40A 3ko0T-1vkiA:
undetectable		 3ko0T-1vkiA:
18.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wgn UBIQUITIN ASSOCIATED
PROTEIN

(Homo sapiens) 		no annotation 3 GLU A  48
LEU A  51
ASP A  52
 None
 0.18A 3ko0T-1wgnA:
undetectable		 3ko0T-1wgnA:
21.50
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.
2a9u UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE 8

(Homo sapiens) 		PF08969
(USP8_dimer) 		3 GLU A  49
LEU A  52
ASP A  53
 None
 0.30A 3ko0T-2a9uA:
undetectable		 3ko0T-2a9uA:
25.78
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.
2bnh RIBONUCLEASE
INHIBITOR

(Sus scrofa) 		PF13516
(LRR_6) 		3 GLU A 130
LEU A 133
ASP A 134
 None
 0.26A 3ko0T-2bnhA:
undetectable		 3ko0T-2bnhA:
13.14
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.
2d2s EXOCYST COMPLEX
COMPONENT EXO84

(Saccharomyces
cerevisiae) 		PF16528
(Exo84_C) 		3 GLU A 557
LEU A 560
ASP A 561
 None
 0.39A 3ko0T-2d2sA:
undetectable		 3ko0T-2d2sA:
19.65
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.
2dzd PYRUVATE CARBOXYLASE

(Geobacillus
thermodenitrificans) 		PF00289
(Biotin_carb_N)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		3 GLU A 112
LEU A 115
ASP A 116
 None
 0.41A 3ko0T-2dzdA:
undetectable		 3ko0T-2dzdA:
13.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2e9f ARGININOSUCCINATE
LYASE

(Thermus
thermophilus) 		PF00206
(Lyase_1)
PF14698
(ASL_C2) 		3 GLU A 329
LEU A 332
ASP A 333
 None
 0.21A 3ko0T-2e9fA:
0.8		 3ko0T-2e9fA:
12.69
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.
2gmu PUTATIVE
PYRIDOXAMINE
5-PHOSPHATE-DEPENDEN
T DEHYDRASE, WBDK

(Escherichia
coli) 		PF01041
(DegT_DnrJ_EryC1) 		3 GLU A 278
LEU A 281
ASP A 282
 None
 0.37A 3ko0T-2gmuA:
undetectable		 3ko0T-2gmuA:
14.50
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.
2i10 PUTATIVE TETR
TRANSCRIPTIONAL
REGULATOR

(Rhodococcus
jostii) 		PF00440
(TetR_N) 		3 GLU A  58
LEU A  61
ASP A  62
 None
 0.42A 3ko0T-2i10A:
undetectable		 3ko0T-2i10A:
16.92
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.
2j1d DISHEVELED-ASSOCIATE
D ACTIVATOR OF
MORPHOGENESIS 1

(Homo sapiens) 		PF02181
(FH2) 		3 GLU G 746
LEU G 743
ASP G 742
 None
 0.40A 3ko0T-2j1dG:
undetectable		 3ko0T-2j1dG:
14.21
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.
2j5b TYROSYL-TRNA
SYNTHETASE

(Acanthamoeba
polyphaga
mimivirus) 		PF00579
(tRNA-synt_1b) 		3 GLU A 125
LEU A 128
ASP A 129
 GLU  A 125 ( 0.6A)
LEU  A 128 ( 0.6A)
ASP  A 129 ( 0.6A)
 0.24A 3ko0T-2j5bA:
undetectable		 3ko0T-2j5bA:
13.22
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.
2khz C-MYC-RESPONSIVE
PROTEIN RCL

(Rattus
norvegicus) 		PF05014
(Nuc_deoxyrib_tr) 		3 GLU A 140
LEU A 143
ASP A 144
 None
 0.40A 3ko0T-2khzA:
undetectable		 3ko0T-2khzA:
20.25
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.
2l6c THIOREDOXIN

(Desulfovibrio
vulgaris) 		PF00085
(Thioredoxin) 		3 GLU A  38
LEU A  41
ASP A  42
 None
 0.34A 3ko0T-2l6cA:
undetectable		 3ko0T-2l6cA:
21.09
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.
2lse FOUR HELIX BUNDLE
PROTEIN

(synthetic
construct) 		no annotation 3 GLU A  13
LEU A  16
ASP A  17
 None
 0.40A 3ko0T-2lseA:
undetectable		 3ko0T-2lseA:
20.91
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.
2mn2 YMOB

(Yersinia
enterocolitica) 		PF10757
(YbaJ) 		3 GLU A  77
LEU A  80
ASP A  81
 None
 0.42A 3ko0T-2mn2A:
undetectable		 3ko0T-2mn2A:
21.74
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.
2o7r CXE CARBOXYLESTERASE

(Actinidia
eriantha) 		PF07859
(Abhydrolase_3) 		3 GLU A 232
LEU A 229
ASP A 228
 None
 0.40A 3ko0T-2o7rA:
undetectable		 3ko0T-2o7rA:
16.00
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.
2pn1 CARBAMOYLPHOSPHATE
SYNTHASE LARGE
SUBUNIT

(Exiguobacterium
sibiricum) 		PF02655
(ATP-grasp_3) 		3 GLU A 239
LEU A 242
ASP A 243
 None
 0.43A 3ko0T-2pn1A:
undetectable		 3ko0T-2pn1A:
16.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pod MANDELATE RACEMASE /
MUCONATE LACTONIZING
ENZYME

(Burkholderia
pseudomallei) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 GLU A 160
LEU A 163
ASP A 164
 None
 0.31A 3ko0T-2podA:
undetectable		 3ko0T-2podA:
12.90
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.
2rae TRANSCRIPTIONAL
REGULATOR, ACRR
FAMILY PROTEIN

(Rhodococcus
jostii) 		PF00440
(TetR_N) 		3 GLU A 172
LEU A 175
ASP A 176
 None
 0.30A 3ko0T-2raeA:
undetectable		 3ko0T-2raeA:
16.75
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.
2rvj EPITHELIAL SPLICING
REGULATORY PROTEIN 1

(Homo sapiens) 		PF00076
(RRM_1) 		3 GLU A 459
LEU A 462
ASP A 463
 None
 0.34A 3ko0T-2rvjA:
undetectable		 3ko0T-2rvjA:
23.58
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.
2tmk THYMIDYLATE KINASE

(Saccharomyces
cerevisiae) 		PF02223
(Thymidylate_kin) 		3 GLU A 171
LEU A 168
ASP A 169
 None
 0.44A 3ko0T-2tmkA:
undetectable		 3ko0T-2tmkA:
19.25
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.
2wbn TERMINASE LARGE
SUBUNIT

(Bacillus phage
SPP1) 		PF17288
(Terminase_3C) 		3 GLU A 354
LEU A 357
ASP A 358
 None
 0.13A 3ko0T-2wbnA:
undetectable		 3ko0T-2wbnA:
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.
2wsb GALACTITOL
DEHYDROGENASE

(Rhodobacter
sphaeroides) 		PF13561
(adh_short_C2) 		3 GLU A 208
LEU A 211
ASP A 212
 None
 0.43A 3ko0T-2wsbA:
undetectable		 3ko0T-2wsbA:
15.75
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.
2xh3 SPD1 NUCLEASE

(Streptococcus
pyogenes) 		PF13930
(Endonuclea_NS_2) 		3 GLU A 164
LEU A 167
ASP A 168
 None
 0.20A 3ko0T-2xh3A:
undetectable		 3ko0T-2xh3A:
15.12
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.
2z7e NIFU-LIKE PROTEIN

(Aquifex
aeolicus) 		PF01592
(NifU_N) 		3 GLU A   7
LEU A  10
ASP A  11
 None
 0.24A 3ko0T-2z7eA:
undetectable		 3ko0T-2z7eA:
20.24
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.
2zc4 PENICILLIN-BINDING
PROTEIN 2X

(Streptococcus
pneumoniae) 		PF03793
(PASTA) 		3 GLU C 652
LEU C 649
ASP C 648
 None
 0.43A 3ko0T-2zc4C:
undetectable		 3ko0T-2zc4C:
27.82
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.
3bt7 TRNA
(URACIL-5-)-METHYLTR
ANSFERASE

(Escherichia
coli) 		PF05958
(tRNA_U5-meth_tr) 		3 GLU A 201
LEU A 204
ASP A 205
 None
 0.25A 3ko0T-3bt7A:
undetectable		 3ko0T-3bt7A:
13.93
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.
3c90 PHOSPHORIBOSYL-ATP
PYROPHOSPHATASE

(Mycobacterium
tuberculosis) 		no annotation 3 GLU X  16
LEU X  13
ASP X  12
 None
 0.38A 3ko0T-3c90X:
undetectable		 3ko0T-3c90X:
20.39
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.
3crl DIHYDROLIPOYLLYSINE-
RESIDUE
ACETYLTRANSFERASE
COMPONENT OF
PYRUVATE
DEHYDROGENASE
COMPLEX,
MITOCHONDRIAL

(Homo sapiens) 		PF00364
(Biotin_lipoyl) 		3 GLU C 179
LEU C 165
ASP C 164
 None
 0.41A 3ko0T-3crlC:
undetectable		 3ko0T-3crlC:
22.86
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.
3dra PROTEIN
FARNESYLTRANSFERASE/
GERANYLGERANYLTRANSF
ERASE TYPE-1 SUBUNIT
ALPHA

(Candida
albicans) 		PF01239
(PPTA) 		3 GLU A  94
LEU A  97
ASP A  98
 None
 0.20A 3ko0T-3draA:
undetectable		 3ko0T-3draA:
13.20
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.
3e6a GLYCERALDEHYDE-3-PHO
SPHATE
DEHYDROGENASE,
CYTOSOLIC

(Oryza sativa) 		no annotation 3 GLU O 139
LEU O 329
ASP O 328
 None
 0.41A 3ko0T-3e6aO:
undetectable		 3ko0T-3e6aO:
14.37
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.
3eoo METHYLISOCITRATE
LYASE

(Burkholderia
pseudomallei) 		PF13714
(PEP_mutase) 		3 GLU A 285
LEU A 288
ASP A 289
 None
 0.41A 3ko0T-3eooA:
undetectable		 3ko0T-3eooA:
17.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fd9 UNCHARACTERIZED
PROTEIN

(Pseudomonas
aeruginosa) 		PF16806
(ExsD) 		3 GLU A 132
LEU A 135
ASP A 136
 None
 0.35A 3ko0T-3fd9A:
undetectable		 3ko0T-3fd9A:
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.
3g6i PUTATIVE OUTER
MEMBRANE PROTEIN,
PART OF CARBOHYDRATE
BINDING COMPLEX

(Bacteroides
thetaiotaomicron) 		PF12875
(DUF3826) 		3 GLU A 145
LEU A 148
ASP A 149
 None
 0.19A 3ko0T-3g6iA:
undetectable		 3ko0T-3g6iA:
18.32
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.
3k2q PYROPHOSPHATE-DEPEND
ENT
PHOSPHOFRUCTOKINASE

(Marinobacter
hydrocarbonoclasticus) 		PF00365
(PFK) 		3 GLU A 169
LEU A 172
ASP A 173
 None
 0.23A 3ko0T-3k2qA:
0.6		 3ko0T-3k2qA:
13.08
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.
3k30 HISTAMINE
DEHYDROGENASE

(Pimelobacter
simplex) 		PF00724
(Oxidored_FMN)
PF07992
(Pyr_redox_2) 		3 GLU A 215
LEU A 218
ASP A 219
 None
 0.24A 3ko0T-3k30A:
undetectable		 3ko0T-3k30A:
8.18
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.
3k7x LIN0763 PROTEIN

(Listeria
innocua) 		PF03663
(Glyco_hydro_76) 		3 GLU A 281
LEU A 278
ASP A 277
 None
 0.42A 3ko0T-3k7xA:
undetectable		 3ko0T-3k7xA:
13.18
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.
3l7g XAA-PRO DIPEPTIDASE

(Alteromonas sp.) 		PF00557
(Peptidase_M24) 		3 GLU A 294
LEU A 297
ASP A 298
 None
 0.33A 3ko0T-3l7gA:
undetectable		 3ko0T-3l7gA:
11.67
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.
3mgj UNCHARACTERIZED
PROTEIN MJ1480

(Methanocaldococcus
jannaschii) 		PF04455
(Saccharop_dh_N) 		3 GLU A  74
LEU A  71
ASP A  70
 None
 0.38A 3ko0T-3mgjA:
undetectable		 3ko0T-3mgjA:
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.
3og4 INTERLEUKIN-29

(Homo sapiens) 		PF15177
(IL28A) 		3 GLU A  92
LEU A  95
ASP A  96
 None
 0.41A 3ko0T-3og4A:
undetectable		 3ko0T-3og4A:
17.88
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.
3p1t PUTATIVE
HISTIDINOL-PHOSPHATE
AMINOTRANSFERASE

(Burkholderia
pseudomallei) 		PF00155
(Aminotran_1_2) 		3 GLU A 237
LEU A 240
ASP A 241
 None
 0.37A 3ko0T-3p1tA:
undetectable		 3ko0T-3p1tA:
15.11
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.
3pl5 PUTATIVE
UNCHARACTERIZED
PROTEIN

(Streptococcus
mutans) 		PF02645
(DegV) 		3 GLU A 150
LEU A 153
ASP A 154
 None
 0.22A 3ko0T-3pl5A:
undetectable		 3ko0T-3pl5A:
15.79
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.
3q88 GLUCOSE-6-PHOSPHATE
ISOMERASE

(Francisella
tularensis) 		PF00342
(PGI) 		3 GLU A 215
LEU A 218
ASP A 219
 None
 0.43A 3ko0T-3q88A:
0.6		 3ko0T-3q88A:
9.94
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.
3qpf PUTATIVE
UNCHARACTERIZED
PROTEIN

(Streptococcus
pneumoniae) 		PF06824
(Glyco_hydro_125) 		3 GLU A 417
LEU A 420
ASP A 421
 EDO  A 433 ( 4.4A)
EDO  A 435 ( 4.5A)
None
 0.31A 3ko0T-3qpfA:
undetectable		 3ko0T-3qpfA:
13.83
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.
3qzy BACULOVIRUS
SULFHYDRYL OXIDASE
AC92

(Autographa
californica
multiple
nucleopolyhedrovirus) 		PF05214
(Baculo_p33) 		3 GLU A 177
LEU A 180
ASP A 181
 None
 0.34A 3ko0T-3qzyA:
1.8		 3ko0T-3qzyA:
16.86
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.
3rv2 S-ADENOSYLMETHIONINE
SYNTHASE

(Mycobacterium
marinum) 		PF00438
(S-AdoMet_synt_N)
PF02772
(S-AdoMet_synt_M)
PF02773
(S-AdoMet_synt_C) 		3 GLU A  76
LEU A  79
ASP A  80
 None
 0.13A 3ko0T-3rv2A:
undetectable		 3ko0T-3rv2A:
12.62
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.
3shr CGMP-DEPENDENT
PROTEIN KINASE 1

(Bos taurus) 		PF00027
(cNMP_binding) 		3 GLU A  95
LEU A  98
ASP A  99
 None
 0.31A 3ko0T-3shrA:
undetectable		 3ko0T-3shrA:
16.72
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.
3t4w MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN

(Sulfitobacter
sp. NAS-14.1) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 GLU A 151
LEU A 154
ASP A 155
 None
 0.31A 3ko0T-3t4wA:
undetectable		 3ko0T-3t4wA:
10.60
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.
3ts7 GERANYLTRANSTRANSFER
ASE

(Methylococcus
capsulatus) 		PF00348
(polyprenyl_synt) 		3 GLU A  19
LEU A  22
ASP A  23
 None
 0.26A 3ko0T-3ts7A:
undetectable		 3ko0T-3ts7A:
13.58
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.
3vvl HOMOSERINE
O-ACETYLTRANSFERASE

(Streptomyces
lavendulae) 		PF00561
(Abhydrolase_1) 		3 GLU A 258
LEU A 261
ASP A 262
 None
 0.22A 3ko0T-3vvlA:
undetectable		 3ko0T-3vvlA:
13.62
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.
3vz0 PUTATIVE
NAD-DEPENDENT
ALDEHYDE
DEHYDROGENASE

(Gluconobacter
oxydans) 		PF00171
(Aldedh) 		3 GLU A 313
LEU A 316
ASP A 317
 None
 0.41A 3ko0T-3vz0A:
undetectable		 3ko0T-3vz0A:
12.06
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.
3zzp RIBOSOMAL PROTEIN S6

(Thermus
thermophilus) 		no annotation 3 GLU A  25
LEU A  22
ASP A  21
 None
 0.43A 3ko0T-3zzpA:
undetectable		 3ko0T-3zzpA:
18.75
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.
4ack TSSL

(Francisella
tularensis) 		PF09850
(DotU) 		3 GLU A   8
LEU A  11
ASP A  12
 None
None
BR  A1156 ( 4.4A)
 0.37A 3ko0T-4ackA:
undetectable		 3ko0T-4ackA:
23.04
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.
4am2 BACTERIOFERRITIN

(Blastochloris
viridis) 		PF00210
(Ferritin) 		3 GLU A 135
LEU A 138
ASP A 139
 None
 0.29A 3ko0T-4am2A:
undetectable		 3ko0T-4am2A:
22.50
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.
4axz PUTATIVE ANTIGEN P35

(Borreliella
burgdorferi) 		PF05714
(Borrelia_lipo_1) 		3 GLU A 270
LEU A 271
ASP A 272
 None
 0.39A 3ko0T-4axzA:
0.9		 3ko0T-4axzA:
15.19
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.
4e44 CENTROMERE PROTEIN S

(Homo sapiens) 		PF15630
(CENP-S) 		3 GLU A  33
LEU A  36
ASP A  37
 None
 0.43A 3ko0T-4e44A:
undetectable		 3ko0T-4e44A:
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.
4ee9 ENDOGLUCANASE

(uncultured
bacterium) 		PF00150
(Cellulase) 		3 GLU A 253
LEU A 256
ASP A 257
 None
 0.34A 3ko0T-4ee9A:
undetectable		 3ko0T-4ee9A:
12.81
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4eto PROTEIN S100-A4

(Homo sapiens) 		PF01023
(S_100) 		3 GLU A   6
LEU A   9
ASP A  10
 None
 0.35A 3ko0T-4etoA:
16.6		 3ko0T-4etoA:
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.
4fd6 ARYLALKYLAMINE
N-ACETYLTRANSFERASE
2

(Aedes aegypti) 		PF00583
(Acetyltransf_1) 		3 GLU A 157
LEU A 160
ASP A 161
 None
 0.26A 3ko0T-4fd6A:
undetectable		 3ko0T-4fd6A:
16.59
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.
4hn3 LMO1757 PROTEIN

(Listeria
monocytogenes) 		PF07537
(CamS) 		3 GLU A 110
LEU A 113
ASP A 114
 None
 0.20A 3ko0T-4hn3A:
undetectable		 3ko0T-4hn3A:
15.63
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.
4i5j SERINE/THREONINE-PRO
TEIN PHOSPHATASE 2A
REGULATORY SUBUNIT
B'' SUBUNIT ALPHA

(Homo sapiens) 		PF13499
(EF-hand_7) 		3 GLU A 438
LEU A 441
ASP A 442
 None
 0.34A 3ko0T-4i5jA:
2.6		 3ko0T-4i5jA:
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.
4i99 CHROMOSOME PARTITION
PROTEIN SMC

(Pyrococcus
furiosus) 		PF02463
(SMC_N) 		3 GLU A1117
LEU A1114
ASP A1113
 None
 0.37A 3ko0T-4i99A:
undetectable		 3ko0T-4i99A:
14.37
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.
4kbm DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA

(Mycobacterium
tuberculosis) 		PF04561
(RNA_pol_Rpb2_2)
PF04563
(RNA_pol_Rpb2_1) 		3 GLU A 266
LEU A 269
ASP A 270
 None
 0.28A 3ko0T-4kbmA:
undetectable		 3ko0T-4kbmA:
11.74
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.
4ne5 CENTROMERE PROTEIN S

(Homo sapiens) 		PF15630
(CENP-S) 		3 GLU A  33
LEU A  36
ASP A  37
 None
 0.33A 3ko0T-4ne5A:
undetectable		 3ko0T-4ne5A:
22.12
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.
4pl2 DUAL-SPECIFICITY RNA
METHYLTRANSFERASE
RLMN

(Escherichia
coli) 		no annotation 3 GLU B 193
LEU B 196
ASP B 197
 None
 0.34A 3ko0T-4pl2B:
undetectable		 3ko0T-4pl2B:
13.39
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.
4r9o PUTATIVE ALDO/KETO
REDUCTASE

(Salmonella
enterica) 		PF00248
(Aldo_ket_red) 		3 GLU A  39
LEU A  42
ASP A  43
 None
 0.21A 3ko0T-4r9oA:
undetectable		 3ko0T-4r9oA:
16.84
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.
4tps CHROMOSOMAL
REPLICATION
INITIATOR PROTEIN
DNAA

(Bacillus
subtilis) 		PF11638
(DnaA_N) 		3 GLU B   2
LEU B   5
ASP B   6
 None
 0.34A 3ko0T-4tpsB:
undetectable		 3ko0T-4tpsB:
21.90
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.
4xxn ESX-1
SECRETION-ASSOCIATED
PROTEIN ESPB

(Mycobacterium
tuberculosis) 		no annotation 3 GLU A 185
LEU A 188
ASP A 189
 None
 0.18A 3ko0T-4xxnA:
undetectable		 3ko0T-4xxnA:
15.64
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.
4xy3 ESX-1
SECRETION-ASSOCIATED
PROTEIN ESPB

(Mycobacterium
tuberculosis) 		no annotation 3 GLU A 185
LEU A 188
ASP A 189
 None
 0.29A 3ko0T-4xy3A:
undetectable		 3ko0T-4xy3A:
11.24
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.
4z0h GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE
GAPC1, CYTOSOLIC

(Arabidopsis
thaliana) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		3 GLU O 134
LEU O 324
ASP O 323
 None
 0.36A 3ko0T-4z0hO:
undetectable		 3ko0T-4z0hO:
13.65
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.
4zwo ORGANOPHOSPHATE
ANHYDROLASE/PROLIDAS
E

(Alteromonas sp.) 		PF00557
(Peptidase_M24) 		3 GLU A 294
LEU A 297
ASP A 298
 None
 0.19A 3ko0T-4zwoA:
undetectable		 3ko0T-4zwoA:
12.86
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.
5abm RETINAL
DEHYDROGENASE 1

(Ovis aries) 		PF00171
(Aldedh) 		3 GLU A 351
LEU A 354
ASP A 355
 None
 0.23A 3ko0T-5abmA:
undetectable		 3ko0T-5abmA:
14.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5bux 3-HYDROXYACYL-[ACYL-
CARRIER-PROTEIN]
DEHYDRATASE FABZ

(Yersinia pestis) 		PF07977
(FabA) 		3 GLU A  11
LEU A  14
ASP A  15
 None
 0.41A 3ko0T-5buxA:
undetectable		 3ko0T-5buxA:
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.
5cqf L-LYSINE
6-MONOOXYGENASE

(Pseudomonas
syringae group
genomosp. 3) 		PF13434
(K_oxygenase) 		3 GLU A 424
LEU A  42
ASP A  41
 None
 0.43A 3ko0T-5cqfA:
undetectable		 3ko0T-5cqfA:
11.54
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.
5e57 TRANSCRIPTION
REGULATOR AMTR

(Mycolicibacterium
smegmatis) 		PF00440
(TetR_N) 		3 GLU A  24
LEU A  27
ASP A  28
 None
 0.19A 3ko0T-5e57A:
1.0		 3ko0T-5e57A:
15.74
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.
5eo6 COPROPORPHYRINOGEN
OXIDASE

(Acinetobacter
baumannii) 		PF01218
(Coprogen_oxidas) 		3 GLU A  14
LEU A  17
ASP A  18
 None
 0.19A 3ko0T-5eo6A:
undetectable		 3ko0T-5eo6A:
14.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5eue PUTATIVE
SPHINGOSINE-1-PHOSPH
ATE LYASE

(Symbiobacterium
thermophilum) 		PF00282
(Pyridoxal_deC) 		3 GLU A 372
LEU A 375
ASP A 376
 None
 0.22A 3ko0T-5eueA:
undetectable		 3ko0T-5eueA:
10.50
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.
5hr6 RLMN METHYLASE

(Escherichia
coli) 		PF04055
(Radical_SAM) 		3 GLU A 193
LEU A 196
ASP A 197
 None
MG  A 504 (-4.9A)
None
 0.40A 3ko0T-5hr6A:
undetectable		 3ko0T-5hr6A:
13.08
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.
5itq ENDONUCLEASE 8-LIKE
1

(Homo sapiens) 		PF01149
(Fapy_DNA_glyco)
PF06831
(H2TH)
PF09292
(Neil1-DNA_bind) 		3 GLU A 163
LEU A 166
ASP A 167
 None
 0.43A 3ko0T-5itqA:
1.9		 3ko0T-5itqA:
15.07
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.
5kht TROPOMYOSIN ALPHA-1
CHAIN,GENERAL
CONTROL PROTEIN GCN4

(Homo sapiens;
Saccharomyces
cerevisiae) 		no annotation 3 GLU A  16
LEU A  19
ASP A  20
 None
 0.14A 3ko0T-5khtA:
undetectable		 3ko0T-5khtA:
18.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5l8a PEROXIN 14

(Trypanosoma
brucei) 		PF04695
(Pex14_N) 		3 GLU A  16
LEU A  19
ASP A  20
 6RB  A 101 (-3.7A)
None
6RB  A 101 ( 4.2A)
 0.43A 3ko0T-5l8aA:
undetectable		 3ko0T-5l8aA:
20.39
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.
5msc CARBOXYLIC ACID
REDUCTASE

(Nocardia
iowensis) 		PF00501
(AMP-binding) 		3 GLU A 407
LEU A 410
ASP A 411
 None
 0.37A 3ko0T-5mscA:
undetectable		 3ko0T-5mscA:
6.11
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.
5odr HETERODISULFIDE
REDUCTASE, SUBUNIT B

(Methanothermococcus
thermolithotrophicus) 		PF02754
(CCG) 		3 GLU B 206
LEU B 209
ASP B 210
 None
 0.26A 3ko0T-5odrB:
undetectable		 3ko0T-5odrB:
14.09
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.
5oet GLUTATHIONE
SYNTHETASE-LIKE
EFFECTOR 30
(GPA-GSS30-APO)

(Globodera
pallida) 		no annotation 3 GLU B  49
LEU B  52
ASP B  53
 None
 0.23A 3ko0T-5oetB:
undetectable		 3ko0T-5oetB:
20.59
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.
5vr3 BRAF

(Homo sapiens) 		no annotation 3 GLU A  62
LEU A  65
ASP A  66
 None
 0.18A 3ko0T-5vr3A:
undetectable		 3ko0T-5vr3A:
17.71
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.
5vyk CHIMERA PROTEIN OF
BRS DOMAIN OF BRAF
AND CC-SAM DOMAIN OF
KSR1,SERINE/THREONIN
E-PROTEIN KINASE
B-RAF

(Homo sapiens) 		no annotation 3 GLU A1062
LEU A1065
ASP A1066
 None
 0.22A 3ko0T-5vykA:
undetectable		 3ko0T-5vykA:
18.81
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.
5xns CHROMOSOME PARTITION
PROTEIN SMC

(Pyrococcus
furiosus) 		PF02463
(SMC_N) 		3 GLU A1117
LEU A1114
ASP A1113
 None
 0.39A 3ko0T-5xnsA:
undetectable		 3ko0T-5xnsA:
13.05
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.
5xog DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA

(Komagataella
phaffii) 		PF00562
(RNA_pol_Rpb2_6)
PF04560
(RNA_pol_Rpb2_7)
PF04561
(RNA_pol_Rpb2_2)
PF04563
(RNA_pol_Rpb2_1)
PF04565
(RNA_pol_Rpb2_3)
PF04566
(RNA_pol_Rpb2_4)
PF04567
(RNA_pol_Rpb2_5) 		3 GLU B 320
LEU B 323
ASP B 324
 None
 0.32A 3ko0T-5xogB:
undetectable		 3ko0T-5xogB:
5.92
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.
5xto FAD-LINKED
SULFHYDRYL OXIDASE

(Autographa
californica
multiple
nucleopolyhedrovirus) 		PF05214
(Baculo_p33) 		3 GLU A 177
LEU A 180
ASP A 181
 None
 0.40A 3ko0T-5xtoA:
undetectable		 3ko0T-5xtoA:
17.01
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.
5yhp COLD ACTIVE PROLINE
IMINOPEPTIDASE

(Glaciozyma
antarctica) 		no annotation 3 GLU A 162
LEU A 165
ASP A 166
 None
 0.23A 3ko0T-5yhpA:
undetectable		 3ko0T-5yhpA:
13.31
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.
5zal ENDORIBONUCLEASE
DICER

(Homo sapiens) 		no annotation 3 GLU A1813
LEU A1712
ASP A1713
 None
 0.44A 3ko0T-5zalA:
undetectable		 3ko0T-5zalA:
21.70
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.
6fea VANADIUM
NITROGENASE, DELTA
SUBUNIT, VNFG

(Azotobacter
vinelandii) 		no annotation 3 GLU C  85
LEU C  88
ASP C  89
 None
 0.39A 3ko0T-6feaC:
undetectable		 3ko0T-6feaC:
22.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6ggp AMINO ACID ABC
TRANSPORTER,
PERIPLASMIC AMINO
ACID-BINDING PROTEIN

(Thermotoga
maritima) 		no annotation 3 GLU A  60
LEU A  57
ASP A  56
 None
 0.42A 3ko0T-6ggpA:
undetectable		 3ko0T-6ggpA:
23.71