SIMILAR PATTERNS OF AMINO ACIDS FOR 3OF4_B_ACTB313_0

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.
1a6c TOBACCO RINGSPOT
VIRUS CAPSID PROTEIN

(Tobacco
ringspot virus) 		PF03391
(Nepo_coat)
PF03688
(Nepo_coat_C)
PF03689
(Nepo_coat_N) 		3 ALA A 145
VAL A 144
GLN A 149
 None
 0.69A 3of4B-1a6cA:
undetectable		 3of4B-1a6cA:
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.
1bjx PROTEIN DISULFIDE
ISOMERASE

(Homo sapiens) 		PF13848
(Thioredoxin_6) 		3 ALA A 139
VAL A 138
GLN A 216
 None
 0.61A 3of4B-1bjxA:
undetectable		 3of4B-1bjxA:
18.57
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.
1c7g TYROSINE
PHENOL-LYASE

(Pantoea
agglomerans) 		PF01212
(Beta_elim_lyase) 		3 ALA A 118
VAL A 117
GLN A 130
 None
 0.73A 3of4B-1c7gA:
0.0		 3of4B-1c7gA:
19.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1e3d [NIFE] HYDROGENASE
LARGE SUBUNIT

(Desulfovibrio
desulfuricans) 		PF00374
(NiFeSe_Hases) 		3 ALA B 217
VAL B 218
GLN B 247
 None
 0.74A 3of4B-1e3dB:
0.1		 3of4B-1e3dB:
16.07
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.
1ezv UBIQUINOL-CYTOCHROME
C REDUCTASE COMPLEX
UBIQUINONE-BINDING
PROTEIN QP-C

(Saccharomyces
cerevisiae) 		PF02939
(UcrQ) 		3 ALA G  28
VAL G  29
GLN G  34
 None
 0.70A 3of4B-1ezvG:
undetectable		 3of4B-1ezvG:
17.70
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.
1f02 INTIMIN

(Escherichia
coli) 		PF02368
(Big_2)
PF02369
(Big_1)
PF07979
(Intimin_C) 		3 ALA I 672
VAL I 671
GLN I 830
 None
 0.70A 3of4B-1f02I:
0.0		 3of4B-1f02I:
21.23
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.
1gpe PROTEIN (GLUCOSE
OXIDASE)

(Penicillium
amagasakiense) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		3 ALA A 413
VAL A 412
GLN A 122
 None
 0.63A 3of4B-1gpeA:
0.3		 3of4B-1gpeA:
16.95
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.
1mw5 HYPOTHETICAL PROTEIN
HI1480

(Haemophilus
influenzae) 		no annotation 3 ALA A  79
VAL A  80
GLN A  54
 None
 0.73A 3of4B-1mw5A:
0.0		 3of4B-1mw5A:
21.78
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.
1su3 INTERSTITIAL
COLLAGENASE

(Homo sapiens) 		PF00045
(Hemopexin)
PF00413
(Peptidase_M10)
PF01471
(PG_binding_1) 		3 ALA A  98
VAL A  97
GLN A  66
 None
 0.74A 3of4B-1su3A:
0.0		 3of4B-1su3A:
17.54
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.
1vgw 4-DIPHOSPHOCYTIDYL-2
C-METHYL-D-ERYTHRITO
L SYNTHASE

(Neisseria
gonorrhoeae) 		PF01128
(IspD) 		3 ALA A 141
VAL A 140
GLN A 163
 None
 0.71A 3of4B-1vgwA:
0.0		 3of4B-1vgwA:
24.31
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.
1xqp 8-OXOGUANINE DNA
GLYCOSYLASE

(Pyrobaculum
aerophilum) 		PF09171
(AGOG) 		3 ALA A 227
VAL A 228
GLN A 246
 None
 0.75A 3of4B-1xqpA:
undetectable		 3of4B-1xqpA:
23.97
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.
1ykd ADENYLATE CYCLASE

(Anabaena sp.) 		PF01590
(GAF) 		3 ALA A 121
VAL A 120
GLN A  89
 CMP  A 501 ( 4.0A)
None
None
 0.58A 3of4B-1ykdA:
undetectable		 3of4B-1ykdA:
20.60
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.
1zki HYPOTHETICAL PROTEIN
PA5202

(Pseudomonas
aeruginosa) 		PF03061
(4HBT) 		3 ALA A  88
VAL A  87
GLN A 114
 None
 0.55A 3of4B-1zkiA:
undetectable		 3of4B-1zkiA:
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.
2a7n L(+)-MANDELATE
DEHYDROGENASE

(Pseudomonas
putida;
Spinacia
oleracea) 		PF01070
(FMN_dh) 		3 ALA A 160
VAL A 159
GLN A 259
 None
 0.74A 3of4B-2a7nA:
undetectable		 3of4B-2a7nA:
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.
2ahm REPLICASE
POLYPROTEIN 1AB,
HEAVY CHAIN

(Severe acute
respiratory
syndrome-related
coronavirus) 		PF08717
(nsp8) 		3 ALA E  50
VAL E  49
GLN E  61
 None
 0.75A 3of4B-2ahmE:
undetectable		 3of4B-2ahmE:
22.36
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.
2cc0 ACETYL-XYLAN
ESTERASE

(Streptomyces
lividans) 		PF01522
(Polysacc_deac_1) 		3 ALA A  60
VAL A  59
GLN A  52
 None
 0.71A 3of4B-2cc0A:
undetectable		 3of4B-2cc0A:
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.
2cvl PROTEIN TRANSLATION
INITIATION INHIBITOR

(Thermus
thermophilus) 		PF01042
(Ribonuc_L-PSP) 		3 ALA A  58
VAL A  59
GLN A  18
 None
 0.72A 3of4B-2cvlA:
undetectable		 3of4B-2cvlA:
23.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ecb ZINC FINGERS AND
HOMEOBOXES PROTEIN 1

(Homo sapiens) 		PF00046
(Homeobox) 		3 ALA A  28
VAL A  25
GLN A  47
 None
 0.64A 3of4B-2ecbA:
undetectable		 3of4B-2ecbA:
19.12
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.
2fyi HTH-TYPE
TRANSCRIPTIONAL
REGULATOR CBL

(Escherichia
coli) 		PF03466
(LysR_substrate) 		3 ALA A 160
VAL A 159
GLN A 303
 None
 0.74A 3of4B-2fyiA:
undetectable		 3of4B-2fyiA:
25.51
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.
2iqi HYPOTHETICAL PROTEIN
XCC0632

(Xanthomonas
campestris) 		PF03886
(ABC_trans_aux) 		3 ALA A 169
VAL A 168
GLN A 190
 None
 0.66A 3of4B-2iqiA:
undetectable		 3of4B-2iqiA:
22.67
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.
2jgd 2-OXOGLUTARATE
DEHYDROGENASE E1
COMPONENT

(Escherichia
coli) 		PF00676
(E1_dh)
PF02779
(Transket_pyr)
PF16870
(OxoGdeHyase_C) 		3 ALA A 911
VAL A 912
GLN A 921
 None
 0.63A 3of4B-2jgdA:
undetectable		 3of4B-2jgdA:
12.27
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.
2knd PHOTOSYSTEM II 11
KDA PROTEIN

(Synechocystis
sp. PCC 6803) 		PF13326
(PSII_Pbs27) 		3 ALA A  20
VAL A  18
GLN A  45
 None
 0.71A 3of4B-2kndA:
undetectable		 3of4B-2kndA:
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.
2m8s BAG FAMILY MOLECULAR
CHAPERONE REGULATOR
1

(Mus musculus) 		PF00240
(ubiquitin) 		3 ALA A  54
VAL A  51
GLN A  62
 None
 0.66A 3of4B-2m8sA:
undetectable		 3of4B-2m8sA:
18.40
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.
2mpa MN12H2
IGG2A-KAPPA,HEAVY
CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 ALA H 176
VAL H 177
GLN H 179
 None
 0.65A 3of4B-2mpaH:
undetectable		 3of4B-2mpaH:
23.65
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.
2nlk PROTEIN TYROSINE
PHOSPHATASE,
RECEPTOR TYPE, G
VARIANT (FRAGMENT)

(Homo sapiens) 		PF00102
(Y_phosphatase) 		3 ALA A1355
VAL A1356
GLN A1399
 None
 0.67A 3of4B-2nlkA:
undetectable		 3of4B-2nlkA:
16.69
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.
2o69 IRON-UTILIZATION
PERIPLASMIC PROTEIN

(Haemophilus
influenzae) 		PF01547
(SBP_bac_1) 		3 ALA A 231
VAL A 232
GLN A 243
 None
 0.68A 3of4B-2o69A:
undetectable		 3of4B-2o69A:
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.
2otm HYPOTHETICAL PROTEIN

(Shewanella
oneidensis) 		PF14588
(YjgF_endoribonc) 		3 ALA A  20
VAL A  19
GLN A  78
 None
 0.75A 3of4B-2otmA:
undetectable		 3of4B-2otmA:
24.76
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.
2prf PROFILIN IA

(Acanthamoeba
sp.) 		PF00235
(Profilin) 		3 ALA A  36
VAL A  37
GLN A  41
 None
 0.67A 3of4B-2prfA:
undetectable		 3of4B-2prfA:
18.52
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.
2wz8 CELLULOSOME PROTEIN
DOCKERIN TYPE I

(Ruminiclostridium
thermocellum) 		PF03422
(CBM_6) 		3 ALA A  24
VAL A  25
GLN A  27
 None
 0.72A 3of4B-2wz8A:
undetectable		 3of4B-2wz8A:
18.48
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.
2xhe UNC18

(Monosiga
brevicollis) 		PF00995
(Sec1) 		3 ALA A 498
VAL A 499
GLN A 199
 None
 0.62A 3of4B-2xheA:
undetectable		 3of4B-2xheA:
14.81
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.
2y6e UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE 4

(Homo sapiens) 		PF00443
(UCH) 		3 ALA A 371
VAL A 370
GLN A 361
 None
 0.43A 3of4B-2y6eA:
undetectable		 3of4B-2y6eA:
19.57
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.
2y9x LECTIN-LIKE FOLD
PROTEIN

(Agaricus
bisporus) 		no annotation 3 ALA E 117
VAL E 118
GLN E 144
 None
 0.68A 3of4B-2y9xE:
undetectable		 3of4B-2y9xE:
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.
3acf BETA-1,4-ENDOGLUCANA
SE

([Clostridium]
josui) 		PF03424
(CBM_17_28) 		3 ALA A  12
VAL A  13
GLN A  49
 None
 0.68A 3of4B-3acfA:
undetectable		 3of4B-3acfA:
21.05
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.
3bs5 PROTEIN AVEUGLE

(Drosophila
melanogaster) 		PF07647
(SAM_2) 		3 ALA A  22
VAL A  23
GLN A  88
 None
 0.65A 3of4B-3bs5A:
undetectable		 3of4B-3bs5A:
24.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bs7 PROTEIN AVEUGLE

(Drosophila
melanogaster) 		PF07647
(SAM_2) 		3 ALA A  22
VAL A  23
GLN A  88
 None
 0.64A 3of4B-3bs7A:
undetectable		 3of4B-3bs7A:
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.
3dsf FAB FRAGMENT OF
ANTI-OSTEOPONTIN
ANTIBODY 23C3, HEAVY
CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 ALA H 171
VAL H 172
GLN H 174
 None
 0.74A 3of4B-3dsfH:
undetectable		 3of4B-3dsfH:
23.37
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.
3g3l PUTATIVE
UNCHARACTERIZED
MEMBRANE-ASSOCIATED
PROTEIN

(Bacteroides
fragilis) 		PF12985
(DUF3869) 		3 ALA A 255
VAL A 256
GLN A 261
 None
None
GOL  A   6 (-4.2A)
 0.73A 3of4B-3g3lA:
undetectable		 3of4B-3g3lA:
22.05
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.
3gkf ALDOLASE LSRF

(Escherichia
coli) 		no annotation 3 ALA O 122
VAL O 123
GLN O 158
 None
 0.67A 3of4B-3gkfO:
undetectable		 3of4B-3gkfO:
20.88
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.
3hks EUKARYOTIC
TRANSLATION
INITIATION FACTOR
5A-2

(Arabidopsis
thaliana) 		PF01287
(eIF-5a) 		3 ALA A 151
VAL A 152
GLN A 125
 None
 0.61A 3of4B-3hksA:
undetectable		 3of4B-3hksA:
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.
3jcl SPIKE GLYCOPROTEIN

(Murine
coronavirus) 		PF01601
(Corona_S2)
PF09408
(Spike_rec_bind)
PF16451
(Spike_NTD) 		3 ALA A1004
VAL A1001
GLN A 765
 None
 0.75A 3of4B-3jclA:
undetectable		 3of4B-3jclA:
10.56
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.
3m9x D-XYLOSE-BINDING
PERIPLASMIC PROTEIN

(Escherichia
coli) 		PF13407
(Peripla_BP_4) 		3 ALA A 194
VAL A 193
GLN A 145
 None
 0.60A 3of4B-3m9xA:
undetectable		 3of4B-3m9xA:
23.17
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.
3nxk CYTOPLASMIC
L-ASPARAGINASE

(Campylobacter
jejuni) 		PF00710
(Asparaginase) 		3 ALA A 249
VAL A 248
GLN A 260
 None
 0.56A 3of4B-3nxkA:
undetectable		 3of4B-3nxkA:
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.
3oc4 OXIDOREDUCTASE,
PYRIDINE
NUCLEOTIDE-DISULFIDE
FAMILY

(Enterococcus
faecalis) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		3 ALA A 287
VAL A 286
GLN A 347
 None
 0.54A 3of4B-3oc4A:
undetectable		 3of4B-3oc4A:
20.65
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3of4 NITROREDUCTASE

(Idiomarina
loihiensis) 		PF00881
(Nitroreductase) 		3 ALA A  84
VAL A  85
GLN A 119
 SO4  A 306 (-3.6A)
SO4  A 306 (-3.7A)
SO4  A 306 (-2.9A)
 0.18A 3of4B-3of4A:
33.4		 3of4B-3of4A:
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.
3p1t PUTATIVE
HISTIDINOL-PHOSPHATE
AMINOTRANSFERASE

(Burkholderia
pseudomallei) 		PF00155
(Aminotran_1_2) 		3 ALA A  28
VAL A  29
GLN A  34
 None
 0.73A 3of4B-3p1tA:
undetectable		 3of4B-3p1tA:
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.
3q3u LIGNIN PEROXIDASE

(Trametopsis
cervina) 		PF00141
(peroxidase)
PF11895
(Peroxidase_ext) 		3 ALA A 118
VAL A 115
GLN A  25
 None
 0.72A 3of4B-3q3uA:
undetectable		 3of4B-3q3uA:
21.05
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.
3quv TRNA
(GUANINE-N(1)-)-METH
YLTRANSFERASE

(Mycobacteroides
abscessus) 		PF01746
(tRNA_m1G_MT) 		3 ALA A  33
VAL A  34
GLN A  14
 None
 0.74A 3of4B-3quvA:
undetectable		 3of4B-3quvA:
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.
3r0p L-PSP PUTATIVE
ENDORIBONUCLEASE

(uncultured
organism) 		PF01042
(Ribonuc_L-PSP) 		3 ALA A  62
VAL A  63
GLN A  21
 None
 0.70A 3of4B-3r0pA:
undetectable		 3of4B-3r0pA:
22.38
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.
3t6a BREAST CANCER
ANTI-ESTROGEN
RESISTANCE PROTEIN 3

(Homo sapiens) 		PF00617
(RasGEF) 		3 ALA A 721
VAL A 722
GLN A 797
 None
 0.67A 3of4B-3t6aA:
undetectable		 3of4B-3t6aA:
21.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tvt DISKS LARGE 1 TUMOR
SUPPRESSOR PROTEIN

(Drosophila
melanogaster) 		PF00018
(SH3_1)
PF00625
(Guanylate_kin) 		3 ALA A 898
VAL A 897
GLN A 962
 None
 0.41A 3of4B-3tvtA:
undetectable		 3of4B-3tvtA:
20.20
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.
3zle APICAL MEMBRANE
ANTIGEN 1

(Toxoplasma
gondii) 		PF02430
(AMA-1) 		3 ALA A 224
VAL A 225
GLN A 183
 None
 0.75A 3of4B-3zleA:
undetectable		 3of4B-3zleA:
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.
4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E

(Streptomyces
cinnabarigriseus) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		3 ALA A 386
VAL A 387
GLN A 418
 None
 0.51A 3of4B-4a0sA:
undetectable		 3of4B-4a0sA:
19.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4am3 POLYRIBONUCLEOTIDE
NUCLEOTIDYLTRANSFERA
SE

(Caulobacter
vibrioides) 		PF00013
(KH_1)
PF01138
(RNase_PH)
PF03725
(RNase_PH_C)
PF03726
(PNPase) 		3 ALA A 478
VAL A 479
GLN A 527
 None
 0.54A 3of4B-4am3A:
undetectable		 3of4B-4am3A:
15.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4dqd EXTRACELLULAR
LIGAND-BINDING
RECEPTOR

(Rhodopseudomonas
palustris) 		PF13458
(Peripla_BP_6) 		3 ALA A 220
VAL A 246
GLN A 242
 PPY  A 401 (-3.4A)
None
None
 0.70A 3of4B-4dqdA:
undetectable		 3of4B-4dqdA:
21.20
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.
4esq SERINE/THREONINE
PROTEIN KINASE

(Mycobacterium
tuberculosis) 		PF14032
(PknH_C) 		3 ALA A 454
VAL A 455
GLN A 614
 None
 0.74A 3of4B-4esqA:
undetectable		 3of4B-4esqA:
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.
4fqk ANTIBODY CR8059
HEAVY CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		3 ALA E 168
VAL E 169
GLN E 171
 None
 0.63A 3of4B-4fqkE:
undetectable		 3of4B-4fqkE:
21.40
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.
4g81 PUTATIVE HEXONATE
DEHYDROGENASE

(Salmonella
enterica) 		no annotation 3 ALA D 158
VAL D 157
GLN D  98
 None
 0.74A 3of4B-4g81D:
undetectable		 3of4B-4g81D:
23.66
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.
4ibn RIBONUCLEASE H

(uncultured
organism) 		PF00075
(RNase_H) 		3 ALA A 215
VAL A 214
GLN A 130
 None
 0.73A 3of4B-4ibnA:
undetectable		 3of4B-4ibnA:
23.94
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.
4j35 PHOSPHOTRIESTERASE,
PUTATIVE

(Deinococcus
radiodurans) 		PF02126
(PTE) 		3 ALA A  11
VAL A  10
GLN A  89
 None
 0.59A 3of4B-4j35A:
undetectable		 3of4B-4j35A:
20.97
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.
4jeu SYNTAXIN-BINDING
PROTEIN 1

(Rattus
norvegicus) 		PF00995
(Sec1) 		3 ALA A 188
VAL A 189
GLN A 206
 None
 0.60A 3of4B-4jeuA:
undetectable		 3of4B-4jeuA:
16.64
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.
4k3d BOVINE ANTIBODY WITH
ULTRALONG CDR H3,
HEAVY CHAIN

(Bos taurus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 ALA H 168
VAL H 169
GLN H 171
 None
 0.60A 3of4B-4k3dH:
undetectable		 3of4B-4k3dH:
21.54
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.
4nbq POLYRIBONUCLEOTIDE
NUCLEOTIDYLTRANSFERA
SE

(Coxiella
burnetii) 		PF00013
(KH_1)
PF00575
(S1)
PF01138
(RNase_PH)
PF03725
(RNase_PH_C)
PF03726
(PNPase) 		3 ALA A 479
VAL A 480
GLN A 528
 None
 0.66A 3of4B-4nbqA:
undetectable		 3of4B-4nbqA:
14.25
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.
4nlm LMO1340 PROTEIN

(Listeria
monocytogenes) 		no annotation 3 ALA A 178
VAL A 177
GLN A 208
 None
 0.50A 3of4B-4nlmA:
undetectable		 3of4B-4nlmA:
21.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE

(Legionella
pneumophila) 		PF00701
(DHDPS) 		3 ALA A 126
VAL A 125
GLN A  89
 None
 0.67A 3of4B-4nq1A:
undetectable		 3of4B-4nq1A:
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.
4p22 UBIQUITIN-LIKE
MODIFIER-ACTIVATING
ENZYME 1

(Homo sapiens) 		PF00899
(ThiF)
PF16190
(E1_FCCH)
PF16191
(E1_4HB) 		3 ALA A 189
VAL A 188
GLN A 172
 None
 0.53A 3of4B-4p22A:
undetectable		 3of4B-4p22A:
18.34
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.
4r0c ABGT PUTATIVE
TRANSPORTER FAMILY

(Alcanivorax
borkumensis) 		PF03806
(ABG_transport) 		3 ALA A 201
VAL A 200
GLN A 422
 None
 0.69A 3of4B-4r0cA:
undetectable		 3of4B-4r0cA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ra7 PEPTIDOGLYCAN
GLYCOSYLTRANSFERASE

(Atopobium
parvulum) 		PF00905
(Transpeptidase) 		3 ALA A 624
VAL A 621
GLN A 943
 None
 0.73A 3of4B-4ra7A:
undetectable		 3of4B-4ra7A:
19.14
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.
4tx2 NON-RIBOSOMAL
PEPTIDE SYNTHETASE

(Actinoplanes
teichomyceticus) 		PF00668
(Condensation) 		3 ALA B 328
VAL B 325
GLN B 264
 None
 0.57A 3of4B-4tx2B:
undetectable		 3of4B-4tx2B:
19.13
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.
4wsq AP2-ASSOCIATED
PROTEIN KINASE 1

(Homo sapiens) 		PF00069
(Pkinase) 		3 ALA A 212
VAL A 213
GLN A 203
 None
 0.74A 3of4B-4wsqA:
undetectable		 3of4B-4wsqA:
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.
4xxn ESX-1
SECRETION-ASSOCIATED
PROTEIN ESPB

(Mycobacterium
tuberculosis) 		no annotation 3 ALA A 123
VAL A 122
GLN A  47
 None
 0.71A 3of4B-4xxnA:
undetectable		 3of4B-4xxnA:
24.11
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.
4xy3 ESX-1
SECRETION-ASSOCIATED
PROTEIN ESPB

(Mycobacterium
tuberculosis) 		no annotation 3 ALA A 123
VAL A 122
GLN A  47
 None
 0.74A 3of4B-4xy3A:
undetectable		 3of4B-4xy3A:
17.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ywh ABC TRANSPORTER
SOLUTE BINDING
PROTEIN

(Actinobacillus
succinogenes) 		PF13407
(Peripla_BP_4) 		3 ALA A 217
VAL A 216
GLN A 168
 None
 0.56A 3of4B-4ywhA:
undetectable		 3of4B-4ywhA:
25.53
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.
4za3 RRNA N-GLYCOSIDASE

(Momordica
charantia) 		PF00652
(Ricin_B_lectin) 		3 ALA B 229
VAL B 230
GLN B 255
 None
 0.66A 3of4B-4za3B:
undetectable		 3of4B-4za3B:
22.18
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.
4zxi TYROCIDINE
SYNTHETASE 3

(Acinetobacter
baumannii) 		PF00501
(AMP-binding)
PF00550
(PP-binding)
PF00668
(Condensation)
PF00975
(Thioesterase)
PF13193
(AMP-binding_C) 		3 ALA A 281
VAL A 280
GLN A 329
 None
 0.70A 3of4B-4zxiA:
undetectable		 3of4B-4zxiA:
10.74
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.
5a31 ANAPHASE-PROMOTING
COMPLEX SUBUNIT 1
ANAPHASE-PROMOTING
COMPLEX SUBUNIT 5

(Homo sapiens;
Homo sapiens) 		PF12859
(ANAPC1)
PF12862
(ANAPC5) 		3 ALA A 112
VAL A 113
GLN O 265
 None
 0.62A 3of4B-5a31A:
undetectable		 3of4B-5a31A:
9.64
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.
5a60 INORGANIC
TRIPHOSPHATASE

(Escherichia
coli) 		PF01928
(CYTH) 		3 ALA A  87
VAL A  86
GLN A  97
 None
 0.68A 3of4B-5a60A:
undetectable		 3of4B-5a60A:
17.87
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.
5c59 MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB

(Escherichia
coli) 		PF12704
(MacB_PCD) 		3 ALA A  70
VAL A  69
GLN A 115
 None
 0.71A 3of4B-5c59A:
2.1		 3of4B-5c59A:
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.
5cad SM80.1 VICILIN

(Solanum
melongena) 		PF00190
(Cupin_1) 		3 ALA A 389
VAL A 388
GLN A 382
 None
 0.66A 3of4B-5cadA:
undetectable		 3of4B-5cadA:
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.
5ccx TRNA
(ADENINE(58)-N(1))-M
ETHYLTRANSFERASE
CATALYTIC SUBUNIT
TRMT61A

(Homo sapiens) 		PF08704
(GCD14) 		3 ALA A 274
VAL A 275
GLN A 236
 None
 0.70A 3of4B-5ccxA:
undetectable		 3of4B-5ccxA:
20.20
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.
5e24 SUPPRESSOR OF
HAIRLESS PROTEIN

(Drosophila
melanogaster) 		PF09270
(BTD)
PF09271
(LAG1-DNAbind) 		3 ALA E 127
VAL E 129
GLN E 356
 None
None
EDO  E 614 (-4.1A)
 0.69A 3of4B-5e24E:
undetectable		 3of4B-5e24E:
20.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hkq CONTACT-DEPENDENT
INHIBITOR A
CDII IMMUNITY
PROTEIN

(Escherichia
coli;
Escherichia
coli) 		PF14436
(EndoU_bacteria)
no annotation 		3 ALA I  72
VAL I  73
GLN A 295
 None
 0.43A 3of4B-5hkqI:
undetectable		 3of4B-5hkqI:
21.52
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.
5huo NICOTINATE-NUCLEOTID
E DIPHOSPHORYLASE
(CARBOXYLATING)

(Streptococcus
pyogenes) 		PF01729
(QRPTase_C)
PF02749
(QRPTase_N) 		3 ALA A 178
VAL A 179
GLN A 188
 None
 0.73A 3of4B-5huoA:
undetectable		 3of4B-5huoA:
24.14
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.
5j47 LARGE T ANTIGEN

(Human
polyomavirus 2) 		PF06431
(Polyoma_lg_T_C) 		3 ALA A 383
VAL A 384
GLN A 387
 None
 0.67A 3of4B-5j47A:
undetectable		 3of4B-5j47A:
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.
5jrl DIPEPTIDYL
AMINOPEPTIDASES/ACYL
AMINOACYL-PEPTIDASES
-LIKE PROTEIN

(Sphingopyxis
alaskensis) 		PF00326
(Peptidase_S9) 		3 ALA A 635
VAL A 634
GLN A 641
 None
 0.48A 3of4B-5jrlA:
undetectable		 3of4B-5jrlA:
15.60
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.
5ket ALDO-KETO REDUCTASE
1

(Coptotermes
gestroi) 		PF00248
(Aldo_ket_red) 		3 ALA A 228
VAL A 225
GLN A  25
 None
 0.73A 3of4B-5ketA:
undetectable		 3of4B-5ketA:
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.
5ldr BETA-D-GALACTOSIDASE

(Paracoccus sp.
32d) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N) 		3 ALA B 631
VAL B 630
GLN B 664
 None
 0.56A 3of4B-5ldrB:
undetectable		 3of4B-5ldrB:
13.82
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.
5n5p PUTATIVE
CELLULOSOMAL
SCAFFOLDIN PROTEIN

(Ruminococcus
flavefaciens) 		no annotation 3 ALA B 646
VAL B 701
GLN B 694
 None
 0.75A 3of4B-5n5pB:
undetectable		 3of4B-5n5pB:
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.
5n6y NITROGENASE
VANADIUM-IRON
PROTEIN BETA CHAIN

(Azotobacter
vinelandii) 		no annotation 3 ALA E  75
VAL E  74
GLN E  37
 None
 0.72A 3of4B-5n6yE:
undetectable		 3of4B-5n6yE:
17.61
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.
5nit GLUCOSE OXIDASE

(Aspergillus
niger) 		no annotation 3 ALA A 409
VAL A 408
GLN A 118
 None
 0.60A 3of4B-5nitA:
2.0		 3of4B-5nitA:
17.09
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.
5opt RIBOSOMAL PROTEIN
S25, PUTATIVE
40S RIBOSOMAL
PROTEIN S18,
PUTATIVE

(Trypanosoma
cruzi;
Trypanosoma
cruzi) 		no annotation
no annotation 		3 ALA a  45
VAL a  46
GLN u  11
 None
 0.71A 3of4B-5opta:
undetectable		 3of4B-5opta:
20.34
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.
5vf5 SM80.1 VICILIN

(Solanum
melongena) 		no annotation 3 ALA A 394
VAL A 393
GLN A 387
 PEG  A 504 ( 3.8A)
None
None
 0.67A 3of4B-5vf5A:
undetectable		 3of4B-5vf5A:
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.
5vip MDCE
MDCD

(Pseudomonas
aeruginosa;
Pseudomonas
aeruginosa) 		PF06833
(MdcE)
PF01039
(Carboxyl_trans) 		3 ALA A 147
VAL A 119
GLN B 137
 None
 0.71A 3of4B-5vipA:
undetectable		 3of4B-5vipA:
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.
5x8r PROTEIN PLASTID PY

(Spinacia
oleracea) 		no annotation 3 ALA y 103
VAL y 102
GLN y 165
 None
 0.73A 3of4B-5x8ry:
undetectable		 3of4B-5x8ry:
23.63
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.
5y3r DNA-DEPENDENT
PROTEIN KINASE
CATALYTIC SUBUNIT

(Homo sapiens) 		PF00454
(PI3_PI4_kinase)
PF02259
(FAT)
PF02260
(FATC)
PF08163
(NUC194) 		3 ALA C1293
VAL C1294
GLN C1238
 None
 0.74A 3of4B-5y3rC:
undetectable		 3of4B-5y3rC:
4.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6b5f NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE

(Yersinia
enterocolitica) 		no annotation 3 ALA A 162
VAL A 166
GLN A  61
 None
 0.71A 3of4B-6b5fA:
undetectable		 3of4B-6b5fA:
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.
6bpq TRANSIENT RECEPTOR
POTENTIAL CATION
CHANNEL SUBFAMILY M
MEMBER 8

(Ficedula
albicollis) 		no annotation 3 ALA A 625
VAL A 626
GLN A 671
 None
 0.67A 3of4B-6bpqA:
undetectable		 3of4B-6bpqA:
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.
6d4j PROTEIN PATCHED
HOMOLOG 1

(Homo sapiens) 		no annotation 3 ALA A 412
VAL A 411
GLN A 177
 NAG  A1502 ( 4.8A)
None
None
 0.74A 3of4B-6d4jA:
1.9		 3of4B-6d4jA:
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.
6d6k POLYRIBONUCLEOTIDE
NUCLEOTIDYLTRANSFERA
SE

(Acinetobacter
baumannii) 		no annotation 3 ALA A 478
VAL A 479
GLN A 527
 None
 0.63A 3of4B-6d6kA:
undetectable		 3of4B-6d6kA:
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.
6f5o RNA-DIRECTED RNA
POLYMERASE CATALYTIC
SUBUNIT

(Influenza B
virus) 		no annotation 3 ALA B 424
VAL B 422
GLN B 268
 None
 0.66A 3of4B-6f5oB:
0.0		 3of4B-6f5oB:
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.
6fn1 HUMAN-MOUSE CHIMERIC
ABCB1 (ABCBHM)

(Homo sapiens) 		no annotation 3 ALA A 571
VAL A 568
GLN A 536
 None
 0.68A 3of4B-6fn1A:
undetectable		 3of4B-6fn1A:
undetectable