SIMILAR PATTERNS OF AMINO ACIDS FOR 4BLV_A_SAMA1281_1

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.
1a8s CHLOROPEROXIDASE F

(Pseudomonas
fluorescens)
PF00561
(Abhydrolase_1)
4 HIS A 253
SER A  94
GLU A  99
ASP A  70
PPI  A 278 ( 4.0A)
PPI  A 278 ( 2.7A)
None
None
1.39A 4blvA-1a8sA:
2.1
4blvA-1a8sA:
22.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1a9x CARBAMOYL PHOSPHATE
SYNTHETASE (SMALL
CHAIN)


(Escherichia
coli)
PF00117
(GATase)
PF00988
(CPSase_sm_chain)
4 HIS B1795
SER B1831
GLU B1818
ASP B1834
None
1.36A 4blvA-1a9xB:
2.2
4blvA-1a9xB:
22.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1c4k PROTEIN (ORNITHINE
DECARBOXYLASE)


(Lactobacillus
sp. 30A)
PF01276
(OKR_DC_1)
PF03709
(OKR_DC_1_N)
PF03711
(OKR_DC_1_C)
4 HIS A 354
SER A 352
GLU A 314
ASP A 219
PLP  A 955 (-4.1A)
PLP  A 955 (-2.8A)
None
None
1.28A 4blvA-1c4kA:
3.8
4blvA-1c4kA:
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.
1czi CHYMOSIN

(Bos taurus)
PF00026
(Asp)
4 SER E   3
GLU E 162
ASP E 156
ASP E 171
None
1.40A 4blvA-1cziE:
undetectable
4blvA-1cziE:
21.81
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.
1dxe 2-DEHYDRO-3-DEOXY-GA
LACTARATE ALDOLASE


(Escherichia
coli)
PF03328
(HpcH_HpaI)
4 HIS A  50
GLU A 101
ASP A 159
ASP A 179
None
None
None
MG  A 901 (-3.2A)
1.28A 4blvA-1dxeA:
undetectable
4blvA-1dxeA:
22.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1gpj GLUTAMYL-TRNA
REDUCTASE


(Methanopyrus
kandleri)
PF00745
(GlutR_dimer)
PF01488
(Shikimate_DH)
PF05201
(GlutR_N)
4 SER A 393
GLU A 401
ASP A 343
ASP A 333
None
1.14A 4blvA-1gpjA:
4.7
4blvA-1gpjA:
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.
1i7n SYNAPSIN II

(Rattus
norvegicus)
PF02078
(Synapsin)
PF02750
(Synapsin_C)
4 HIS A 275
SER A 392
GLU A 387
ASP A 314
None
1.38A 4blvA-1i7nA:
undetectable
4blvA-1i7nA:
21.87
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.
1l9y FEZ-1 B-LACTAMASE

(Fluoribacter
gormanii)
PF00753
(Lactamase_B)
4 HIS A 196
HIS A 263
SER A 262
ASP A 176
ZN  A   1 ( 3.3A)
ZN  A   2 ( 3.3A)
None
None
1.35A 4blvA-1l9yA:
undetectable
4blvA-1l9yA:
23.82
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.
1lfw PEPV

(Lactobacillus
delbrueckii)
PF01546
(Peptidase_M20)
4 HIS A 269
GLU A 179
ASP A 449
ASP A 119
AEP  A 683 (-4.0A)
None
None
ZN  A1001 (-2.4A)
1.39A 4blvA-1lfwA:
undetectable
4blvA-1lfwA:
22.35
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.
1mjf SPERMIDINE SYNTHASE

(Pyrococcus
furiosus)
PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N)
4 HIS A  61
GLU A 104
ASP A 141
ASP A 158
None
1.36A 4blvA-1mjfA:
11.6
4blvA-1mjfA:
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.
1qq0 CARBONIC ANHYDRASE

(Methanosarcina
thermophila)
PF00132
(Hexapep)
PF14602
(Hexapep_2)
4 HIS A 193
SER A 192
GLU A 184
ASP A 187
None
1.13A 4blvA-1qq0A:
undetectable
4blvA-1qq0A:
21.82
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.
1w36 EXODEOXYRIBONUCLEASE
V GAMMA CHAIN


(Escherichia
coli)
PF04257
(Exonuc_V_gamma)
4 HIS C 237
HIS C 267
GLU C  33
ASP C  28
None
1.15A 4blvA-1w36C:
undetectable
4blvA-1w36C:
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.
1z48 PROBABLE
NADH-DEPENDENT
FLAVIN
OXIDOREDUCTASE YQJM


(Bacillus
subtilis)
PF00724
(Oxidored_FMN)
4 HIS A 164
SER A 217
GLU A 173
ASP A 125
FMN  A1500 (-3.9A)
None
None
None
1.28A 4blvA-1z48A:
undetectable
4blvA-1z48A:
23.05
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.
1zoi ESTERASE

(Pseudomonas
putida)
PF00561
(Abhydrolase_1)
4 HIS A 256
SER A  97
GLU A 102
ASP A  73
None
1.40A 4blvA-1zoiA:
2.2
4blvA-1zoiA:
24.16
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.
2buc DIPEPTIDYL PEPTIDASE
IV


(Sus scrofa)
PF00326
(Peptidase_S9)
PF00930
(DPPIV_N)
4 HIS A 740
SER A 630
GLU A 545
ASP A 556
SO4  A1769 ( 4.1A)
SO4  A1769 ( 3.0A)
None
None
1.35A 4blvA-2bucA:
2.1
4blvA-2bucA:
16.09
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.
2ec3 FIBRONECTIN

(Homo sapiens)
PF00039
(fn1)
4 HIS A  60
SER A  44
GLU A  31
ASP A  34
None
1.38A 4blvA-2ec3A:
undetectable
4blvA-2ec3A:
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.
2ei0 1,2-DIHYDROXYNAPHTHA
LENE DIOXYGENASE


(Pseudomonas sp.
C18)
PF00903
(Glyoxalase)
4 HIS A 247
HIS A 215
GLU A 177
ASP A 276
BP7  A 400 (-3.2A)
FE2  A 399 ( 3.3A)
MG  A 398 (-2.5A)
BP7  A 402 (-2.7A)
1.03A 4blvA-2ei0A:
undetectable
4blvA-2ei0A:
20.78
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.
2f7v AECTYLCITRULLINE
DEACETYLASE


(Xanthomonas
campestris)
PF01546
(Peptidase_M20)
PF07687
(M20_dimer)
4 HIS A  51
SER A  57
ASP A 103
ASP A 129
None
None
CO  A5367 (-2.2A)
None
1.26A 4blvA-2f7vA:
undetectable
4blvA-2f7vA:
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.
2gsn PHOSPHODIESTERASE-NU
CLEOTIDE
PYROPHOSPHATASE


(Xanthomonas
citri)
PF01663
(Phosphodiest)
4 HIS A 258
HIS A  94
SER A  52
ASP A  62
ZN  A1000 (-3.2A)
None
None
None
1.33A 4blvA-2gsnA:
2.7
4blvA-2gsnA:
23.15
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.
2iv2 FORMATE
DEHYDROGENASE H


(Escherichia
coli)
PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4)
4 HIS X 149
GLU X 385
ASP X 101
ASP X 349
None
1.32A 4blvA-2iv2X:
2.1
4blvA-2iv2X:
17.04
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.
2ixo SERINE/THREONINE-PRO
TEIN PHOSPHATASE 2A
ACTIVATOR 1


(Saccharomyces
cerevisiae)
PF03095
(PTPA)
4 HIS A 304
SER A 138
ASP A 205
ASP A 143
None
1.40A 4blvA-2ixoA:
undetectable
4blvA-2ixoA:
23.94
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2oo3 PROTEIN INVOLVED IN
CATABOLISM OF
EXTERNAL DNA


(Legionella
pneumophila)
PF04378
(RsmJ)
5 HIS A  19
SER A 101
GLU A 119
ASP A 144
ASP A 165
None
0.70A 4blvA-2oo3A:
38.9
4blvA-2oo3A:
38.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2p0k POLYCOMB PROTEIN
SCMH1


(Homo sapiens)
PF02820
(MBT)
4 HIS A  45
HIS A 164
SER A 163
ASP A 106
None
1.35A 4blvA-2p0kA:
undetectable
4blvA-2p0kA:
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.
2pt6 SPERMIDINE SYNTHASE

(Plasmodium
falciparum)
PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N)
4 HIS A 103
GLU A 147
ASP A 178
ASP A 196
S4M  A 501 (-3.7A)
S4M  A 501 (-2.7A)
S4M  A 501 (-3.3A)
S4M  A 501 (-2.6A)
1.37A 4blvA-2pt6A:
11.2
4blvA-2pt6A:
21.16
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.
2r2c 28 KDA OUTER
MEMBRANE PROTEIN
OMP28


(Porphyromonas
gingivalis)
PF11551
(Omp28)
4 HIS A 173
SER A 155
GLU A 152
ASP A  95
None
1.19A 4blvA-2r2cA:
undetectable
4blvA-2r2cA:
19.86
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.
2r2d ZN-DEPENDENT
HYDROLASES


(Agrobacterium
fabrum)
PF00753
(Lactamase_B)
4 HIS A 113
SER A 110
ASP A 238
ASP A 213
ZN  A 278 ( 3.2A)
None
None
ZN  A 277 (-2.0A)
1.32A 4blvA-2r2dA:
undetectable
4blvA-2r2dA:
25.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2uuu ALKYLDIHYDROXYACETON
EPHOSPHATE SYNTHASE


(Dictyostelium
discoideum)
PF01565
(FAD_binding_4)
PF02913
(FAD-oxidase_C)
4 HIS A  12
SER A  -1
GLU A 152
ASP A 108
None
1.41A 4blvA-2uuuA:
undetectable
4blvA-2uuuA:
19.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vg8 HYDROQUINONE
GLUCOSYLTRANSFERASE


(Arabidopsis
thaliana)
PF00201
(UDPGT)
4 HIS A  19
SER A  14
GLU A  45
ASP A  75
EDO  A1480 ( 3.8A)
None
None
None
1.13A 4blvA-2vg8A:
2.5
4blvA-2vg8A:
20.53
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.
2w5s PROCESSED GLYCEROL
PHOSPHATE
LIPOTEICHOIC ACID
SYNTHASE


(Staphylococcus
aureus)
PF00884
(Sulfatase)
4 HIS A 253
HIS A 476
SER A 256
ASP A 425
None
MN  A1642 ( 3.4A)
MN  A1642 ( 4.6A)
None
1.15A 4blvA-2w5sA:
3.2
4blvA-2w5sA:
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.
2wjf TYROSINE-PROTEIN
PHOSPHATASE CPSB


(Streptococcus
pneumoniae)
no annotation 4 HIS A   5
HIS A 201
GLU A 138
ASP A 141
MN  A1246 (-3.4A)
MN  A1247 ( 3.3A)
None
None
1.37A 4blvA-2wjfA:
undetectable
4blvA-2wjfA:
21.59
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.
2wqp POLYSIALIC ACID
CAPSULE BIOSYNTHESIS
PROTEIN SIAC


(Neisseria
meningitidis)
PF03102
(NeuB)
PF08666
(SAF)
4 HIS A 215
SER A 251
ASP A  76
ASP A 247
MN  A1351 ( 3.3A)
None
EDO  A1356 (-4.4A)
WQP  A1350 (-2.8A)
1.39A 4blvA-2wqpA:
undetectable
4blvA-2wqpA:
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.
2x1m METHIONYL-TRNA
SYNTHETASE


(Mycolicibacterium
smegmatis)
PF09334
(tRNA-synt_1g)
4 HIS A  52
HIS A 100
ASP A 130
ASP A  50
None
None
None
MET  A 600 (-4.3A)
1.29A 4blvA-2x1mA:
undetectable
4blvA-2x1mA:
20.22
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.
2x7v PROBABLE
ENDONUCLEASE 4


(Thermotoga
maritima)
PF01261
(AP_endonuc_2)
4 HIS A 230
HIS A 109
ASP A 188
ASP A 178
ZN  A1289 (-3.2A)
ZN  A1287 (-3.3A)
None
ZN  A1288 (-3.1A)
1.30A 4blvA-2x7vA:
undetectable
4blvA-2x7vA:
23.12
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.
2yb4 AMIDOHYDROLASE

(Chromobacterium
violaceum)
PF02811
(PHP)
4 HIS A   9
HIS A  75
GLU A 254
ASP A 248
None
1.34A 4blvA-2yb4A:
undetectable
4blvA-2yb4A:
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.
2yeq ALKALINE PHOSPHATASE
D


(Bacillus
subtilis)
PF09423
(PhoD)
PF16655
(PhoD_N)
4 HIS A 382
HIS A 211
GLU A 503
ASP A 380
FE  A1524 (-3.4A)
PO4  A1527 (-4.0A)
None
CA  A1525 ( 3.4A)
1.26A 4blvA-2yeqA:
undetectable
4blvA-2yeqA:
19.66
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.
2yeq ALKALINE PHOSPHATASE
D


(Bacillus
subtilis)
PF09423
(PhoD)
PF16655
(PhoD_N)
4 HIS A 510
HIS A 382
SER A 412
ASP A 151
PO4  A1527 (-4.1A)
FE  A1524 (-3.4A)
FE  A1524 ( 4.0A)
CA  A1525 (-2.4A)
1.10A 4blvA-2yeqA:
undetectable
4blvA-2yeqA:
19.66
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.
2zsu SPERMIDINE SYNTHASE

(Pyrococcus
horikoshii)
PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N)
4 HIS A  63
GLU A 107
ASP A 144
ASP A 161
AG3  A1001 (-4.0A)
None
None
AG3  A1001 (-2.8A)
1.19A 4blvA-2zsuA:
12.1
4blvA-2zsuA:
20.78
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.
3dul O-METHYLTRANSFERASE,
PUTATIVE


(Bacillus cereus)
PF01596
(Methyltransf_3)
4 HIS A  40
SER A  72
GLU A  90
ASP A 140
None
1.19A 4blvA-3dulA:
11.9
4blvA-3dulA:
25.42
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.
3ez0 UNCHARACTERIZED
PROTEIN WITH
FERRITIN-LIKE FOLD


(Arthrobacter
sp. FB24)
PF13794
(MiaE_2)
4 HIS A  59
SER A 111
ASP A  36
ASP A 108
UNL  A 500 (-3.7A)
UNL  A 500 (-3.5A)
None
None
1.40A 4blvA-3ez0A:
undetectable
4blvA-3ez0A:
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.
3fby CARTILAGE OLIGOMERIC
MATRIX PROTEIN


(Homo sapiens)
PF02412
(TSP_3)
PF05735
(TSP_C)
4 SER A 681
GLU A 559
ASP A 310
ASP A 271
None
None
None
CA  A 801 ( 2.8A)
1.38A 4blvA-3fbyA:
undetectable
4blvA-3fbyA:
18.77
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.
3fm0 PROTEIN CIAO1

(Homo sapiens)
PF00400
(WD40)
4 HIS A 155
SER A 199
ASP A 273
ASP A 257
None
1.38A 4blvA-3fm0A:
undetectable
4blvA-3fm0A:
24.18
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.
3glq ADENOSYLHOMOCYSTEINA
SE


(Burkholderia
pseudomallei)
PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase)
4 HIS A 344
SER A  60
ASP A 115
ASP A 142
RAB  A 602 ( 3.5A)
None
None
None
1.33A 4blvA-3glqA:
4.8
4blvA-3glqA:
20.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gr8 NADPH DEHYDROGENASE

(Geobacillus
kaustophilus)
PF00724
(Oxidored_FMN)
4 HIS A 164
SER A 217
GLU A 173
ASP A 125
FMN  A 341 (-4.0A)
None
None
None
1.28A 4blvA-3gr8A:
undetectable
4blvA-3gr8A:
24.71
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.
3gxa OUTER MEMBRANE
LIPOPROTEIN GNA1946


(Neisseria
meningitidis)
PF03180
(Lipoprotein_9)
4 HIS A 100
SER A 152
GLU A 110
ASP A 150
MET  A 296 (-3.6A)
None
None
None
1.34A 4blvA-3gxaA:
undetectable
4blvA-3gxaA:
24.56
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.
3hpf MUCONATE
CYCLOISOMERASE


(Oceanobacillus
iheyensis)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
4 HIS A 246
GLU A 218
ASP A 159
ASP A 322
MG  A 401 ( 3.3A)
None
None
None
1.32A 4blvA-3hpfA:
undetectable
4blvA-3hpfA:
21.63
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.
3ibr BACTERIOPHYTOCHROME

(Pseudomonas
aeruginosa)
PF00360
(PHY)
PF01590
(GAF)
PF08446
(PAS_2)
4 HIS A 247
HIS A 277
SER A 275
ASP A 169
BLA  A 900 (-3.8A)
BLA  A 900 (-4.2A)
BLA  A 900 (-2.9A)
None
1.40A 4blvA-3ibrA:
undetectable
4blvA-3ibrA:
22.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ihm STYRENE
MONOOXYGENASE A


(Pseudomonas
putida)
no annotation 4 HIS A  50
HIS A  16
SER A 312
ASP A 384
None
1.19A 4blvA-3ihmA:
2.2
4blvA-3ihmA:
21.41
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.
3jb9 PRE-MRNA-SPLICING
FACTOR SPP42


(Schizosaccharomyces
pombe)
PF08082
(PRO8NT)
PF08083
(PROCN)
PF10596
(U6-snRNA_bdg)
PF10597
(U5_2-snRNA_bdg)
PF10598
(RRM_4)
PF12134
(PRP8_domainIV)
4 SER A1362
GLU A1510
ASP A1730
ASP A1696
None
1.13A 4blvA-3jb9A:
undetectable
4blvA-3jb9A:
8.63
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.
3kgy BIFUNCTIONAL
DEAMINASE-REDUCTASE
DOMAIN PROTEIN


(Chloroflexus
aurantiacus)
PF01872
(RibD_C)
4 HIS A 206
SER A   9
GLU A 168
ASP A 145
None
NDP  A 301 (-4.5A)
None
None
1.41A 4blvA-3kgyA:
undetectable
4blvA-3kgyA:
21.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kzp PUTATIVE DIGUANYLATE
CYCLASE/PHOSPHODIEST
ERASE


(Listeria
monocytogenes)
PF00563
(EAL)
4 HIS A 143
GLU A  23
ASP A  15
ASP A 201
None
1.34A 4blvA-3kzpA:
undetectable
4blvA-3kzpA:
21.75
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.
3lij CALCIUM/CALMODULIN
DEPENDENT PROTEIN
KINASE WITH A KINASE
DOMAIN AND 4
CALMODULIN LIKE EF
HANDS


(Cryptosporidium
parvum)
PF00069
(Pkinase)
PF13499
(EF-hand_7)
4 HIS A 118
SER A 170
GLU A 314
ASP A 379
None
None
None
CA  A   1 (-3.3A)
1.17A 4blvA-3lijA:
undetectable
4blvA-3lijA:
22.29
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.
3mpd NUCLEOSIDE
DIPHOSPHATE KINASE


(Encephalitozoon
cuniculi)
PF00334
(NDK)
4 HIS A  51
HIS A 115
GLU A 121
ASP A 118
None
1.15A 4blvA-3mpdA:
undetectable
4blvA-3mpdA:
19.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3opy 6-PHOSPHOFRUCTO-1-KI
NASE ALPHA-SUBUNIT
6-PHOSPHOFRUCTO-1-KI
NASE BETA-SUBUNIT


(Komagataella
pastoris;
Komagataella
pastoris)
PF00365
(PFK)
PF00365
(PFK)
4 HIS A 493
SER B 365
ASP A 314
ASP A 221
SO4  B 943 (-4.2A)
None
SO4  A 991 (-4.7A)
None
1.32A 4blvA-3opyA:
undetectable
4blvA-3opyA:
14.43
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.
3s2j DIPEPTIDASE

(Streptomyces
coelicolor)
PF01244
(Peptidase_M19)
4 HIS A 212
SER A  66
ASP A 333
ASP A  22
ZN  A 403 ( 3.3A)
ZN  A 402 ( 3.9A)
None
ZN  A 402 ( 2.2A)
1.32A 4blvA-3s2jA:
undetectable
4blvA-3s2jA:
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.
3t8l ADENINE DEAMINASE 2

(Agrobacterium
fabrum)
PF01979
(Amidohydro_1)
PF13382
(Adenine_deam_C)
4 HIS A 239
HIS A 122
ASP A 304
ASP A 290
UNX  A 606 ( 3.6A)
UNX  A 607 ( 3.5A)
None
None
1.13A 4blvA-3t8lA:
undetectable
4blvA-3t8lA:
20.33
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.
3u60 DNA POLYMERASE
ACCESSORY PROTEIN 62


(Escherichia
virus T4)
PF16790
(Phage_clamp_A)
4 SER A  19
GLU A  12
ASP A  30
ASP A  21
None
1.40A 4blvA-3u60A:
undetectable
4blvA-3u60A:
22.90
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.
3ux8 EXCINUCLEASE ABC, A
SUBUNIT


(Geobacillus sp.
Y412MC52)
PF00005
(ABC_tran)
4 HIS A 886
SER A 639
GLU A 903
ASP A 521
None
1.34A 4blvA-3ux8A:
2.8
4blvA-3ux8A:
19.05
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.
3v0a NTNH

(Clostridium
botulinum)
PF01742
(Peptidase_M27)
PF07953
(Toxin_R_bind_N)
PF08470
(NTNH_C)
4 SER B 890
GLU B 837
ASP B 733
ASP B 892
None
1.27A 4blvA-3v0aB:
undetectable
4blvA-3v0aB:
12.48
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.
4bed HEMOCYANIN KLH1

(Megathura
crenulata)
PF00264
(Tyrosinase)
PF14830
(Haemocyan_bet_s)
4 HIS A 491
HIS A 606
GLU A 595
ASP A 774
CUO  A9002 (-3.4A)
CUO  A9002 (-3.3A)
None
None
1.31A 4blvA-4bedA:
undetectable
4blvA-4bedA:
11.21
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.
4bed HEMOCYANIN KLH1

(Megathura
crenulata)
PF00264
(Tyrosinase)
PF14830
(Haemocyan_bet_s)
4 HIS A 905
HIS A1019
GLU A1008
ASP A1188
CUO  A9003 (-3.5A)
CUO  A9003 (-3.4A)
None
None
1.36A 4blvA-4bedA:
undetectable
4blvA-4bedA:
11.21
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.
4bed HEMOCYANIN KLH1

(Megathura
crenulata)
PF00264
(Tyrosinase)
PF14830
(Haemocyan_bet_s)
4 HIS B1734
HIS B1851
GLU B1840
ASP B2019
CUO  B9005 (-3.4A)
CUO  B9005 (-3.2A)
None
None
1.30A 4blvA-4bedB:
undetectable
4blvA-4bedB:
10.06
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4blu RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE J


(Escherichia
coli)
PF04378
(RsmJ)
5 HIS A  19
SER A 100
GLU A 118
ASP A 143
ASP A 164
None
None
None
None
TRS  A1281 ( 3.0A)
0.41A 4blvA-4bluA:
46.6
4blvA-4bluA:
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.
4cw4 BETA-KETOACYL
SYNTHASE


(Pseudomonas
aeruginosa)
PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
4 HIS A 244
SER A 239
GLU A 315
ASP A 230
None
0.87A 4blvA-4cw4A:
undetectable
4blvA-4cw4A:
18.39
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.
4ddw REVERSE GYRASE

(Thermotoga
maritima)
PF00270
(DEAD)
PF01131
(Topoisom_bac)
PF01751
(Toprim)
4 HIS A   9
SER A 617
ASP A 623
ASP A 645
None
1.26A 4blvA-4ddwA:
2.5
4blvA-4ddwA:
13.03
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.
4dvg RHO-LIKE SMALL
GTPASE


(Entamoeba
histolytica)
PF00071
(Ras)
4 SER A 111
GLU A 148
ASP A 143
ASP A 108
None
1.38A 4blvA-4dvgA:
undetectable
4blvA-4dvgA:
20.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gaa MGC78867 PROTEIN

(Xenopus laevis)
PF01433
(Peptidase_M1)
PF09127
(Leuk-A4-hydro_C)
4 HIS A  23
SER A 158
GLU A 162
ASP A 180
None
1.16A 4blvA-4gaaA:
undetectable
4blvA-4gaaA:
19.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4i59 CYCLOHEXYLAMINE
OXIDASE


(Microbacterium
oxydans)
PF01593
(Amino_oxidase)
4 SER A 405
GLU A 386
ASP A 391
ASP A 403
None
1.33A 4blvA-4i59A:
undetectable
4blvA-4i59A:
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.
4ig8 2'-5'-OLIGOADENYLATE
SYNTHASE 1


(Homo sapiens)
PF01909
(NTP_transf_2)
PF10421
(OAS1_C)
4 SER A  64
GLU A 233
ASP A 300
ASP A  77
None
DTP  A 403 ( 4.2A)
None
MG  A 402 (-2.6A)
1.22A 4blvA-4ig8A:
undetectable
4blvA-4ig8A:
22.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4keq 4-PYRIDOXOLACTONASE

(Mesorhizobium
japonicum)
PF00753
(Lactamase_B)
4 HIS A  96
HIS A 252
SER A 251
ASP A 170
ZN  A 302 (-3.4A)
ZN  A 301 ( 3.3A)
ZN  A 301 ( 4.9A)
None
1.21A 4blvA-4keqA:
undetectable
4blvA-4keqA:
23.93
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.
4miv N-SULPHOGLUCOSAMINE
SULPHOHYDROLASE


(Homo sapiens)
PF00884
(Sulfatase)
PF16347
(DUF4976)
4 HIS A 368
HIS A 125
SER A  71
ASP A 477
FGP  A  70 ( 4.4A)
FGP  A  70 ( 3.7A)
FGP  A  70 ( 4.1A)
None
1.38A 4blvA-4mivA:
2.2
4blvA-4mivA:
21.04
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.
4nur PSDSA

(Pseudomonas sp.
S9)
PF00753
(Lactamase_B)
PF14863
(Alkyl_sulf_dimr)
PF14864
(Alkyl_sulf_C)
4 HIS A 192
HIS A 367
SER A 146
ASP A 161
None
ZN  A 701 (-3.4A)
None
None
1.28A 4blvA-4nurA:
undetectable
4blvA-4nurA:
19.09
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.
4nv0 7-METHYLGUANOSINE
PHOSPHATE-SPECIFIC
5'-NUCLEOTIDASE


(Drosophila
melanogaster)
PF05822
(UMPH-1)
4 SER A 171
GLU A 103
ASP A 270
ASP A  57
MGF  A 404 (-2.7A)
MG7  A 403 (-2.8A)
None
MG7  A 403 (-3.9A)
1.08A 4blvA-4nv0A:
2.4
4blvA-4nv0A:
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.
4r27 GLYCOSIDE HYDROLASE

(Microbacterium
sp. Gsoil167)
PF00232
(Glyco_hydro_1)
4 HIS A 106
HIS A  64
GLU A 112
ASP A 162
None
1.31A 4blvA-4r27A:
undetectable
4blvA-4r27A:
24.09
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.
4r70 BACTERIOPHYTOCHROME
(LIGHT-REGULATED
SIGNAL TRANSDUCTION
HISTIDINE KINASE),
PHYB2


(Rhodopseudomonas
palustris)
PF00360
(PHY)
PF01590
(GAF)
PF08446
(PAS_2)
4 HIS A 269
HIS A 299
SER A 297
ASP A 190
BLA  A 900 (-3.3A)
BLA  A 900 (-4.0A)
BLA  A 900 (-3.2A)
None
1.25A 4blvA-4r70A:
undetectable
4blvA-4r70A:
19.74
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.
4u4l BETA-LACTAMASE NDM-1

(Klebsiella
pneumoniae)
PF00753
(Lactamase_B)
4 HIS A 120
SER A 249
ASP A  95
ASP A  90
ZN  A 301 (-3.3A)
ZN  A 302 ( 4.3A)
None
None
1.27A 4blvA-4u4lA:
undetectable
4blvA-4u4lA:
19.37
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.
4uoe SPERMIDINE SYNTHASE

(Plasmodium
falciparum)
PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N)
4 HIS A 103
GLU A 147
ASP A 178
ASP A 196
None
MTA  A 401 (-2.7A)
MTA  A 401 (-3.2A)
4ZY  A 501 ( 3.6A)
1.41A 4blvA-4uoeA:
11.2
4blvA-4uoeA:
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.
4uoo LIPOTEICHOIC ACID
SYNTHASE


(Listeria
monocytogenes)
PF00884
(Sulfatase)
4 HIS A 261
HIS A 482
SER A 264
ASP A 431
TPO  A 307 ( 4.5A)
MG  A1645 (-3.2A)
MG  A1645 ( 3.9A)
None
1.21A 4blvA-4uooA:
2.1
4blvA-4uooA:
19.75
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.
4whn APXC

(Actinobacillus
pleuropneumoniae)
PF02794
(HlyC)
4 HIS A 152
SER A 157
GLU A  68
ASP A  87
None
1.22A 4blvA-4whnA:
undetectable
4blvA-4whnA:
22.92
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.
4wxo UNCHARACTERIZED
PROTEIN


(Pseudomonas
aeruginosa)
PF00990
(GGDEF)
4 HIS A 363
SER A 442
GLU A 403
ASP A 464
None
1.31A 4blvA-4wxoA:
undetectable
4blvA-4wxoA:
24.32
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.
4yg7 SERINE/THREONINE-PRO
TEIN KINASE HIPA


(Escherichia
coli)
PF07804
(HipA_C)
PF13657
(Couple_hipA)
4 HIS D  24
SER D  91
ASP D  73
ASP D  88
None
1.32A 4blvA-4yg7D:
undetectable
4blvA-4yg7D:
21.36
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.
4ysj CALMODULIN-LIKE
DOMAIN PROTEIN
KINASE


(Eimeria tenella)
PF00069
(Pkinase)
PF13499
(EF-hand_7)
4 HIS A  85
SER A 137
GLU A 281
ASP A 345
None
None
None
CA  A 501 (-3.1A)
0.96A 4blvA-4ysjA:
undetectable
4blvA-4ysjA:
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.
4ysl BETA-LACTAMASE
DOMAIN PROTEIN


(Pseudomonas
putida)
PF00753
(Lactamase_B)
4 HIS A  79
HIS A  74
ASP A  10
ASP A  36
None
FE  A 301 (-3.4A)
None
None
1.40A 4blvA-4yslA:
undetectable
4blvA-4yslA:
24.32
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.
5bn7 MALTODEXTRIN
GLUCOSIDASE


(Escherichia
coli)
PF00128
(Alpha-amylase)
4 SER A 307
GLU A 343
ASP A 291
ASP A 279
None
1.20A 4blvA-5bn7A:
undetectable
4blvA-5bn7A:
19.42
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.
5bza BETA-N-ACETYLHEXOSAM
INIDASE


(Thermotoga
neapolitana)
PF00933
(Glyco_hydro_3)
4 HIS A 165
SER A 172
ASP A 280
ASP A 245
None
None
None
CD  A 501 (-3.0A)
1.39A 4blvA-5bzaA:
undetectable
4blvA-5bzaA:
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.
5cfa BONE
SIALOPROTEIN-BINDING
PROTEIN


(Staphylococcus
aureus)
PF10425
(SdrG_C_C)
4 HIS A  29
GLU A 174
ASP A 167
ASP A  64
None
1.34A 4blvA-5cfaA:
undetectable
4blvA-5cfaA:
19.82
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.
5cuv ACIDOCALCISOMAL
PYROPHOSPHATASE


(Trypanosoma
cruzi)
PF00719
(Pyrophosphatase)
4 HIS A 202
SER A 199
GLU A 229
ASP A 252
None
1.28A 4blvA-5cuvA:
undetectable
4blvA-5cuvA:
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.
5ejy MYOSIN-I HEAVY CHAIN

(Dictyostelium
discoideum)
PF00784
(MyTH4)
4 HIS A  78
SER A 100
GLU A 140
ASP A  88
None
15P  A 602 ( 4.3A)
None
None
1.32A 4blvA-5ejyA:
undetectable
4blvA-5ejyA:
20.12
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.
5hp5 PROTEIN-ARGININE
DEIMINASE TYPE-1


(Homo sapiens)
PF03068
(PAD)
PF08526
(PAD_N)
PF08527
(PAD_M)
4 HIS A 535
GLU A 580
ASP A 585
ASP A 539
None
1.38A 4blvA-5hp5A:
undetectable
4blvA-5hp5A:
18.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5k0w CLASS B
CARBAPENEMASE GOB-18


(Elizabethkingia
meningoseptica)
PF00753
(Lactamase_B)
4 HIS A 241
HIS A 175
SER A 202
ASP A 264
ZN  A 301 (-3.3A)
ZN  A 302 (-3.3A)
None
None
1.30A 4blvA-5k0wA:
undetectable
4blvA-5k0wA:
20.68
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.
5m8t 5,6-DIHYDROXYINDOLE-
2-CARBOXYLIC ACID
OXIDASE


(Homo sapiens)
PF00264
(Tyrosinase)
4 HIS A 404
HIS A 215
SER A 214
ASP A 234
ZN  A 511 (-3.1A)
ZN  A 512 ( 3.3A)
None
None
1.38A 4blvA-5m8tA:
undetectable
4blvA-5m8tA:
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.
5mqs BETA-L-ARABINOBIOSID
ASE


(Bacteroides
thetaiotaomicron)
PF13088
(BNR_2)
4 HIS A  77
SER A 367
GLU A 397
ASP A 458
PTR  A 372 ( 4.0A)
None
None
None
1.39A 4blvA-5mqsA:
undetectable
4blvA-5mqsA:
13.01
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.
5n0o PEPTIDE
N-METHYLTRANSFERASE


(Omphalotus
olearius)
no annotation 4 HIS A 100
HIS A 109
SER A 108
ASP A  45
None
1.38A 4blvA-5n0oA:
undetectable
4blvA-5n0oA:
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.
5nug CYTOPLASMIC DYNEIN 1
HEAVY CHAIN 1


(Homo sapiens)
PF03028
(Dynein_heavy)
PF07728
(AAA_5)
PF08393
(DHC_N2)
PF12774
(AAA_6)
PF12775
(AAA_7)
PF12777
(MT)
PF12780
(AAA_8)
PF12781
(AAA_9)
4 HIS A1810
SER A2056
GLU A1814
ASP A1886
None
1.36A 4blvA-5nugA:
undetectable
4blvA-5nugA:
4.91
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.
5nv8 EF-P ARGININE 32
RHAMNOSYL-TRANSFERAS
E


(Pseudomonas
putida)
PF10093
(DUF2331)
4 HIS A  32
HIS A 371
ASP A 274
ASP A 364
None
None
TRH  A 401 (-4.1A)
None
1.33A 4blvA-5nv8A:
undetectable
4blvA-5nv8A:
22.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5thm ESTERASE-6

(Drosophila
melanogaster)
PF00135
(COesterase)
4 HIS A 187
SER A 214
GLU A 318
ASP A 448
7BZ  A 601 ( 4.8A)
None
None
None
1.40A 4blvA-5thmA:
undetectable
4blvA-5thmA:
19.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5vjw RHIZOBIALES-LIKE
PHOSPHATASE 2


(Arabidopsis
thaliana)
no annotation 4 HIS A  15
HIS A 213
ASP A  60
ASP A  82
ZN  A 402 ( 3.4A)
ZN  A 401 (-3.4A)
None
None
1.11A 4blvA-5vjwA:
undetectable
4blvA-5vjwA:
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.
5xyi GUANINE
NUCLEOTIDE-BINDING
PROTEIN BETA
SUBUNIT, PUTATIVE


(Trichomonas
vaginalis)
no annotation 4 HIS g 255
SER g 215
GLU g  37
ASP g 124
None
1.29A 4blvA-5xyig:
undetectable
4blvA-5xyig:
19.73
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.
5zw4 PUTATIVE
O-METHYLTRANSFERASE
YRRM


(Bacillus
subtilis)
no annotation 4 SER A  68
GLU A  85
ASP A 113
ASP A 133
SAM  A 302 (-2.7A)
SAM  A 302 (-2.7A)
SAM  A 302 (-3.3A)
SAM  A 302 (-3.6A)
0.93A 4blvA-5zw4A:
12.0
4blvA-5zw4A:
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.
6ax8 METHIONINE-TRNA
LIGASE


(Mycobacterium
tuberculosis)
no annotation 4 HIS A  51
HIS A  99
ASP A 129
ASP A  49
None
None
None
ME8  A 801 (-4.1A)
1.31A 4blvA-6ax8A:
undetectable
4blvA-6ax8A:
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.
6bog RNA
POLYMERASE-ASSOCIATE
D PROTEIN RAPA


(Escherichia
coli)
no annotation 4 HIS A 692
GLU A 402
ASP A 381
ASP A 409
None
1.20A 4blvA-6bogA:
undetectable
4blvA-6bogA:
undetectable