SIMILAR PATTERNS OF AMINO ACIDS FOR 3L8L_A_DVAA6

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.
1ak0 P1 NUCLEASE

(Penicillium
citrinum) 		PF02265
(S1-P1_nuclease) 		3 ALA A 108
VAL A  97
TRP A  24
 None
 0.83A 3l8lA-1ak0A:
undetectable
3l8lB-1ak0A:
undetectable		 3l8lA-1ak0A:
3.85
3l8lB-1ak0A:
3.85
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.
1bii MHC CLASS I H-2DD

(Mus musculus) 		PF00129
(MHC_I)
PF07654
(C1-set) 		3 ALA A  11
VAL A   9
TRP A  97
 None
 0.60A 3l8lA-1biiA:
undetectable
3l8lB-1biiA:
undetectable		 3l8lA-1biiA:
3.68
3l8lB-1biiA:
3.68
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.
1c8o ICE INHIBITOR

(Cowpox virus) 		PF00079
(Serpin) 		3 ALA A 293
VAL A 286
TRP A 137
 None
 0.84A 3l8lA-1c8oA:
undetectable
3l8lB-1c8oA:
undetectable		 3l8lA-1c8oA:
4.96
3l8lB-1c8oA:
4.96
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.
1ddh MHC CLASS I H-2DD
HEAVY CHAIN

(Mus musculus) 		PF00129
(MHC_I)
PF07654
(C1-set) 		3 ALA A  11
VAL A   9
TRP A  97
 None
 0.73A 3l8lA-1ddhA:
undetectable
3l8lB-1ddhA:
undetectable		 3l8lA-1ddhA:
4.14
3l8lB-1ddhA:
4.14
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.
1mqq ALPHA-D-GLUCURONIDAS
E

(Geobacillus
stearothermophilus) 		PF03648
(Glyco_hydro_67N)
PF07477
(Glyco_hydro_67C)
PF07488
(Glyco_hydro_67M) 		3 ALA A 188
VAL A 190
TRP A   9
 None
GOL  A 751 (-4.1A)
None
 0.82A 3l8lA-1mqqA:
undetectable
3l8lB-1mqqA:
undetectable		 3l8lA-1mqqA:
3.46
3l8lB-1mqqA:
7.95
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.
1o1j HEMOGLOBIN ALPHA
CHAIN

(Homo sapiens) 		PF00042
(Globin) 		3 ALA A  19
VAL A  17
TRP A  14
 None
 0.84A 3l8lA-1o1jA:
undetectable
3l8lB-1o1jA:
undetectable		 3l8lA-1o1jA:
3.37
3l8lB-1o1jA:
4.17
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.
1r2k MOLYBDENUM COFACTOR
BIOSYNTHESIS PROTEIN
B

(Escherichia
coli) 		no annotation 3 ALA B  58
VAL B  60
TRP B  63
 None
 0.82A 3l8lA-1r2kB:
undetectable
3l8lB-1r2kB:
undetectable		 3l8lA-1r2kB:
6.59
3l8lB-1r2kB:
7.19
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.
1rbl RIBULOSE 1,5
BISPHOSPHATE
CARBOXYLASE/OXYGENAS
E (LARGE CHAIN)

(Synechococcus
elongatus) 		PF00016
(RuBisCO_large)
PF02788
(RuBisCO_large_N) 		3 ALA A  15
VAL A  17
TRP A  66
 None
 0.72A 3l8lA-1rblA:
undetectable
3l8lB-1rblA:
undetectable		 3l8lA-1rblA:
4.08
3l8lB-1rblA:
4.08
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.
1sfr ANTIGEN 85-A

(Mycobacterium
tuberculosis) 		PF00756
(Esterase) 		3 ALA A 129
VAL A 123
TRP A  51
 None
 0.64A 3l8lA-1sfrA:
undetectable
3l8lB-1sfrA:
undetectable		 3l8lA-1sfrA:
6.90
3l8lB-1sfrA:
4.81
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.
1sfs HYPOTHETICAL PROTEIN

(Geobacillus
stearothermophilus) 		PF08924
(DUF1906) 		3 ALA A 154
VAL A 158
TRP A 189
 None
 0.73A 3l8lA-1sfsA:
undetectable
3l8lB-1sfsA:
undetectable		 3l8lA-1sfsA:
7.59
3l8lB-1sfsA:
6.21
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.
1wom SIGMA FACTOR SIGB
REGULATION PROTEIN
RSBQ

(Bacillus
subtilis) 		PF12697
(Abhydrolase_6) 		3 ALA A  99
VAL A  93
TRP A  34
 None
 0.80A 3l8lA-1womA:
undetectable
3l8lB-1womA:
undetectable		 3l8lA-1womA:
18.33
3l8lB-1womA:
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.
1xje RIBONUCLEOTIDE
REDUCTASE,
B12-DEPENDENT

(Thermotoga
maritima) 		PF00317
(Ribonuc_red_lgN)
PF02867
(Ribonuc_red_lgC) 		3 ALA A  49
VAL A  44
TRP A  41
 None
 0.77A 3l8lA-1xjeA:
undetectable
3l8lB-1xjeA:
undetectable		 3l8lA-1xjeA:
1.74
3l8lB-1xjeA:
1.90
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.
1yhu HEMOGLOBIN B1A CHAIN

(Riftia
pachyptila) 		PF00042
(Globin) 		3 ALA C  24
VAL C  19
TRP C  16
 None
 0.70A 3l8lA-1yhuC:
undetectable
3l8lB-1yhuC:
undetectable		 3l8lA-1yhuC:
5.97
3l8lB-1yhuC:
8.59
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.
1z5z HELICASE OF THE
SNF2/RAD54 FAMILY

(Sulfolobus
solfataricus) 		PF00271
(Helicase_C) 		3 ALA A 809
VAL A 807
TRP A 828
 None
 0.52A 3l8lA-1z5zA:
undetectable
3l8lB-1z5zA:
undetectable		 3l8lA-1z5zA:
3.82
3l8lB-1z5zA:
5.15
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.
2ljr GLUTATHIONE
S-TRANSFERASE

(Homo sapiens) 		PF00043
(GST_C)
PF02798
(GST_N) 		3 ALA A 158
VAL A 162
TRP A  84
 None
 0.76A 3l8lA-2ljrA:
undetectable
3l8lB-2ljrA:
undetectable		 3l8lA-2ljrA:
5.67
3l8lB-2ljrA:
5.67
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.
2o8p 14-3-3 DOMAIN
CONTAINING PROTEIN

(Cryptosporidium
parvum) 		PF00244
(14-3-3) 		3 ALA A  18
VAL A  20
TRP A  23
 None
 0.81A 3l8lA-2o8pA:
undetectable
3l8lB-2o8pA:
undetectable		 3l8lA-2o8pA:
5.81
3l8lB-2o8pA:
10.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2p6r AFUHEL308 HELICASE

(Archaeoglobus
fulgidus) 		PF00270
(DEAD)
PF00271
(Helicase_C) 		3 ALA A  60
VAL A  62
TRP A  91
 None
 0.78A 3l8lA-2p6rA:
undetectable
3l8lB-2p6rA:
undetectable		 3l8lA-2p6rA:
2.21
3l8lB-2p6rA:
2.38
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.
2p9n ACTIN-RELATED
PROTEIN 2/3 COMPLEX
SUBUNIT 1B

(Bos taurus) 		PF00400
(WD40) 		3 ALA C  76
VAL C  78
TRP C 104
 None
 0.62A 3l8lA-2p9nC:
undetectable
3l8lB-2p9nC:
undetectable		 3l8lA-2p9nC:
3.52
3l8lB-2p9nC:
3.52
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.
2poi BACULOVIRAL IAP
REPEAT-CONTAINING
PROTEIN 4

(Homo sapiens) 		PF00653
(BIR) 		3 ALA A  44
VAL A  42
TRP A  73
 None
 0.81A 3l8lA-2poiA:
undetectable
3l8lB-2poiA:
undetectable		 3l8lA-2poiA:
8.05
3l8lB-2poiA:
8.24
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.
2qkq EPHRIN TYPE-B
RECEPTOR 4

(Homo sapiens) 		PF00536
(SAM_1) 		3 ALA A 963
VAL A 965
TRP A 915
 None
 0.84A 3l8lA-2qkqA:
undetectable
3l8lB-2qkqA:
undetectable		 3l8lA-2qkqA:
12.12
3l8lB-2qkqA:
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.
2vak SIGMA A

(Avian
orthoreovirus) 		PF03084
(Sigma_1_2) 		3 ALA A  83
VAL A  85
TRP A 105
 None
 0.81A 3l8lA-2vakA:
undetectable
3l8lB-2vakA:
undetectable		 3l8lA-2vakA:
5.53
3l8lB-2vakA:
5.44
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.
2w8q SUCCINATE-SEMIALDEHY
DE DEHYDROGENASE,
MITOCHONDRIAL

(Homo sapiens) 		PF00171
(Aldedh) 		3 ALA A 117
VAL A 115
TRP A 112
 None
 0.82A 3l8lA-2w8qA:
undetectable
3l8lB-2w8qA:
undetectable		 3l8lA-2w8qA:
2.88
3l8lB-2w8qA:
3.12
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.
2x05 EXO-BETA-D-GLUCOSAMI
NIDASE

(Amycolatopsis
orientalis) 		PF00703
(Glyco_hydro_2)
PF02837
(Glyco_hydro_2_N) 		3 ALA A  63
VAL A  65
TRP A  81
 None
 0.73A 3l8lA-2x05A:
undetectable
3l8lB-2x05A:
undetectable		 3l8lA-2x05A:
1.74
3l8lB-2x05A:
2.04
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.
2x64 GLUTATHIONE-S-TRANSF
ERASE

(Xylella
fastidiosa) 		PF00043
(GST_C)
PF02798
(GST_N) 		3 ALA A 191
VAL A 195
TRP A  20
 None
 0.81A 3l8lA-2x64A:
undetectable
3l8lB-2x64A:
undetectable		 3l8lA-2x64A:
9.09
3l8lB-2x64A:
9.09
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.
2yvh TRANSCRIPTIONAL
REGULATOR

(Corynebacterium
glutamicum) 		PF00440
(TetR_N) 		3 ALA A  89
VAL A  92
TRP A  63
 None
 0.76A 3l8lA-2yvhA:
undetectable
3l8lB-2yvhA:
undetectable		 3l8lA-2yvhA:
9.65
3l8lB-2yvhA:
9.65
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.
2ywm GLUTAREDOXIN-LIKE
PROTEIN

(Aquifex
aeolicus) 		PF13192
(Thioredoxin_3) 		3 ALA A 154
VAL A 156
TRP A 159
 None
 0.82A 3l8lA-2ywmA:
undetectable
3l8lB-2ywmA:
undetectable		 3l8lA-2ywmA:
5.23
3l8lB-2ywmA:
6.47
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.
3aqu AT4G19810

(Arabidopsis
thaliana) 		PF00704
(Glyco_hydro_18) 		3 ALA A 155
VAL A 179
TRP A 218
 None
 0.79A 3l8lA-3aquA:
undetectable
3l8lB-3aquA:
undetectable		 3l8lA-3aquA:
4.41
3l8lB-3aquA:
3.53
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.
3ayf NITRIC OXIDE
REDUCTASE

(Geobacillus
stearothermophilus) 		PF00115
(COX1) 		3 ALA A 626
VAL A 624
TRP A 621
 HEM  A 802 (-3.5A)
LOP  A 810 (-4.9A)
LOP  A 810 (-3.6A)
 0.81A 3l8lA-3ayfA:
undetectable
3l8lB-3ayfA:
undetectable		 3l8lA-3ayfA:
3.17
3l8lB-3ayfA:
1.88
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.
3b12 FLUOROACETATE
DEHALOGENASE

(Burkholderia
sp.) 		PF00561
(Abhydrolase_1) 		3 ALA A 104
VAL A 126
TRP A 255
 FAH  A 501 (-3.5A)
None
None
 0.74A 3l8lA-3b12A:
undetectable
3l8lB-3b12A:
undetectable		 3l8lA-3b12A:
4.66
3l8lB-3b12A:
5.33
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.
3db2 PUTATIVE
NADPH-DEPENDENT
OXIDOREDUCTASE

(Desulfitobacterium
hafniense) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		3 ALA A  22
VAL A  18
TRP A  15
 None
 0.71A 3l8lA-3db2A:
undetectable
3l8lB-3db2A:
undetectable		 3l8lA-3db2A:
6.75
3l8lB-3db2A:
5.08
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.
3deg GTP-BINDING PROTEIN
LEPA

(Escherichia
coli) 		PF00009
(GTP_EFTU)
PF00679
(EFG_C)
PF03144
(GTP_EFTU_D2)
PF06421
(LepA_C) 		3 ALA C 234
VAL C 259
TRP C 257
 None
 0.76A 3l8lA-3degC:
undetectable
3l8lB-3degC:
undetectable		 3l8lA-3degC:
5.43
3l8lB-3degC:
4.22
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.
3eqn GLUCAN
1,3-BETA-GLUCOSIDASE

(Phanerochaete
chrysosporium) 		PF12708
(Pectate_lyase_3) 		3 ALA A 444
VAL A 475
TRP A 505
 None
 0.81A 3l8lA-3eqnA:
undetectable
3l8lB-3eqnA:
undetectable		 3l8lA-3eqnA:
2.74
3l8lB-3eqnA:
2.74
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.
3ewi N-ACYLNEURAMINATE
CYTIDYLYLTRANSFERASE

(Mus musculus) 		no annotation 3 ALA A  86
VAL A  88
TRP A  91
 None
 0.82A 3l8lA-3ewiA:
undetectable
3l8lB-3ewiA:
undetectable		 3l8lA-3ewiA:
12.50
3l8lB-3ewiA:
8.13
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.
3hjg PUTATIVE
ALPHA-RIBAZOLE-5'-PH
OSPHATE PHOSPHATASE
COBC

(Vibrio
parahaemolyticus) 		PF00300
(His_Phos_1) 		3 ALA A 156
VAL A 158
TRP A 131
 None
 0.71A 3l8lA-3hjgA:
undetectable
3l8lB-3hjgA:
undetectable		 3l8lA-3hjgA:
8.51
3l8lB-3hjgA:
9.20
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.
3ibz PUTATIVE TELLURIUM
RESISTANT LIKE
PROTEIN TERD

(Streptomyces
coelicolor) 		PF02342
(TerD) 		3 ALA A 100
VAL A  98
TRP A 167
 None
 0.83A 3l8lA-3ibzA:
undetectable
3l8lB-3ibzA:
undetectable		 3l8lA-3ibzA:
6.55
3l8lB-3ibzA:
6.55
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.
3ih6 PUTATIVE ZINC
PROTEASE

(Bordetella
pertussis) 		PF05193
(Peptidase_M16_C) 		3 ALA A 290
VAL A 296
TRP A 382
 None
 0.80A 3l8lA-3ih6A:
undetectable
3l8lB-3ih6A:
undetectable		 3l8lA-3ih6A:
9.57
3l8lB-3ih6A:
11.96
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.
3ijl MUCONATE
CYCLOISOMERASE

(Bacteroides
thetaiotaomicron) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 ALA A 317
VAL A 312
TRP A 309
 None
 0.83A 3l8lA-3ijlA:
undetectable
3l8lB-3ijlA:
undetectable		 3l8lA-3ijlA:
8.02
3l8lB-3ijlA:
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.
3jv1 P22 PROTEIN

(Trypanosoma
brucei) 		PF02330
(MAM33) 		3 ALA A 192
VAL A 195
TRP A  79
 None
 0.83A 3l8lA-3jv1A:
undetectable
3l8lB-3jv1A:
undetectable		 3l8lA-3jv1A:
5.71
3l8lB-3jv1A:
5.71
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.
3k3d PROTEIN
RV1364C/MT1410

(Mycobacterium
tuberculosis) 		PF08448
(PAS_4) 		3 ALA A  13
VAL A  11
TRP A   7
 None
 0.69A 3l8lA-3k3dA:
undetectable
3l8lB-3k3dA:
undetectable		 3l8lA-3k3dA:
13.58
3l8lB-3k3dA:
11.11
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.
3k9b LIVER
CARBOXYLESTERASE 1

(Homo sapiens) 		PF00135
(COesterase) 		3 ALA A1422
VAL A1424
TRP A1547
 None
 0.75A 3l8lA-3k9bA:
undetectable
3l8lB-3k9bA:
undetectable		 3l8lA-3k9bA:
5.88
3l8lB-3k9bA:
3.48
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.
3kx0 UNCHARACTERIZED
PROTEIN
RV1364C/MT1410

(Mycobacterium
tuberculosis) 		PF08448
(PAS_4) 		3 ALA X  13
VAL X  11
TRP X   7
 None
 0.82A 3l8lA-3kx0X:
undetectable
3l8lB-3kx0X:
undetectable		 3l8lA-3kx0X:
13.58
3l8lB-3kx0X:
11.11
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.
3lv4 GLYCOSIDE HYDROLASE
YXIA

(Bacillus
licheniformis) 		PF04616
(Glyco_hydro_43)
PF16369
(GH43_C) 		3 ALA A 131
VAL A 174
TRP A 104
 None
 0.67A 3l8lA-3lv4A:
undetectable
3l8lB-3lv4A:
undetectable		 3l8lA-3lv4A:
2.91
3l8lB-3lv4A:
3.16
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.
3mcw PUTATIVE HYDROLASE

(Chromobacterium
violaceum) 		PF00857
(Isochorismatase) 		3 ALA A 118
VAL A 116
TRP A  47
 None
 0.71A 3l8lA-3mcwA:
undetectable
3l8lB-3mcwA:
undetectable		 3l8lA-3mcwA:
6.72
3l8lB-3mcwA:
11.76
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.
3p1u SUSD HOMOLOG

(Parabacteroides
distasonis) 		PF12741
(SusD-like) 		3 ALA A 308
VAL A 300
TRP A 296
 None
 0.84A 3l8lA-3p1uA:
undetectable
3l8lB-3p1uA:
undetectable		 3l8lA-3p1uA:
3.35
3l8lB-3p1uA:
3.61
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.
3ppo GLYCINE
BETAINE/CARNITINE/CH
OLINE-BINDING
PROTEIN

(Bacillus
subtilis) 		PF04069
(OpuAC) 		3 ALA A  88
VAL A 246
TRP A 127
 None
 0.73A 3l8lA-3ppoA:
undetectable
3l8lB-3ppoA:
undetectable		 3l8lA-3ppoA:
5.46
3l8lB-3ppoA:
5.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ppo GLYCINE
BETAINE/CARNITINE/CH
OLINE-BINDING
PROTEIN

(Bacillus
subtilis) 		PF04069
(OpuAC) 		3 ALA A 216
VAL A 168
TRP A 172
 None
 0.74A 3l8lA-3ppoA:
undetectable
3l8lB-3ppoA:
undetectable		 3l8lA-3ppoA:
5.46
3l8lB-3ppoA:
5.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3prx COBRA VENOM FACTOR

(Naja kaouthia) 		PF00207
(A2M)
PF01759
(NTR)
PF01821
(ANATO)
PF01835
(A2M_N)
PF07677
(A2M_recep)
PF07678
(A2M_comp)
PF07703
(A2M_N_2)
PF10569
(Thiol-ester_cl) 		3 ALA B 791
VAL B 578
TRP B 757
 None
 0.73A 3l8lA-3prxB:
undetectable
3l8lB-3prxB:
undetectable		 3l8lA-3prxB:
1.67
3l8lB-3prxB:
2.00
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.
3s51 FANCONI ANEMIA GROUP
I PROTEIN HOMOLOG

(Mus musculus) 		PF14674
(FANCI_S1-cap)
PF14675
(FANCI_S1)
PF14676
(FANCI_S2)
PF14677
(FANCI_S3)
PF14678
(FANCI_S4)
PF14679
(FANCI_HD1)
PF14680
(FANCI_HD2) 		3 ALA A 196
VAL A 198
TRP A 169
 None
 0.69A 3l8lA-3s51A:
undetectable
3l8lB-3s51A:
undetectable		 3l8lA-3s51A:
1.35
3l8lB-3s51A:
1.66
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.
3sfz APOPTOTIC PEPTIDASE
ACTIVATING FACTOR 1

(Mus musculus) 		PF00400
(WD40)
PF00931
(NB-ARC)
PF12894
(ANAPC4_WD40) 		3 ALA A 329
VAL A 299
TRP A 338
 None
 0.70A 3l8lA-3sfzA:
undetectable
3l8lB-3sfzA:
undetectable		 3l8lA-3sfzA:
1.80
3l8lB-3sfzA:
2.01
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.
3sz3 TRYPTOPHANYL-TRNA
SYNTHETASE

(Vibrio cholerae) 		PF00579
(tRNA-synt_1b) 		3 ALA A  69
VAL A  72
TRP A  28
 None
 0.74A 3l8lA-3sz3A:
undetectable
3l8lB-3sz3A:
undetectable		 3l8lA-3sz3A:
7.19
3l8lB-3sz3A:
7.84
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.
3uaj ENVELOPE PROTEIN

(Dengue virus) 		no annotation 3 ALA B  35
VAL B  15
TRP B  20
 None
 0.80A 3l8lA-3uajB:
undetectable
3l8lB-3uajB:
undetectable		 3l8lA-3uajB:
6.42
3l8lB-3uajB:
6.42
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.
3v4h HYPOTHETICAL PROTEIN

(Yersinia pestis) 		PF05638
(T6SS_HCP) 		3 ALA A  35
VAL A  53
TRP A  32
 None
 0.73A 3l8lA-3v4hA:
undetectable
3l8lB-3v4hA:
undetectable		 3l8lA-3v4hA:
10.00
3l8lB-3v4hA:
8.89
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.
4b3v E1 ENVELOPE
GLYCOPROTEIN

(Rubella virus) 		PF05748
(Rubella_E1) 		3 ALA A  24
VAL A  26
TRP A 167
 None
 0.84A 3l8lA-4b3vA:
undetectable
3l8lB-4b3vA:
undetectable		 3l8lA-4b3vA:
9.56
3l8lB-4b3vA:
9.56
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.
4c90 ALPHA-GLUCURONIDASE
GH115

(Bacteroides
ovatus) 		PF15979
(Glyco_hydro_115) 		3 ALA A 230
VAL A 232
TRP A 172
 None
 0.78A 3l8lA-4c90A:
undetectable
3l8lB-4c90A:
undetectable		 3l8lA-4c90A:
3.20
3l8lB-4c90A:
3.20
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.
4cot EXTRACELLULAR
ENDO-ALPHA-(1->5)-L-
ARABINANASE 2

(Bacillus
subtilis) 		PF04616
(Glyco_hydro_43)
PF16369
(GH43_C) 		3 ALA A 127
VAL A 170
TRP A 100
 None
TRS  A1471 (-3.9A)
TRS  A1471 (-3.5A)
 0.66A 3l8lA-4cotA:
undetectable
3l8lB-4cotA:
undetectable		 3l8lA-4cotA:
6.78
3l8lB-4cotA:
2.47
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.
4f53 SUSD HOMOLOG

(Bacteroides
ovatus) 		PF12741
(SusD-like) 		3 ALA A 202
VAL A  48
TRP A  45
 None
 0.77A 3l8lA-4f53A:
undetectable
3l8lB-4f53A:
undetectable		 3l8lA-4f53A:
2.62
3l8lB-4f53A:
3.14
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.
4g25 PENTATRICOPEPTIDE
REPEAT-CONTAINING
PROTEIN AT2G32230,
MITOCHONDRIAL

(Arabidopsis
thaliana) 		PF16953
(PRORP)
PF17177
(PPR_long) 		3 ALA A 467
VAL A 435
TRP A 459
 None
 0.80A 3l8lA-4g25A:
undetectable
3l8lB-4g25A:
undetectable		 3l8lA-4g25A:
3.75
3l8lB-4g25A:
3.75
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.
4iw9 GLUTATHIONE
TRANSFERASE

(Mannheimia
haemolytica) 		PF00043
(GST_C)
PF02798
(GST_N) 		3 ALA A 194
VAL A 198
TRP A  20
 None
 0.78A 3l8lA-4iw9A:
undetectable
3l8lB-4iw9A:
undetectable		 3l8lA-4iw9A:
5.43
3l8lB-4iw9A:
5.88
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.
4mkv RIBULOSE
BISPHOSPHATE
CARBOXYLASE LARGE
CHAIN

(Pisum sativum) 		PF00016
(RuBisCO_large)
PF02788
(RuBisCO_large_N) 		3 ALA A  15
VAL A  17
TRP A  66
 None
 0.82A 3l8lA-4mkvA:
undetectable
3l8lB-4mkvA:
undetectable		 3l8lA-4mkvA:
3.79
3l8lB-4mkvA:
5.22
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.
4n9n STEROL UPTAKE
CONTROL PROTEIN 2,
LYSOZYME

(Saccharomyces
cerevisiae;
Escherichia
virus T4) 		PF00959
(Phage_lysozyme)
PF11951
(Fungal_trans_2) 		3 ALA A 711
VAL A 872
TRP A 732
 None
 0.74A 3l8lA-4n9nA:
undetectable
3l8lB-4n9nA:
undetectable		 3l8lA-4n9nA:
3.16
3l8lB-4n9nA:
3.48
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.
4om9 SERINE PROTEASE PET

(Escherichia
coli) 		PF02395
(Peptidase_S6) 		3 ALA A 328
VAL A 326
TRP A 351
 None
 0.37A 3l8lA-4om9A:
undetectable
3l8lB-4om9A:
undetectable		 3l8lA-4om9A:
1.65
3l8lB-4om9A:
1.78
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.
4oxc E3 UBIQUITIN-PROTEIN
LIGASE XIAP

(Homo sapiens) 		PF00653
(BIR) 		3 ALA A  44
VAL A  42
TRP A  73
 None
 0.75A 3l8lA-4oxcA:
undetectable
3l8lB-4oxcA:
undetectable		 3l8lA-4oxcA:
6.31
3l8lB-4oxcA:
8.14
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.
4qjy GH127
BETA-L-ARABINOFURANO
SIDASE

(Geobacillus
stearothermophilus) 		PF07944
(Glyco_hydro_127) 		3 ALA A 144
VAL A  80
TRP A  76
 None
 0.67A 3l8lA-4qjyA:
undetectable
3l8lB-4qjyA:
undetectable		 3l8lA-4qjyA:
3.34
3l8lB-4qjyA:
2.17
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.
4qtt MULTIFUNCTIONAL
METHYLTRANSFERASE
SUBUNIT TRM112

(Saccharomyces
cerevisiae) 		PF03966
(Trm112p) 		3 ALA A  64
VAL A  59
TRP A  56
 None
 0.81A 3l8lA-4qttA:
undetectable
3l8lB-4qttA:
undetectable		 3l8lA-4qttA:
5.83
3l8lB-4qttA:
6.67
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.
4u7l LEUCINE-RICH REPEATS
AND
IMMUNOGLOBULIN-LIKE
DOMAINS PROTEIN 1

(Homo sapiens) 		PF01463
(LRRCT)
PF13855
(LRR_8) 		3 ALA A 358
VAL A 381
TRP A 410
 None
 0.77A 3l8lA-4u7lA:
undetectable
3l8lB-4u7lA:
undetectable		 3l8lA-4u7lA:
2.88
3l8lB-4u7lA:
3.12
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.
4usr MONOOXYGENASE

(Pseudomonas
stutzeri) 		PF13738
(Pyr_redox_3) 		3 ALA A 177
VAL A 179
TRP A  47
 None
 0.84A 3l8lA-4usrA:
undetectable
3l8lB-4usrA:
undetectable		 3l8lA-4usrA:
4.39
3l8lB-4usrA:
4.70
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.
4uuo CYTOSOLIC MALATE
DEHYDROGENASE

(Trichomonas
vaginalis) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		3 ALA A 152
VAL A 124
TRP A 150
 None
 0.77A 3l8lA-4uuoA:
undetectable
3l8lB-4uuoA:
undetectable		 3l8lA-4uuoA:
6.80
3l8lB-4uuoA:
6.80
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.
4w99 ENOYL-[ACYL-CARRIER-
PROTEIN] REDUCTASE
[NADPH, B-SPECIFIC]
1, MITOCHONDRIAL

(Candida
tropicalis) 		no annotation 3 ALA A  96
VAL A  29
TRP A 132
 None
 0.81A 3l8lA-4w99A:
undetectable
3l8lB-4w99A:
undetectable		 3l8lA-4w99A:
5.49
3l8lB-4w99A:
5.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xwl EXOGLUCANASE S

(Clostridium
cellulovorans) 		PF02011
(Glyco_hydro_48) 		3 ALA A 598
VAL A 593
TRP A 590
 None
 0.81A 3l8lA-4xwlA:
undetectable
3l8lB-4xwlA:
undetectable		 3l8lA-4xwlA:
2.84
3l8lB-4xwlA:
2.84
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.
4zgc KELCH PROTEIN

(Plasmodium
falciparum) 		PF01344
(Kelch_1)
PF02214
(BTB_2)
PF13418
(Kelch_4) 		3 ALA A 557
VAL A 555
TRP A 611
 None
 0.79A 3l8lA-4zgcA:
undetectable
3l8lB-4zgcA:
undetectable		 3l8lA-4zgcA:
3.69
3l8lB-4zgcA:
3.61
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.
5a7m BETA-XYLOSIDASE

(Trichoderma
reesei) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		3 ALA A 382
VAL A 377
TRP A 374
 NAG  A1501 (-4.1A)
None
None
 0.80A 3l8lA-5a7mA:
undetectable
3l8lB-5a7mA:
undetectable		 3l8lA-5a7mA:
1.95
3l8lB-5a7mA:
2.28
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.
5b3g PROTEIN SHORT-ROOT

(Arabidopsis
thaliana) 		PF03514
(GRAS) 		3 ALA B 393
VAL B 522
TRP B 234
 None
 0.72A 3l8lA-5b3gB:
undetectable
3l8lB-5b3gB:
undetectable		 3l8lA-5b3gB:
5.75
3l8lB-5b3gB:
5.75
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.
5b3h PROTEIN SHORT-ROOT

(Arabidopsis
thaliana) 		PF03514
(GRAS) 		3 ALA B 393
VAL B 522
TRP B 234
 None
 0.69A 3l8lA-5b3hB:
undetectable
3l8lB-5b3hB:
undetectable		 3l8lA-5b3hB:
5.75
3l8lB-5b3hB:
5.75
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.
5c3j CYTOCHROME B-LARGE
SUBUNIT
SUCCINATE
DEHYDROGENASE
[UBIQUINONE]
CYTOCHROME B SMALL
SUBUNIT,
MITOCHONDRIAL

(Ascaris suum;
Ascaris suum) 		PF01127
(Sdh_cyt)
PF05328
(CybS) 		3 ALA C 169
VAL C 171
TRP D 154
 None
None
EPH  D 201 (-3.7A)
 0.80A 3l8lA-5c3jC:
undetectable
3l8lB-5c3jC:
undetectable		 3l8lA-5c3jC:
10.20
3l8lB-5c3jC:
10.20
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.
5djo KINESIN-LIKE PROTEIN

(Mus musculus) 		PF00498
(FHA)
PF16183
(Kinesin_assoc) 		3 ALA A  89
VAL A  87
TRP A 148
 None
 0.84A 3l8lA-5djoA:
undetectable
3l8lB-5djoA:
undetectable		 3l8lA-5djoA:
11.83
3l8lB-5djoA:
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.
5dnw SHKAI2IB

(Striga
hermonthica) 		PF12697
(Abhydrolase_6) 		3 ALA A  98
VAL A  92
TRP A  33
 None
 0.76A 3l8lA-5dnwA:
undetectable
3l8lB-5dnwA:
undetectable		 3l8lA-5dnwA:
5.21
3l8lB-5dnwA:
6.25
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.
5fq6 SUSC/RAGA FAMILY
TONB-LINKED OUTER
MEMBRANE PROTEIN

(Bacteroides
thetaiotaomicron) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		3 ALA B 933
VAL B 931
TRP B 914
 None
 0.83A 3l8lA-5fq6B:
undetectable
3l8lB-5fq6B:
undetectable		 3l8lA-5fq6B:
1.67
3l8lB-5fq6B:
1.56
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.
5g5n LH3
HEXON-INTERLACING
CAPSID PROTEIN

(Snake
atadenovirus A) 		PF01696
(Adeno_E1B_55K) 		3 ALA A  53
VAL A  75
TRP A  57
 None
 0.81A 3l8lA-5g5nA:
undetectable
3l8lB-5g5nA:
undetectable		 3l8lA-5g5nA:
5.15
3l8lB-5g5nA:
5.88
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.
5g5z ABC TRANSPORTER,
SUBSTRATE-BINDING
PROTEIN

(Streptococcus
pneumoniae) 		PF01547
(SBP_bac_1) 		3 ALA A 429
VAL A 380
TRP A 384
 None
None
DQR  A 544 (-4.1A)
 0.84A 3l8lA-5g5zA:
undetectable
3l8lB-5g5zA:
undetectable		 3l8lA-5g5zA:
2.85
3l8lB-5g5zA:
3.09
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.
5gz4 SNAKE VENOM
PHOSPHODIESTERASE
(PDE)

(Naja atra) 		PF01033
(Somatomedin_B)
PF01223
(Endonuclease_NS)
PF01663
(Phosphodiest) 		3 ALA A 277
VAL A 282
TRP A 285
 None
 0.84A 3l8lA-5gz4A:
undetectable
3l8lB-5gz4A:
undetectable		 3l8lA-5gz4A:
1.90
3l8lB-5gz4A:
2.21
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.
5hr4 MMEI

(Methylophilus
methylotrophus) 		no annotation 3 ALA C 422
VAL C 424
TRP C 427
 None
 0.81A 3l8lA-5hr4C:
undetectable
3l8lB-5hr4C:
undetectable		 3l8lA-5hr4C:
2.72
3l8lB-5hr4C:
2.26
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.
5hzg STRIGOLACTONE
ESTERASE D14

(Arabidopsis
thaliana) 		PF12697
(Abhydrolase_6) 		3 ALA A 100
VAL A  94
TRP A  35
 None
 0.81A 3l8lA-5hzgA:
undetectable
3l8lB-5hzgA:
undetectable		 3l8lA-5hzgA:
4.35
3l8lB-5hzgA:
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.
5l9s ABC TRANSPORTER,
SUBSTRATE BINDING
PROTEIN (MANNOPINE)

(Agrobacterium
fabrum) 		PF13416
(SBP_bac_8) 		3 ALA A  84
VAL A  82
TRP A  93
 None
 0.84A 3l8lA-5l9sA:
undetectable
3l8lB-5l9sA:
undetectable		 3l8lA-5l9sA:
4.09
3l8lB-5l9sA:
4.40
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.
5lm8 'MULTICOPPER OXIDASE

(Aspergillus
niger) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		3 ALA A 430
VAL A 531
TRP A 420
 None
 0.83A 3l8lA-5lm8A:
undetectable
3l8lB-5lm8A:
undetectable		 3l8lA-5lm8A:
2.78
3l8lB-5lm8A:
2.78
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.
5m3x ANGIOTENSINOGEN

(Homo sapiens) 		no annotation 3 ALA A  71
VAL A  73
TRP A 133
 None
 0.70A 3l8lA-5m3xA:
undetectable
3l8lB-5m3xA:
undetectable		 3l8lA-5m3xA:
undetectable
3l8lB-5m3xA:
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.
5mdn DNA POLYMERASE

(Pyrobaculum
calidifontis) 		PF00136
(DNA_pol_B)
PF03104
(DNA_pol_B_exo1) 		3 ALA A 274
VAL A 270
TRP A 237
 None
 0.76A 3l8lA-5mdnA:
undetectable
3l8lB-5mdnA:
undetectable		 3l8lA-5mdnA:
1.80
3l8lB-5mdnA:
2.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5msc CARBOXYLIC ACID
REDUCTASE

(Nocardia
iowensis) 		PF00501
(AMP-binding) 		3 ALA A 102
VAL A  97
TRP A  94
 None
 0.84A 3l8lA-5mscA:
undetectable
3l8lB-5mscA:
undetectable		 3l8lA-5mscA:
1.50
3l8lB-5mscA:
1.50
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.
5nkp KELCH-LIKE PROTEIN 3

(Homo sapiens) 		PF01344
(Kelch_1) 		3 ALA A 413
VAL A 411
TRP A 470
 None
 0.84A 3l8lA-5nkpA:
undetectable
3l8lB-5nkpA:
undetectable		 3l8lA-5nkpA:
9.71
3l8lB-5nkpA:
8.74
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.
5nv3 RIBULOSE
BISPHOSPHATE
CARBOXYLASE LARGE
CHAIN

(Rhodobacter
sphaeroides) 		PF00016
(RuBisCO_large)
PF02788
(RuBisCO_large_N) 		3 ALA A  16
VAL A  18
TRP A  68
 None
 0.73A 3l8lA-5nv3A:
undetectable
3l8lB-5nv3A:
undetectable		 3l8lA-5nv3A:
3.90
3l8lB-5nv3A:
4.20
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.
5nxy OSMOTICALLY
ACTIVATED
L-CARNITINE/CHOLINE
ABC TRANSPORTER
SUBSTRATE-BINDING
PROTEIN OPUCC

(Bacillus
subtilis) 		no annotation 3 ALA A  60
VAL A 218
TRP A  99
 None
 0.76A 3l8lA-5nxyA:
undetectable
3l8lB-5nxyA:
undetectable		 3l8lA-5nxyA:
undetectable
3l8lB-5nxyA:
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.
5nxy OSMOTICALLY
ACTIVATED
L-CARNITINE/CHOLINE
ABC TRANSPORTER
SUBSTRATE-BINDING
PROTEIN OPUCC

(Bacillus
subtilis) 		no annotation 3 ALA A 188
VAL A 140
TRP A 144
 None
 0.79A 3l8lA-5nxyA:
undetectable
3l8lB-5nxyA:
undetectable		 3l8lA-5nxyA:
undetectable
3l8lB-5nxyA:
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.
5svc ACETONE CARBOXYLASE
ALPHA SUBUNIT

(Xanthobacter
autotrophicus) 		PF02538
(Hydantoinase_B) 		3 ALA A 347
VAL A 149
TRP A 401
 None
 0.75A 3l8lA-5svcA:
undetectable
3l8lB-5svcA:
undetectable		 3l8lA-5svcA:
3.16
3l8lB-5svcA:
3.41
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.
5usf TYROSYL-TRNA
SYNTHETASE, PUTATIVE

(Leishmania
donovani) 		PF00579
(tRNA-synt_1b) 		3 ALA A 421
VAL A 130
TRP A 127
 None
 0.78A 3l8lA-5usfA:
undetectable
3l8lB-5usfA:
undetectable		 3l8lA-5usfA:
1.88
3l8lB-5usfA:
3.80
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.
5wel CHIMERA OF GLUTAMATE
RECEPTOR 2, GERM
CELL-SPECIFIC GENE
1-LIKE PROTEIN

(Mus musculus;
Rattus
norvegicus) 		PF00060
(Lig_chan)
PF01094
(ANF_receptor)
PF07803
(GSG-1)
PF10613
(Lig_chan-Glu_bd) 		3 ALA A 430
VAL A 426
TRP A 766
 None
 0.83A 3l8lA-5welA:
undetectable
3l8lB-5welA:
undetectable		 3l8lA-5welA:
1.50
3l8lB-5welA:
2.73
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.
5wvb CHITINASE

(Ostrinia
furnacalis) 		no annotation 3 ALA A 480
VAL A 478
TRP A 475
 None
 0.73A 3l8lA-5wvbA:
undetectable
3l8lB-5wvbA:
undetectable		 3l8lA-5wvbA:
undetectable
3l8lB-5wvbA:
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.
5xea ENVELOPE
GLYCOPROTEIN

(Thogoto
thogotovirus) 		PF03273
(Baculo_gp64) 		3 ALA A 297
VAL A 295
TRP A 292
 None
 0.67A 3l8lA-5xeaA:
undetectable
3l8lB-5xeaA:
undetectable		 3l8lA-5xeaA:
4.35
3l8lB-5xeaA:
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.
5xxu RIBOSOMAL PROTEIN
ES19

(Toxoplasma
gondii) 		PF01090
(Ribosomal_S19e) 		3 ALA T  53
VAL T  50
TRP T  65
 None
A  21501 ( 4.5A)
None
 0.79A 3l8lA-5xxuT:
undetectable
3l8lB-5xxuT:
undetectable		 3l8lA-5xxuT:
12.73
3l8lB-5xxuT:
6.47
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.
5y92 RECEPTOR-LIKE
PROTEIN KINASE
ANXUR2

(Arabidopsis
thaliana) 		no annotation 3 ALA A 273
VAL A 275
TRP A 237
 None
 0.84A 3l8lA-5y92A:
undetectable
3l8lB-5y92A:
undetectable		 3l8lA-5y92A:
undetectable
3l8lB-5y92A:
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.
6b8a DNA-BINDING
TRANSCRIPTIONAL
REGULATOR

(Pseudomonas
aeruginosa) 		no annotation 3 ALA A 237
VAL A 170
TRP A 234
 None
CZG  A 301 (-4.9A)
None
 0.81A 3l8lA-6b8aA:
undetectable
3l8lB-6b8aA:
undetectable		 3l8lA-6b8aA:
undetectable
3l8lB-6b8aA:
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.
6c0w HISTONE H3-LIKE
CENTROMERIC PROTEIN
A
HISTONE H4

(Homo sapiens;
Homo sapiens) 		no annotation
no annotation 		3 ALA B  83
VAL B  81
TRP A  86
 ALA  B  83 ( 0.0A)
VAL  B  81 ( 0.6A)
TRP  A  86 ( 0.5A)
 0.75A 3l8lA-6c0wB:
undetectable
3l8lB-6c0wB:
undetectable		 3l8lA-6c0wB:
undetectable
3l8lB-6c0wB:
undetectable