SIMILAR PATTERNS OF AMINO ACIDS FOR 4O7G_A_ASCA303_0

List of similar pattern of amino acids derived from ASSAM search

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1bt2 PROTEIN (CATECHOL
OXIDASE)

(Ipomoea batatas) 		PF00264
(Tyrosinase)
PF12142
(PPO1_DWL) 		4 PHE A 117
HIS A 118
PHE A 261
ASN A  93
 None
C2O  A 500 ( 3.3A)
C2O  A 500 (-3.6A)
None
 1.35A 4o7gA-1bt2A:
0.2
4o7gB-1bt2A:
0.5		 4o7gA-1bt2A:
19.82
4o7gB-1bt2A:
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.
1bt2 PROTEIN (CATECHOL
OXIDASE)

(Ipomoea batatas) 		PF00264
(Tyrosinase)
PF12142
(PPO1_DWL) 		4 PHE A 261
HIS A 244
ILE A 241
PHE A 114
 C2O  A 500 (-3.6A)
C2O  A 500 ( 3.2A)
None
None
 1.19A 4o7gA-1bt2A:
0.2
4o7gB-1bt2A:
0.5		 4o7gA-1bt2A:
19.82
4o7gB-1bt2A:
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.
1c3r HDLP (HISTONE
DEACETYLASE-LIKE
PROTEIN)

(Aquifex
aeolicus) 		PF00850
(Hist_deacetyl) 		4 PHE A 198
HIS A 170
TYR A 297
ASN A  93
 TSN  A 502 ( 3.9A)
ZN  A 501 ( 3.1A)
TSN  A 502 (-4.3A)
None
 1.29A 4o7gA-1c3rA:
undetectable
4o7gB-1c3rA:
undetectable		 4o7gA-1c3rA:
22.93
4o7gB-1c3rA:
22.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1e5p APHRODISIN

(Mesocricetus
auratus) 		PF00061
(Lipocalin) 		4 PHE A  33
ILE A  47
PHE A  82
ASN A  96
 None
 1.27A 4o7gA-1e5pA:
undetectable
4o7gB-1e5pA:
undetectable		 4o7gA-1e5pA:
20.72
4o7gB-1e5pA:
20.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1hbz CATALASE

(Micrococcus
luteus) 		PF00199
(Catalase)
PF06628
(Catalase-rel) 		4 PHE A  68
ILE A 314
PHE A 319
ASN A 361
 None
None
HEM  A 504 (-4.6A)
None
 1.24A 4o7gA-1hbzA:
undetectable
4o7gB-1hbzA:
undetectable		 4o7gA-1hbzA:
17.39
4o7gB-1hbzA:
17.39
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.
1l9x GAMMA-GLUTAMYL
HYDROLASE

(Homo sapiens) 		PF07722
(Peptidase_C26) 		4 PHE A 251
ILE A  12
PHE A 104
ASN A 258
 None
 1.19A 4o7gA-1l9xA:
undetectable
4o7gB-1l9xA:
undetectable		 4o7gA-1l9xA:
19.44
4o7gB-1l9xA:
19.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ma1 SUPEROXIDE DISMUTASE

(Methanothermobacter
thermautotrophicus) 		PF00081
(Sod_Fe_N)
PF02777
(Sod_Fe_C) 		4 ILE A  24
TYR A 183
PHE A  83
ASN A  86
 None
 1.43A 4o7gA-1ma1A:
0.9
4o7gB-1ma1A:
1.1		 4o7gA-1ma1A:
20.98
4o7gB-1ma1A:
20.98
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.
1pem RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE 2
ALPHA CHAIN

(Salmonella
enterica) 		PF00317
(Ribonuc_red_lgN)
PF02867
(Ribonuc_red_lgC)
PF08343
(RNR_N) 		4 PHE A 368
ILE A 366
PHE A 351
ASN A 677
 None
 1.35A 4o7gA-1pemA:
undetectable
4o7gB-1pemA:
1.2		 4o7gA-1pemA:
15.50
4o7gB-1pemA:
15.50
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.
1srq GTPASE-ACTIVATING
PROTEIN 1

(Homo sapiens) 		PF02145
(Rap_GAP) 		4 PHE A 211
ILE A 309
TYR A 317
ASN A 290
 None
 1.20A 4o7gA-1srqA:
undetectable
4o7gB-1srqA:
0.3		 4o7gA-1srqA:
20.34
4o7gB-1srqA:
20.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1txd RHO GUANINE
NUCLEOTIDE EXCHANGE
FACTOR 12

(Homo sapiens) 		PF00621
(RhoGEF) 		4 PHE A 796
ILE A 792
ASN A 856
ARG A 788
 None
 1.16A 4o7gA-1txdA:
2.3
4o7gB-1txdA:
1.9		 4o7gA-1txdA:
22.57
4o7gB-1txdA:
22.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1u69 HYPOTHETICAL PROTEIN

(Pseudomonas
aeruginosa) 		PF06983
(3-dmu-9_3-mt) 		4 PHE A  76
HIS A  72
ILE A 114
TYR A  11
 None
 0.94A 4o7gA-1u69A:
undetectable
4o7gB-1u69A:
undetectable		 4o7gA-1u69A:
21.37
4o7gB-1u69A:
21.37
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.
1ua7 ALPHA-AMYLASE

(Bacillus
subtilis) 		PF00128
(Alpha-amylase) 		4 PHE A 304
HIS A  13
ASN A 273
ARG A 174
 None
None
GLC  A 503 (-2.8A)
ACI  A 504 (-3.5A)
 1.32A 4o7gA-1ua7A:
undetectable
4o7gB-1ua7A:
undetectable		 4o7gA-1ua7A:
19.80
4o7gB-1ua7A:
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.
2bb0 IMIDAZOLONEPROPIONAS
E

(Bacillus
subtilis) 		PF01979
(Amidohydro_1) 		4 PHE A 221
HIS A 185
ILE A 112
ARG A  89
 None
None
ACT  A1501 (-4.5A)
ACT  A1501 (-3.1A)
 1.04A 4o7gA-2bb0A:
undetectable
4o7gB-2bb0A:
undetectable		 4o7gA-2bb0A:
20.66
4o7gB-2bb0A:
20.66
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.
2bb0 IMIDAZOLONEPROPIONAS
E

(Bacillus
subtilis) 		PF01979
(Amidohydro_1) 		4 PHE A 221
HIS A 185
ILE A 112
TYR A 152
 None
None
ACT  A1501 (-4.5A)
ACT  A1501 (-4.4A)
 0.96A 4o7gA-2bb0A:
undetectable
4o7gB-2bb0A:
undetectable		 4o7gA-2bb0A:
20.66
4o7gB-2bb0A:
20.66
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.
2bco SUCCINYLGLUTAMATE
DESUCCINYLASE

(Vibrio
parahaemolyticus) 		PF04952
(AstE_AspA) 		4 PHE A 273
ILE A 266
PHE A 293
ARG A 264
 None
 1.38A 4o7gA-2bcoA:
undetectable
4o7gB-2bcoA:
undetectable		 4o7gA-2bcoA:
20.72
4o7gB-2bcoA:
20.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2dgk GLUTAMATE
DECARBOXYLASE BETA

(Escherichia
coli) 		PF00282
(Pyridoxal_deC) 		4 PHE A 230
ILE A 236
ASN A 156
ARG A 144
 None
 1.07A 4o7gA-2dgkA:
undetectable
4o7gB-2dgkA:
undetectable		 4o7gA-2dgkA:
19.91
4o7gB-2dgkA:
19.91
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.
2eae ALPHA-FUCOSIDASE

(Bifidobacterium
bifidum) 		PF14498
(Glyco_hyd_65N_2) 		4 PHE A  73
ILE A 277
PHE A  53
ASN A  55
 None
 1.40A 4o7gA-2eaeA:
1.6
4o7gB-2eaeA:
1.6		 4o7gA-2eaeA:
15.33
4o7gB-2eaeA:
15.33
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.
2f8t ARGONAUTE PROTEIN

(Aquifex
aeolicus) 		PF02171
(Piwi) 		4 PHE A 346
ILE A 484
TYR A 667
ASN A 523
 None
 1.44A 4o7gA-2f8tA:
undetectable
4o7gB-2f8tA:
undetectable		 4o7gA-2f8tA:
16.05
4o7gB-2f8tA:
16.05
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.
2g39 ACETYL-COA HYDROLASE

(Pseudomonas
aeruginosa) 		PF02550
(AcetylCoA_hydro)
PF13336
(AcetylCoA_hyd_C) 		4 ILE A 180
TYR A 183
PHE A 156
ARG A 118
 ACY  A 903 (-4.0A)
ACY  A 903 (-4.4A)
ACY  A 903 (-3.9A)
ACY  A 903 (-3.9A)
 1.11A 4o7gA-2g39A:
undetectable
4o7gB-2g39A:
undetectable		 4o7gA-2g39A:
18.67
4o7gB-2g39A:
18.67
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.
2k8v THIOREDOXIN
DOMAIN-CONTAINING
PROTEIN 12

(Homo sapiens) 		PF13899
(Thioredoxin_7) 		4 HIS A  24
ILE A  45
TYR A 126
PHE A 102
 None
 1.31A 4o7gA-2k8vA:
undetectable
4o7gB-2k8vA:
undetectable		 4o7gA-2k8vA:
21.72
4o7gB-2k8vA:
21.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2le1 UNCHARACTERIZED
PROTEIN

(Thermobifida
fusca) 		PF10604
(Polyketide_cyc2) 		4 PHE A 111
HIS A  89
TYR A  77
PHE A 130
 None
 1.05A 4o7gA-2le1A:
undetectable
4o7gB-2le1A:
undetectable		 4o7gA-2le1A:
19.57
4o7gB-2le1A:
19.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ql2 TRANSCRIPTION FACTOR
E2-ALPHA
NEUROGENIC
DIFFERENTIATION
FACTOR 1

(Mus musculus;
Mus musculus) 		PF00010
(HLH)
PF00010
(HLH) 		4 PHE A 562
ILE A 558
ASN B 118
ARG A 554
 None
 1.18A 4o7gA-2ql2A:
undetectable
4o7gB-2ql2A:
undetectable		 4o7gA-2ql2A:
14.66
4o7gB-2ql2A:
14.66
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.
2ux0 CALCIUM-CALMODULIN
DEPENDENT PROTEIN
KINASE (CAM KINASE)
II GAMMA

(Homo sapiens) 		PF08332
(CaMKII_AD) 		4 HIS A 444
TYR A 516
ASN A 411
ARG A 502
 GLY  A1521 (-3.9A)
None
None
None
 1.14A 4o7gA-2ux0A:
undetectable
4o7gB-2ux0A:
undetectable		 4o7gA-2ux0A:
21.65
4o7gB-2ux0A:
21.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ux0 CALCIUM-CALMODULIN
DEPENDENT PROTEIN
KINASE (CAM KINASE)
II GAMMA

(Homo sapiens) 		PF08332
(CaMKII_AD) 		4 PHE A 448
HIS A 444
TYR A 516
ARG A 502
 None
GLY  A1521 (-3.9A)
None
None
 1.34A 4o7gA-2ux0A:
undetectable
4o7gB-2ux0A:
undetectable		 4o7gA-2ux0A:
21.65
4o7gB-2ux0A:
21.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2w5s PROCESSED GLYCEROL
PHOSPHATE
LIPOTEICHOIC ACID
SYNTHASE

(Staphylococcus
aureus) 		PF00884
(Sulfatase) 		4 HIS A 409
ILE A 411
TYR A 360
ARG A 356
 None
None
None
GP9  A1644 (-3.0A)
 1.31A 4o7gA-2w5sA:
undetectable
4o7gB-2w5sA:
undetectable		 4o7gA-2w5sA:
18.78
4o7gB-2w5sA:
18.78
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.
2wd5 STRUCTURAL
MAINTENANCE OF
CHROMOSOMES PROTEIN
3

(Mus musculus) 		PF06470
(SMC_hinge) 		4 PHE B 586
HIS B 560
PHE B 575
ASN B 576
 None
 1.24A 4o7gA-2wd5B:
undetectable
4o7gB-2wd5B:
undetectable		 4o7gA-2wd5B:
21.29
4o7gB-2wd5B:
21.29
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.
2xkr PUTATIVE CYTOCHROME
P450 142

(Mycobacterium
tuberculosis) 		PF00067
(p450) 		4 PHE A 380
ILE A  65
PHE A 305
ARG A 282
 None
None
HEM  A1400 ( 4.3A)
HEM  A1400 (-3.1A)
 1.08A 4o7gA-2xkrA:
1.5
4o7gB-2xkrA:
1.5		 4o7gA-2xkrA:
18.00
4o7gB-2xkrA:
18.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ypb T-CELL ACUTE
LYMPHOCYTIC LEUKEMIA
PROTEIN 1
TRANSCRIPTION FACTOR
E2-ALPHA

(Homo sapiens;
Homo sapiens) 		PF00010
(HLH)
PF00010
(HLH) 		4 PHE B 566
ILE B 562
ASN A 204
ARG B 558
 None
 1.11A 4o7gA-2ypbB:
undetectable
4o7gB-2ypbB:
undetectable		 4o7gA-2ypbB:
15.93
4o7gB-2ypbB:
15.93
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.
3aqe RECEPTOR
ACTIVITY-MODIFYING
PROTEIN 2

(Homo sapiens) 		PF04901
(RAMP) 		4 HIS A 124
ILE A 120
TYR A  93
ARG A  97
 None
 1.35A 4o7gA-3aqeA:
undetectable
4o7gB-3aqeA:
undetectable		 4o7gA-3aqeA:
16.52
4o7gB-3aqeA:
16.52
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.
3aqe RECEPTOR
ACTIVITY-MODIFYING
PROTEIN 2

(Homo sapiens) 		PF04901
(RAMP) 		4 PHE A 121
ILE A 120
TYR A  93
ARG A  97
 None
 1.13A 4o7gA-3aqeA:
undetectable
4o7gB-3aqeA:
undetectable		 4o7gA-3aqeA:
16.52
4o7gB-3aqeA:
16.52
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.
3e2v 3'-5'-EXONUCLEASE

(Saccharomyces
cerevisiae) 		PF01026
(TatD_DNase) 		4 PHE A 180
ILE A 183
ASN A 215
ARG A 272
 None
 1.05A 4o7gA-3e2vA:
undetectable
4o7gB-3e2vA:
undetectable		 4o7gA-3e2vA:
20.26
4o7gB-3e2vA:
20.26
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.
3ff0 PHENAZINE
BIOSYNTHESIS PROTEIN
PHZB 2

(Pseudomonas
aeruginosa) 		PF03284
(PHZA_PHZB) 		4 PHE A 121
HIS A 123
TYR A  27
ARG A  38
 GOL  A 166 (-4.5A)
None
GOL  A 167 (-4.8A)
GOL  A 167 ( 4.6A)
 1.37A 4o7gA-3ff0A:
undetectable
4o7gB-3ff0A:
undetectable		 4o7gA-3ff0A:
19.70
4o7gB-3ff0A:
19.70
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.
3g16 UNCHARACTERIZED
PROTEIN WITH
CYSTATIN-LIKE FOLD

(Methylibium
petroleiphilum) 		PF12680
(SnoaL_2) 		4 PHE A  51
HIS A  40
ILE A  57
TYR A  18
 None
UNL  A 156 ( 4.6A)
None
None
 1.42A 4o7gA-3g16A:
undetectable
4o7gB-3g16A:
undetectable		 4o7gA-3g16A:
20.25
4o7gB-3g16A:
20.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gec PERIOD CIRCADIAN
PROTEIN

(Drosophila
melanogaster) 		PF00989
(PAS)
PF14598
(PAS_11) 		4 PHE A 461
ILE A 463
TYR A 377
PHE A 391
 None
 1.09A 4o7gA-3gecA:
undetectable
4o7gB-3gecA:
undetectable		 4o7gA-3gecA:
21.71
4o7gB-3gecA:
21.71
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.
3gm8 GLYCOSIDE HYDROLASE
FAMILY 2, CANDIDATE
BETA-GLYCOSIDASE

(Bacteroides
vulgatus) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF16355
(DUF4982) 		4 HIS A 311
TYR A 167
ASN A 364
ARG A 168
 None
 1.33A 4o7gA-3gm8A:
undetectable
4o7gB-3gm8A:
undetectable		 4o7gA-3gm8A:
15.59
4o7gB-3gm8A:
15.59
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.
3gor PUTATIVE
METAL-DEPENDENT
HYDROLASE

(Geobacillus
stearothermophilus) 		PF05163
(DinB) 		4 PHE A 150
HIS A  14
ILE A 129
TYR A  10
 None
 1.12A 4o7gA-3gorA:
undetectable
4o7gB-3gorA:
2.4		 4o7gA-3gorA:
20.78
4o7gB-3gorA:
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.
3htx HEN1

(Arabidopsis
thaliana) 		PF13847
(Methyltransf_31) 		4 PHE A 809
ILE A 779
TYR A 924
PHE A 817
 None
SAH  A 951 (-3.9A)
None
None
 1.29A 4o7gA-3htxA:
undetectable
4o7gB-3htxA:
undetectable		 4o7gA-3htxA:
13.37
4o7gB-3htxA:
13.37
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.
3j4s FTSZ/TUBULIN-RELATED
PROTEIN

(Bacillus
thuringiensis) 		PF00091
(Tubulin) 		4 HIS A 249
TYR A  53
PHE A  46
ASN A  48
 None
 1.40A 4o7gA-3j4sA:
undetectable
4o7gB-3j4sA:
undetectable		 4o7gA-3j4sA:
19.75
4o7gB-3j4sA:
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.
3jq3 LOMBRICINE KINASE

(Urechis caupo) 		PF00217
(ATP-gua_Ptrans)
PF02807
(ATP-gua_PtransN) 		4 PHE A  87
HIS A  84
ILE A  80
ASN A 261
 None
 0.95A 4o7gA-3jq3A:
undetectable
4o7gB-3jq3A:
undetectable		 4o7gA-3jq3A:
22.07
4o7gB-3jq3A:
22.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jup PHENAZINE
BIOSYNTHESIS PROTEIN
A/B

(Burkholderia
lata) 		PF03284
(PHZA_PHZB) 		4 PHE A 124
HIS A 126
TYR A  30
ARG A  41
 AKD  A 500 ( 4.7A)
None
None
None
 1.40A 4o7gA-3jupA:
undetectable
4o7gB-3jupA:
undetectable		 4o7gA-3jupA:
20.50
4o7gB-3jupA:
20.50
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.
3kjr DIHYDROFOLATE
REDUCTASE/THYMIDYLAT
E SYNTHASE

(Babesia bovis) 		PF00186
(DHFR_1)
PF00303
(Thymidylat_synt) 		4 PHE A 229
HIS A 226
ILE A 168
ARG A 145
 None
 1.18A 4o7gA-3kjrA:
undetectable
4o7gB-3kjrA:
undetectable		 4o7gA-3kjrA:
20.47
4o7gB-3kjrA:
20.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3p8a UNCHARACTERIZED
PROTEIN

(Staphylococcus
aureus) 		PF13468
(Glyoxalase_3) 		4 PHE A 166
ILE A 168
ASN A  60
ARG A 177
 None
None
GOL  A 275 (-3.5A)
None
 0.98A 4o7gA-3p8aA:
undetectable
4o7gB-3p8aA:
undetectable		 4o7gA-3p8aA:
20.07
4o7gB-3p8aA:
20.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pam TRANSMEMBRANE
PROTEIN

(Bartonella
henselae) 		PF00496
(SBP_bac_5) 		4 PHE A 462
ILE A 568
ASN A 416
ARG A 361
 None
 1.21A 4o7gA-3pamA:
undetectable
4o7gB-3pamA:
undetectable		 4o7gA-3pamA:
25.80
4o7gB-3pamA:
25.80
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.
3pu5 EXTRACELLULAR
SOLUTE-BINDING
PROTEIN

(Bordetella
parapertussis) 		PF13416
(SBP_bac_8) 		4 PHE A 159
ILE A 142
PHE A 173
ASN A 175
 PHE  A 159 ( 1.3A)
ILE  A 142 ( 0.6A)
PHE  A 173 ( 1.3A)
ASN  A 175 ( 0.6A)
 1.27A 4o7gA-3pu5A:
undetectable
4o7gB-3pu5A:
undetectable		 4o7gA-3pu5A:
21.96
4o7gB-3pu5A:
21.96
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.
3qtn UNCHARACTERIZED
PROTEIN C4B3.07

(Schizosaccharomyces
pombe) 		PF12753
(Nro1) 		4 PHE B  93
HIS B  97
ILE B  96
ASN B 142
 None
 1.38A 4o7gA-3qtnB:
3.0
4o7gB-3qtnB:
3.8		 4o7gA-3qtnB:
22.16
4o7gB-3qtnB:
22.16
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.
3qvn MANGANESE-CONTAINING
SUPEROXIDE DISMUTASE

(Candida
albicans) 		PF00081
(Sod_Fe_N)
PF02777
(Sod_Fe_C) 		4 ILE A  24
TYR A 187
PHE A  83
ASN A  86
 None
 1.38A 4o7gA-3qvnA:
undetectable
4o7gB-3qvnA:
undetectable		 4o7gA-3qvnA:
20.63
4o7gB-3qvnA:
20.63
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.
3r4r HYPOTHETICAL
FIMBRIAL ASSEMBLY
PROTEIN

(Parabacteroides
distasonis) 		PF06321
(P_gingi_FimA) 		4 PHE A 136
ILE A 154
TYR A 254
ASN A  68
 None
EDO  A 325 ( 4.4A)
None
None
 1.32A 4o7gA-3r4rA:
undetectable
4o7gB-3r4rA:
undetectable		 4o7gA-3r4rA:
22.55
4o7gB-3r4rA:
22.55
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.
3su8 PLEXIN-B1

(Homo sapiens) 		PF08337
(Plexin_cytopl) 		4 PHE X1652
ILE X1693
TYR X1568
PHE X1576
 None
 1.24A 4o7gA-3su8X:
undetectable
4o7gB-3su8X:
undetectable		 4o7gA-3su8X:
16.92
4o7gB-3su8X:
16.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3u62 SHIKIMATE
DEHYDROGENASE

(Thermotoga
maritima) 		PF01488
(Shikimate_DH)
PF08501
(Shikimate_dh_N) 		4 PHE A  23
HIS A  30
ILE A 238
ASN A  57
 None
 1.10A 4o7gA-3u62A:
undetectable
4o7gB-3u62A:
undetectable		 4o7gA-3u62A:
20.00
4o7gB-3u62A:
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.
3v70 GTPASE IMAP FAMILY
MEMBER 1

(Homo sapiens) 		PF04548
(AIG1) 		4 PHE A 151
ILE A 149
PHE A 124
ASN A 171
 None
 1.40A 4o7gA-3v70A:
undetectable
4o7gB-3v70A:
undetectable		 4o7gA-3v70A:
19.77
4o7gB-3v70A:
19.77
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.
3vtg HIGH CHORIOLYTIC
ENZYME 1

(Oryzias latipes) 		PF01400
(Astacin) 		4 HIS A 154
ILE A 179
TYR A 147
ASN A 123
 None
 1.17A 4o7gA-3vtgA:
undetectable
4o7gB-3vtgA:
undetectable		 4o7gA-3vtgA:
20.90
4o7gB-3vtgA:
20.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zby P450 HEME-THIOLATE
PROTEIN

(Mycolicibacterium
smegmatis) 		PF00067
(p450) 		4 PHE A 382
ILE A  68
PHE A 308
ARG A 285
 None
None
HEM  A1402 ( 4.4A)
HEM  A1402 (-3.2A)
 1.11A 4o7gA-3zbyA:
undetectable
4o7gB-3zbyA:
1.3		 4o7gA-3zbyA:
21.14
4o7gB-3zbyA:
21.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zx2 ECTONUCLEOSIDE
TRIPHOSPHATE
DIPHOSPHOHYDROLASE 1

(Rattus
norvegicus) 		PF01150
(GDA1_CD39) 		4 PHE A 222
ILE A 220
PHE A 430
ASN A 429
 None
 1.28A 4o7gA-3zx2A:
undetectable
4o7gB-3zx2A:
undetectable		 4o7gA-3zx2A:
19.00
4o7gB-3zx2A:
19.00
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.
4amq L544

(Acanthamoeba
polyphaga
mimivirus) 		no annotation 4 PHE A  35
ILE A  31
TYR A  29
ARG A  26
 None
 1.43A 4o7gA-4amqA:
2.5
4o7gB-4amqA:
2.5		 4o7gA-4amqA:
19.42
4o7gB-4amqA:
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.
4c7u SUPEROXIDE DISMUTASE
[MN] 1,
MITOCHONDRIAL

(Arabidopsis
thaliana) 		PF00081
(Sod_Fe_N)
PF02777
(Sod_Fe_C) 		4 ILE A  18
TYR A 180
PHE A  77
ASN A  80
 None
 1.42A 4o7gA-4c7uA:
undetectable
4o7gB-4c7uA:
undetectable		 4o7gA-4c7uA:
21.43
4o7gB-4c7uA:
21.43
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.
4ccd GALACTOCEREBROSIDASE

(Mus musculus) 		PF02057
(Glyco_hydro_59)
PF17387
(Glyco_hydro_59M) 		4 PHE A  39
HIS A  80
ILE A  42
ASN A 277
 None
 1.33A 4o7gA-4ccdA:
undetectable
4o7gB-4ccdA:
undetectable		 4o7gA-4ccdA:
15.94
4o7gB-4ccdA:
15.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4epi PESTICIN, LYSOZYME
CHIMERA

(Yersinia
pestis;
Escherichia
virus T4) 		PF00959
(Phage_lysozyme) 		4 PHE A 269
ILE A 265
TYR A 253
ASN A 233
 None
 1.27A 4o7gA-4epiA:
undetectable
4o7gB-4epiA:
undetectable		 4o7gA-4epiA:
20.11
4o7gB-4epiA:
20.11
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.
4ewt PEPTIDASE,
M20/M25/M40 FAMILY

(Staphylococcus
aureus) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		4 PHE A  79
HIS A 134
ILE A  60
TYR A  44
 None
 1.43A 4o7gA-4ewtA:
undetectable
4o7gB-4ewtA:
undetectable		 4o7gA-4ewtA:
20.25
4o7gB-4ewtA:
20.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4f6e SUPEROXIDE DISMUTASE
[MN], MITOCHONDRIAL

(Saccharomyces
cerevisiae) 		PF00081
(Sod_Fe_N)
PF02777
(Sod_Fe_C) 		4 ILE A  18
TYR A 185
PHE A  84
ASN A  87
 None
 1.44A 4o7gA-4f6eA:
undetectable
4o7gB-4f6eA:
undetectable		 4o7gA-4f6eA:
19.26
4o7gB-4f6eA:
19.26
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.
4g2u ANCYLOSTOMA-SECRETED
PROTEIN-LIKE PROTEIN

(Ostertagia
ostertagi) 		PF00188
(CAP) 		4 PHE A  21
HIS A  22
ILE A 137
TYR A 166
 None
 0.80A 4o7gA-4g2uA:
undetectable
4o7gB-4g2uA:
undetectable		 4o7gA-4g2uA:
19.69
4o7gB-4g2uA:
19.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hjl NAPHTHALENE
1,2-DIOXYGENASE
SUBUNIT ALPHA

(Pseudomonas sp.
C18) 		PF00355
(Rieske)
PF00848
(Ring_hydroxyl_A) 		4 PHE A 174
ILE A 331
PHE A  41
ASN A 304
 None
 1.07A 4o7gA-4hjlA:
undetectable
4o7gB-4hjlA:
undetectable		 4o7gA-4hjlA:
19.55
4o7gB-4hjlA:
19.55
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.
4ijm CIRCADIAN CLOCK
PROTEIN KINASE KAIC

(Synechococcus
elongatus) 		PF06745
(ATPase) 		4 PHE A 412
ILE A 377
TYR A 317
PHE A 395
 None
 1.39A 4o7gA-4ijmA:
undetectable
4o7gB-4ijmA:
undetectable		 4o7gA-4ijmA:
17.72
4o7gB-4ijmA:
17.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4l37 SILKWORM STORAGE
PROTEIN

(Bombyx mori) 		PF00372
(Hemocyanin_M)
PF03722
(Hemocyanin_N)
PF03723
(Hemocyanin_C) 		4 ILE A 206
TYR A 257
ASN A 201
ARG A 261
 None
None
None
NA  A 707 ( 4.5A)
 1.04A 4o7gA-4l37A:
undetectable
4o7gB-4l37A:
undetectable		 4o7gA-4l37A:
17.11
4o7gB-4l37A:
17.11
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.
4mr0 PLASMIN AND
FIBRONECTIN-BINDING
PROTEIN A

(Streptococcus
pneumoniae) 		PF12708
(Pectate_lyase_3)
PF13229
(Beta_helix) 		4 PHE A 558
ILE A 542
PHE A 587
ASN A 588
 None
 1.23A 4o7gA-4mr0A:
undetectable
4o7gB-4mr0A:
undetectable		 4o7gA-4mr0A:
16.36
4o7gB-4mr0A:
16.36
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.
4n0l PREDICTED COMPONENT
OF A
THERMOPHILE-SPECIFIC
DNA REPAIR SYSTEM,
CONTAINS A RAMP
DOMAIN

(Methanopyrus
kandleri) 		PF03787
(RAMPs) 		4 PHE A  62
ILE A 120
TYR A 230
ARG A 171
 None
 1.36A 4o7gA-4n0lA:
undetectable
4o7gB-4n0lA:
undetectable		 4o7gA-4n0lA:
20.87
4o7gB-4n0lA:
20.87
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.
4n5c CARGO-TRANSPORT
PROTEIN YPP1

(Saccharomyces
cerevisiae) 		no annotation 4 PHE A 218
ILE A 179
TYR A 275
PHE A 188
 None
 1.29A 4o7gA-4n5cA:
4.0
4o7gB-4n5cA:
4.0		 4o7gA-4n5cA:
14.50
4o7gB-4n5cA:
14.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4n9n STEROL UPTAKE
CONTROL PROTEIN 2,
LYSOZYME

(Saccharomyces
cerevisiae;
Escherichia
virus T4) 		PF00959
(Phage_lysozyme)
PF11951
(Fungal_trans_2) 		4 PHE A1104
ILE A1100
TYR A1088
ASN A1068
 None
 1.27A 4o7gA-4n9nA:
undetectable
4o7gB-4n9nA:
undetectable		 4o7gA-4n9nA:
19.86
4o7gB-4n9nA:
19.86
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4o79 PROBABLE
TRANSMEMBRANE
ASCORBATE
FERRIREDUCTASE 2

(Arabidopsis
thaliana) 		PF03188
(Cytochrom_B561) 		6 PHE A 105
HIS A 106
ILE A 111
TYR A 115
PHE A 182
ASN A 186
 None
HEM  A 301 (-3.8A)
None
HEM  A 301 ( 4.8A)
None
None
 0.25A 4o7gA-4o79A:
36.9
4o7gB-4o79A:
36.0		 4o7gA-4o79A:
100.00
4o7gB-4o79A:
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.
4oet PUTATIVE PEPTIDE
ABC-TRANSPORT SYSTEM
PERIPLASMIC
PEPTIDE-BINDING
PROTEIN

(Campylobacter
jejuni) 		PF00496
(SBP_bac_5) 		4 ILE A 382
TYR A 241
PHE A 398
ASN A 412
 None
 1.30A 4o7gA-4oetA:
undetectable
4o7gB-4oetA:
undetectable		 4o7gA-4oetA:
18.40
4o7gB-4oetA:
18.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4p08 COCAINE ESTERASE

(Rhodococcus sp.
MB1) 		PF02129
(Peptidase_S15)
PF08530
(PepX_C) 		4 PHE A  84
ILE A 170
PHE A  78
ASN A  42
 None
 1.19A 4o7gA-4p08A:
undetectable
4o7gB-4p08A:
undetectable		 4o7gA-4p08A:
18.98
4o7gB-4p08A:
18.98
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.
4pbo C-REACTIVE PROTEIN

(Danio rerio) 		PF00354
(Pentaxin) 		4 PHE A  33
ILE A 128
PHE A  52
ASN A  63
 None
 1.42A 4o7gA-4pboA:
undetectable
4o7gB-4pboA:
undetectable		 4o7gA-4pboA:
19.28
4o7gB-4pboA:
19.28
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.
4rct RESTRICTION
ENDONUCLEASE
R.NGOVII

(Neisseria
gonorrhoeae) 		PF09565
(RE_NgoFVII) 		4 PHE A  26
HIS A  56
ILE A  57
ARG A  92
 None
 1.39A 4o7gA-4rctA:
undetectable
4o7gB-4rctA:
undetectable		 4o7gA-4rctA:
20.81
4o7gB-4rctA:
20.81
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.
4rkr TRANSCRIPTIONAL
REGULATOR, LACI
FAMILY

(Arthrobacter
sp. FB24) 		PF13377
(Peripla_BP_3) 		4 HIS A 333
TYR A 167
ASN A  82
ARG A 206
 None
None
LBT  A 401 (-3.3A)
LBT  A 401 (-2.8A)
 1.00A 4o7gA-4rkrA:
undetectable
4o7gB-4rkrA:
undetectable		 4o7gA-4rkrA:
22.90
4o7gB-4rkrA:
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.
4rlz CAPSID PROTEIN

(Norwalk virus) 		PF00915
(Calici_coat)
PF08435
(Calici_coat_C) 		4 PHE A 397
ILE A 444
PHE A 240
ASN A 237
 None
 1.19A 4o7gA-4rlzA:
undetectable
4o7gB-4rlzA:
undetectable		 4o7gA-4rlzA:
22.91
4o7gB-4rlzA:
22.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4uv6 APICAL MEROZOITE
ANTIGEN 1

(Plasmodium
knowlesi) 		PF02430
(AMA-1) 		4 ILE A 138
TYR A 147
PHE A 169
ARG A 146
 None
 1.06A 4o7gA-4uv6A:
undetectable
4o7gB-4uv6A:
undetectable		 4o7gA-4uv6A:
20.00
4o7gB-4uv6A:
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.
4v3i VCA0115

(Vibrio cholerae) 		PF09850
(DotU) 		4 PHE A 125
ILE A  70
TYR A  66
ARG A  67
 GOL  A1194 (-4.5A)
None
None
None
 1.44A 4o7gA-4v3iA:
undetectable
4o7gB-4v3iA:
undetectable		 4o7gA-4v3iA:
22.02
4o7gB-4v3iA:
22.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4z11 AURONE SYNTHASE

(Coreopsis
grandiflora) 		PF00264
(Tyrosinase)
PF12142
(PPO1_DWL)
PF12143
(PPO1_KFDV) 		4 PHE A 124
HIS A 125
PHE A 273
ASN A  98
 None
CU  A 700 (-3.2A)
None
None
 1.31A 4o7gA-4z11A:
undetectable
4o7gB-4z11A:
undetectable		 4o7gA-4z11A:
19.43
4o7gB-4z11A:
19.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zng PROLIDASE

(Lactococcus
lactis) 		no annotation 4 ILE C 330
TYR C 286
PHE C 245
ASN C 243
 None
 1.16A 4o7gA-4zngC:
undetectable
4o7gB-4zngC:
undetectable		 4o7gA-4zngC:
21.47
4o7gB-4zngC:
21.47
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.
5clw 1,4-ALPHA-GLUCAN-BRA
NCHING ENZYME

(Homo sapiens) 		PF00128
(Alpha-amylase)
PF02806
(Alpha-amylase_C)
PF02922
(CBM_48) 		4 PHE A 249
HIS A 203
ILE A 206
ASN A 541
 None
 1.31A 4o7gA-5clwA:
undetectable
4o7gB-5clwA:
undetectable		 4o7gA-5clwA:
14.91
4o7gB-5clwA:
14.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5csl ACETYL-COA
CARBOXYLASE

(Saccharomyces
cerevisiae) 		PF00289
(Biotin_carb_N)
PF00364
(Biotin_lipoyl)
PF01039
(Carboxyl_trans)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2)
PF08326
(ACC_central) 		4 PHE A1393
ILE A1347
ASN A1079
ARG A1348
 None
 1.09A 4o7gA-5cslA:
3.2
4o7gB-5cslA:
undetectable		 4o7gA-5cslA:
7.67
4o7gB-5cslA:
7.67
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.
5cyz MONOPOLIN COMPLEX
SUBUNIT MAM1

(Saccharomyces
cerevisiae) 		PF10434
(MAM1) 		4 PHE C 105
ILE C 104
TYR C 158
PHE C 134
 None
 1.31A 4o7gA-5cyzC:
undetectable
4o7gB-5cyzC:
undetectable		 4o7gA-5cyzC:
17.12
4o7gB-5cyzC:
17.12
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.
5dgk ACTIVE HELICASE

(Staphylococcus
aureus) 		PF06048
(DUF927) 		4 PHE A 334
ILE A 330
TYR A 426
PHE A 183
 None
 1.43A 4o7gA-5dgkA:
undetectable
4o7gB-5dgkA:
undetectable		 4o7gA-5dgkA:
18.25
4o7gB-5dgkA:
18.25
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.
5dkc PROBABLE GLOBAL
TRANSCRIPTION
ACTIVATOR SNF2L2

(Homo sapiens) 		PF00439
(Bromodomain) 		4 ILE A1434
TYR A1443
ASN A1459
ARG A1437
 None
 1.38A 4o7gA-5dkcA:
undetectable
4o7gB-5dkcA:
undetectable		 4o7gA-5dkcA:
16.45
4o7gB-5dkcA:
16.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dkd TRANSCRIPTION
ACTIVATOR BRG1

(Homo sapiens) 		PF00439
(Bromodomain) 		4 ILE A1510
TYR A1519
ASN A1535
ARG A1513
 None
None
None
EDO  A1602 (-3.9A)
 1.31A 4o7gA-5dkdA:
undetectable
4o7gB-5dkdA:
undetectable		 4o7gA-5dkdA:
20.00
4o7gB-5dkdA:
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.
5e5d PEPTIDE DEFORMYLASE

(Xanthomonas
oryzae) 		PF01327
(Pep_deformylase) 		4 ILE A 127
TYR A 117
PHE A  61
ARG A 129
 None
 1.32A 4o7gA-5e5dA:
undetectable
4o7gB-5e5dA:
undetectable		 4o7gA-5e5dA:
24.90
4o7gB-5e5dA:
24.90
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.
5e9j MRNA CAP GUANINE-N7
METHYLTRANSFERASE,MR
NA CAP GUANINE-N7
METHYLTRANSFERASE

(Homo sapiens) 		PF03291
(Pox_MCEL) 		4 PHE A 360
ILE A 430
PHE A 336
ASN A 338
 None
 1.39A 4o7gA-5e9jA:
undetectable
4o7gB-5e9jA:
undetectable		 4o7gA-5e9jA:
21.38
4o7gB-5e9jA:
21.38
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.
5hax NUCLEOPORIN NUP170

(Chaetomium
thermophilum) 		PF08801
(Nucleoporin_N) 		4 PHE A 601
ILE A 578
ASN A 585
ARG A 573
 None
 1.20A 4o7gA-5haxA:
2.7
4o7gB-5haxA:
2.2		 4o7gA-5haxA:
15.50
4o7gB-5haxA:
15.50
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.
5kob PEPTIDE DEFORMYLASE

(Paraburkholderia
xenovorans) 		PF01327
(Pep_deformylase) 		4 ILE A 127
TYR A 117
PHE A  61
ARG A 129
 None
 1.33A 4o7gA-5kobA:
undetectable
4o7gB-5kobA:
undetectable		 4o7gA-5kobA:
19.41
4o7gB-5kobA:
19.41
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.
5lc5 NADH-UBIQUINONE
OXIDOREDUCTASE CHAIN
1

(Bos taurus) 		PF00146
(NADHdh) 		4 HIS H 247
ILE H 166
TYR H 255
ASN H  97
 None
 1.44A 4o7gA-5lc5H:
undetectable
4o7gB-5lc5H:
undetectable		 4o7gA-5lc5H:
22.57
4o7gB-5lc5H:
22.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5m86 TA1207

(Thermoplasma
acidophilum) 		no annotation 4 PHE A 190
ILE A 189
TYR A 216
ASN A 261
 None
 1.18A 4o7gA-5m86A:
undetectable
4o7gB-5m86A:
undetectable		 4o7gA-5m86A:
22.02
4o7gB-5m86A:
22.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mr4 GDNF FAMILY RECEPTOR
ALPHA-2

(Homo sapiens) 		no annotation 4 ILE C 317
TYR C 309
ASN C 357
ARG C 233
 None
 1.32A 4o7gA-5mr4C:
undetectable
4o7gB-5mr4C:
undetectable		 4o7gA-5mr4C:
undetectable
4o7gB-5mr4C:
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.
5n05 AUXILIARY ACTIVITY 9

(Lentinus
similis) 		PF03443
(Glyco_hydro_61) 		4 PHE A 102
HIS A 125
ILE A  82
ASN A 107
 None
 1.35A 4o7gA-5n05A:
undetectable
4o7gB-5n05A:
undetectable		 4o7gA-5n05A:
21.76
4o7gB-5n05A:
21.76
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.
5t0l BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE

(Toxoplasma
gondii) 		PF00186
(DHFR_1)
PF00303
(Thymidylat_synt) 		4 PHE A 325
HIS A 322
ILE A 232
ARG A 173
 None
 1.34A 4o7gA-5t0lA:
undetectable
4o7gB-5t0lA:
undetectable		 4o7gA-5t0lA:
18.65
4o7gB-5t0lA:
18.65
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.
5whg PROTEIN VMS1

(Saccharomyces
cerevisiae) 		no annotation 4 PHE A 211
ILE A 206
PHE A  21
ASN A 227
 None
 1.28A 4o7gA-5whgA:
undetectable
4o7gB-5whgA:
undetectable		 4o7gA-5whgA:
18.46
4o7gB-5whgA:
18.46
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.
5wwp ORF1AB

(Middle East
respiratory
syndrome-related
coronavirus) 		no annotation 4 PHE B 587
ILE B 572
PHE B 561
ASN B 562
 None
 1.42A 4o7gA-5wwpB:
undetectable
4o7gB-5wwpB:
undetectable		 4o7gA-5wwpB:
18.02
4o7gB-5wwpB:
18.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5x00 NUCLEOSIDE
DIPHOSPHATE KINASE

(Vibrio cholerae) 		no annotation 4 PHE A   7
HIS A 117
ILE A   9
TYR A  51
 None
 1.40A 4o7gA-5x00A:
undetectable
4o7gB-5x00A:
undetectable		 4o7gA-5x00A:
undetectable
4o7gB-5x00A:
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.
5y10 MEMBRANE
GLYCOPROTEIN
POLYPROTEIN

(SFTS
phlebovirus) 		PF07243
(Phlebovirus_G1) 		4 PHE C 135
ILE C 239
TYR C 318
ASN C 214
 None
 1.18A 4o7gA-5y10C:
undetectable
4o7gB-5y10C:
undetectable		 4o7gA-5y10C:
20.18
4o7gB-5y10C:
20.18
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.
6brm PUTATIVE
METAL-DEPENDENT
ISOTHIOCYANATE
HYDROLASE SAXA

(Pectobacterium
carotovorum) 		no annotation 4 HIS A 128
ILE A 198
PHE A  35
ASN A 226
 ZN  A 301 (-3.3A)
None
FMT  A 303 (-4.1A)
None
 1.31A 4o7gA-6brmA:
undetectable
4o7gB-6brmA:
undetectable		 4o7gA-6brmA:
undetectable
4o7gB-6brmA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6f5o POLYMERASE ACIDIC
PROTEIN

(Influenza B
virus) 		no annotation 4 PHE A 654
ILE A 686
PHE A 703
ASN A 704
 None
 0.96A 4o7gA-6f5oA:
undetectable
4o7gB-6f5oA:
undetectable		 4o7gA-6f5oA:
undetectable
4o7gB-6f5oA:
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.
6fos PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A1
PHOTOSYSTEM I
IRON-SULFUR CENTER
SUBUNIT VII

(Cyanidioschyzon
merolae;
Cyanidioschyzon
merolae) 		no annotation
no annotation 		4 PHE E  40
TYR E  45
ASN A 702
ARG A 713
 None
 1.26A 4o7gA-6fosE:
undetectable
4o7gB-6fosE:
undetectable		 4o7gA-6fosE:
undetectable
4o7gB-6fosE:
undetectable