SIMILAR PATTERNS OF AMINO ACIDS FOR 2DXR_A_SORA1002

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
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1biy LACTOFERRIN

(Bubalus bubalis) 		PF00405
(Transferrin) 		3 THR A 430
PRO A 593
TYR A 660
 None
 0.28A 2dxrA-1biyA:
41.0		 2dxrA-1biyA:
91.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1dxy D-2-HYDROXYISOCAPROA
TE DEHYDROGENASE

(Lactobacillus
casei) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		3 THR A 153
PRO A 178
TYR A 188
 None
 0.98A 2dxrA-1dxyA:
1.9		 2dxrA-1dxyA:
22.96
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.
1feh PROTEIN (PERIPLASMIC
HYDROGENASE 1)

(Clostridium
pasteurianum) 		PF02256
(Fe_hyd_SSU)
PF02906
(Fe_hyd_lg_C)
PF12838
(Fer4_7)
PF13510
(Fer2_4) 		3 THR A 250
PRO A 231
TYR A 410
 None
HC1  A 580 (-3.5A)
None
 0.93A 2dxrA-1fehA:
undetectable		 2dxrA-1fehA:
19.34
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.
1fep FERRIC ENTEROBACTIN
RECEPTOR

(Escherichia
coli) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		3 THR A 146
PRO A 115
TYR A 192
 None
 0.68A 2dxrA-1fepA:
undetectable		 2dxrA-1fepA:
18.43
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.
1fp9 4-ALPHA-GLUCANOTRANS
FERASE

(Thermus
thermophilus) 		PF02446
(Glyco_hydro_77) 		3 THR A 188
PRO A  51
TYR A 141
 None
 0.95A 2dxrA-1fp9A:
0.0		 2dxrA-1fp9A:
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.
1gq8 PECTINESTERASE

(Daucus carota) 		PF01095
(Pectinesterase) 		3 THR A 186
PRO A 226
TYR A 263
 None
 0.85A 2dxrA-1gq8A:
0.0		 2dxrA-1gq8A:
22.22
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.
1n94 PROTEIN
FARNESYLTRANSFERASE
BETA SUBUNIT

(Rattus
norvegicus) 		PF00432
(Prenyltrans) 		3 THR B 153
PRO B 148
TYR B 180
 None
 0.88A 2dxrA-1n94B:
undetectable		 2dxrA-1n94B:
23.18
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.
1nst HEPARAN SULFATE
N-DEACETYLASE/N-SULF
OTRANSFERASE

(Homo sapiens) 		PF00685
(Sulfotransfer_1) 		3 THR A 615
PRO A 706
TYR A 757
 A3P  A 301 (-4.9A)
None
None
 0.92A 2dxrA-1nstA:
0.0		 2dxrA-1nstA:
21.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ohf NUDAURELIA CAPENSIS
OMEGA VIRUS CAPSID
PROTEIN

(Nudaurelia
capensis omega
virus) 		PF03566
(Peptidase_A21) 		3 THR A 102
PRO A  98
TYR A 523
 None
 0.97A 2dxrA-1ohfA:
0.0		 2dxrA-1ohfA:
20.49
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.
1rrh SEED LIPOXYGENASE-3

(Glycine max) 		PF00305
(Lipoxygenase)
PF01477
(PLAT) 		3 THR A 792
PRO A 542
TYR A 647
 None
 0.97A 2dxrA-1rrhA:
undetectable		 2dxrA-1rrhA:
18.14
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.
1rvk ISOMERASE/LACTONIZIN
G ENZYME

(Agrobacterium
fabrum) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 THR A 172
PRO A 181
TYR A 211
 None
 0.88A 2dxrA-1rvkA:
undetectable		 2dxrA-1rvkA:
20.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1t3q QUINOLINE
2-OXIDOREDUCTASE
LARGE SUBUNIT

(Pseudomonas
putida) 		PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2) 		3 THR B 109
PRO B  51
TYR B 138
 None
 0.81A 2dxrA-1t3qB:
undetectable		 2dxrA-1t3qB:
18.91
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.
1w07 ACYL-COA OXIDASE

(Arabidopsis
thaliana) 		PF01756
(ACOX)
PF02770
(Acyl-CoA_dh_M)
PF14749
(Acyl-CoA_ox_N) 		3 THR A 385
PRO A 419
TYR A 423
 None
FAD  A1660 (-4.5A)
None
 0.94A 2dxrA-1w07A:
undetectable		 2dxrA-1w07A:
19.21
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.
1x5y MYOSIN BINDING
PROTEIN C, FAST-TYPE

(Mus musculus) 		PF00041
(fn3) 		3 THR A   9
PRO A  12
TYR A  43
 None
 0.86A 2dxrA-1x5yA:
undetectable		 2dxrA-1x5yA:
17.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xg2 PECTINESTERASE 1

(Solanum
lycopersicum) 		PF01095
(Pectinesterase) 		3 THR A 182
PRO A 222
TYR A 259
 None
 0.81A 2dxrA-1xg2A:
undetectable		 2dxrA-1xg2A:
19.45
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.
2cs7 PNEUMOCOCCAL
HISTIDINE TRIAD A
PROTEIN

(Streptococcus
pneumoniae) 		PF04270
(Strep_his_triad) 		3 THR A  20
PRO A  36
TYR A  34
 None
 0.98A 2dxrA-2cs7A:
undetectable		 2dxrA-2cs7A:
8.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2dm4 SORTILIN-RELATED
RECEPTOR

(Homo sapiens) 		PF00041
(fn3) 		3 THR A  36
PRO A  11
TYR A  43
 None
 0.92A 2dxrA-2dm4A:
undetectable		 2dxrA-2dm4A:
17.33
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.
2e0p ENDOGLUCANASE

(Ruminiclostridium
thermocellum) 		PF12891
(Glyco_hydro_44) 		3 THR A  91
PRO A  86
TYR A 164
 None
 0.65A 2dxrA-2e0pA:
undetectable		 2dxrA-2e0pA:
23.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2egc SH3 AND PX
DOMAIN-CONTAINING
PROTEIN 2A

(Homo sapiens) 		PF07653
(SH3_2) 		3 THR A  25
PRO A  61
TYR A  19
 None
 0.87A 2dxrA-2egcA:
undetectable		 2dxrA-2egcA:
14.11
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.
2gl5 PUTATIVE DEHYDRATASE
PROTEIN

(Salmonella
enterica) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 THR A 272
PRO A 296
TYR A 282
 None
 0.90A 2dxrA-2gl5A:
undetectable		 2dxrA-2gl5A:
22.65
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.
2hdw HYPOTHETICAL PROTEIN
PA2218

(Pseudomonas
aeruginosa) 		PF02129
(Peptidase_S15) 		3 THR A 202
PRO A 104
TYR A 348
 None
 0.97A 2dxrA-2hdwA:
undetectable		 2dxrA-2hdwA:
18.96
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.
2inr DNA TOPOISOMERASE 4
SUBUNIT A

(Staphylococcus
aureus) 		PF00521
(DNA_topoisoIV) 		3 THR A 169
PRO A 180
TYR A 326
 None
 0.97A 2dxrA-2inrA:
undetectable		 2dxrA-2inrA:
19.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2iuj LIPOXYGENASE L-5

(Glycine max) 		PF00305
(Lipoxygenase)
PF01477
(PLAT) 		3 THR A 788
PRO A 537
TYR A 642
 None
 0.96A 2dxrA-2iujA:
undetectable		 2dxrA-2iujA:
17.17
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.
2qvw GLP_546_48378_50642

(Giardia
intestinalis) 		PF00636
(Ribonuclease_3)
PF02170
(PAZ) 		3 THR A 161
PRO A 243
TYR A 197
 None
 0.92A 2dxrA-2qvwA:
undetectable		 2dxrA-2qvwA:
19.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2r9l PUTATIVE DNA
LIGASE-LIKE PROTEIN

(Mycobacterium
tuberculosis) 		no annotation 3 THR A 237
PRO A 240
TYR A 180
 EDO  A 295 (-4.1A)
None
None
 0.83A 2dxrA-2r9lA:
undetectable		 2dxrA-2r9lA:
23.55
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.
2v7y CHAPERONE PROTEIN
DNAK

(Geobacillus
kaustophilus) 		PF00012
(HSP70) 		3 THR A  36
PRO A  28
TYR A 100
 None
 0.94A 2dxrA-2v7yA:
undetectable		 2dxrA-2v7yA:
21.10
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.
2x1i 4-ALPHA-GLUCANOTRANS
FERASE

(Thermus
brockianus) 		PF02446
(Glyco_hydro_77) 		3 THR A 188
PRO A  51
TYR A 141
 None
 0.97A 2dxrA-2x1iA:
undetectable		 2dxrA-2x1iA:
20.04
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.
2yoy RBAM17540

(Bacillus
amyloliquefaciens) 		PF03067
(LPMO_10) 		3 THR A 135
PRO A 141
TYR A 180
 None
 0.92A 2dxrA-2yoyA:
undetectable		 2dxrA-2yoyA:
19.88
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.
3abg BILIRUBIN OXIDASE

(Albifimbria
verrucaria) 		PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		3 THR A  12
PRO A 210
TYR A   8
 None
 0.88A 2dxrA-3abgA:
undetectable		 2dxrA-3abgA:
19.48
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.
3av6 DNA
(CYTOSINE-5)-METHYLT
RANSFERASE 1

(Mus musculus) 		PF00145
(DNA_methylase)
PF01426
(BAH)
PF02008
(zf-CXXC)
PF12047
(DNMT1-RFD) 		3 THR A 540
PRO A 543
TYR A 513
 None
 0.95A 2dxrA-3av6A:
undetectable		 2dxrA-3av6A:
13.72
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.
3b9t TWIN-ARGININE
TRANSLOCATION
PATHWAY SIGNAL
PROTEIN

(Methylobacillus
flagellatus) 		PF03069
(FmdA_AmdA) 		3 THR A 361
PRO A  76
TYR A  74
 EDO  A 489 (-4.3A)
None
None
 0.80A 2dxrA-3b9tA:
undetectable		 2dxrA-3b9tA:
20.96
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.
3bb8 CDP-4-KETO-6-DEOXY-D
-GLUCOSE-3-DEHYDRASE

(Yersinia
pseudotuberculosis) 		PF01041
(DegT_DnrJ_EryC1) 		3 THR A 408
PRO A 348
TYR A 144
 None
 0.91A 2dxrA-3bb8A:
undetectable		 2dxrA-3bb8A:
21.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cjx PROTEIN OF UNKNOWN
FUNCTION WITH A
CUPIN-LIKE FOLD

(Cupriavidus
pinatubonensis) 		no annotation 3 THR A  58
PRO A 106
TYR A  78
 None
 0.84A 2dxrA-3cjxA:
undetectable		 2dxrA-3cjxA:
19.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3h6z POLYCOMB PROTEIN
SFMBT

(Drosophila
melanogaster) 		PF02820
(MBT) 		3 THR A 819
PRO A 817
TYR A 884
 None
 0.84A 2dxrA-3h6zA:
undetectable		 2dxrA-3h6zA:
21.26
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.
3ik2 ENDOGLUCANASE A

(Clostridium
acetobutylicum) 		PF12891
(Glyco_hydro_44) 		3 THR A  85
PRO A  80
TYR A 158
 None
 0.78A 2dxrA-3ik2A:
undetectable		 2dxrA-3ik2A:
20.19
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.
3jq1 SUSD SUPERFAMILY
PROTEIN

(Bacteroides
vulgatus) 		PF07980
(SusD_RagB)
PF14322
(SusD-like_3) 		3 THR A 503
PRO A 497
TYR A 109
 None
 0.89A 2dxrA-3jq1A:
undetectable		 2dxrA-3jq1A:
20.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kom TRANSKETOLASE

(Francisella
tularensis) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		3 THR A  40
PRO A   6
TYR A 295
 None
 0.93A 2dxrA-3komA:
0.7		 2dxrA-3komA:
19.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3l6g BETAINE ABC
TRANSPORTER PERMEASE
AND SUBSTRATE
BINDING PROTEIN

(Lactococcus
lactis) 		PF04069
(OpuAC) 		3 THR A 504
PRO A 501
TYR A 449
 None
 0.92A 2dxrA-3l6gA:
5.7		 2dxrA-3l6gA:
21.25
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.
3mde MEDIUM CHAIN
ACYL-COA
DEHYDROGENASE

(Sus scrofa) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		3 THR A 255
PRO A 107
TYR A 133
 None
 0.82A 2dxrA-3mdeA:
undetectable		 2dxrA-3mdeA:
20.43
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.
3mv3 COATOMER SUBUNIT
ALPHA

(Saccharomyces
cerevisiae) 		PF06957
(COPI_C) 		3 THR A1073
PRO A1143
TYR A1104
 None
 0.89A 2dxrA-3mv3A:
undetectable		 2dxrA-3mv3A:
22.14
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.
3pg5 UNCHARACTERIZED
PROTEIN

(Corynebacterium
diphtheriae) 		PF13614
(AAA_31) 		3 THR A  75
PRO A 111
TYR A  58
 None
 0.86A 2dxrA-3pg5A:
undetectable		 2dxrA-3pg5A:
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.
3pmq DECAHEME CYTOCHROME
C MTRF

(Shewanella
oneidensis) 		no annotation 3 THR A  95
PRO A  91
TYR A 184
 None
 0.81A 2dxrA-3pmqA:
undetectable		 2dxrA-3pmqA:
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.
3poy NEUREXIN-1-ALPHA

(Bos taurus) 		PF00008
(EGF)
PF02210
(Laminin_G_2) 		3 THR A1058
PRO A1063
TYR A 967
 None
 0.77A 2dxrA-3poyA:
undetectable		 2dxrA-3poyA:
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.
3qcw NEUREXIN-1-ALPHA

(Bos taurus) 		PF00008
(EGF)
PF02210
(Laminin_G_2) 		3 THR A1042
PRO A1047
TYR A 951
 None
 0.72A 2dxrA-3qcwA:
undetectable		 2dxrA-3qcwA:
13.91
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.
3s6p CAPSID PROTEIN

(Helicoverpa
armigera stunt
virus) 		PF03566
(Peptidase_A21) 		3 THR A 105
PRO A 101
TYR A 528
 None
 0.97A 2dxrA-3s6pA:
undetectable		 2dxrA-3s6pA:
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.
3tpa HEME-BINDING PROTEIN
A

(Glaesserella
parasuis) 		PF00496
(SBP_bac_5) 		3 THR A 371
PRO A 366
TYR A 306
 None
 0.93A 2dxrA-3tpaA:
2.2		 2dxrA-3tpaA:
19.96
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.
3waj TRANSMEMBRANE
OLIGOSACCHARYL
TRANSFERASE

(Archaeoglobus
fulgidus) 		PF02516
(STT3) 		3 THR A  58
PRO A  63
TYR A  88
 None
 0.94A 2dxrA-3wajA:
undetectable		 2dxrA-3wajA:
17.93
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.
3woe PUTATIVE
UNCHARACTERIZED
PROTEIN

(Thermus virus
P23-45) 		no annotation 3 THR B  33
PRO B  36
TYR B  27
 None
 0.97A 2dxrA-3woeB:
undetectable		 2dxrA-3woeB:
12.91
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.
3wtr UNCHARACTERIZED
PROTEIN

(Escherichia
coli) 		PF04315
(EpmC) 		3 THR A  24
PRO A  37
TYR A  35
 None
 0.89A 2dxrA-3wtrA:
undetectable		 2dxrA-3wtrA:
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.
3wwy D-LACTATE
DEHYDROGENASE

(Fusobacterium
nucleatum) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		3 THR A 154
PRO A 179
TYR A 191
 None
 0.96A 2dxrA-3wwyA:
1.7		 2dxrA-3wwyA:
22.11
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.
4akr F-ACTIN-CAPPING
PROTEIN SUBUNIT
ALPHA

(Dictyostelium
discoideum) 		PF01267
(F-actin_cap_A) 		3 THR A 220
PRO A 177
TYR A 114
 None
 0.94A 2dxrA-4akrA:
undetectable		 2dxrA-4akrA:
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.
4as3 PHOSPHORYLCHOLINE
PHOSPHATASE

(Pseudomonas
aeruginosa) 		no annotation 3 THR A 195
PRO A 235
TYR A 249
 None
 0.70A 2dxrA-4as3A:
undetectable		 2dxrA-4as3A:
21.12
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.
4b8c GLUCOSE-REPRESSIBLE
ALCOHOL
DEHYDROGENASE
TRANSCRIPTIONAL
EFFECTOR

(Saccharomyces
cerevisiae) 		PF03372
(Exo_endo_phos)
PF13855
(LRR_8) 		3 THR D 772
PRO D 810
TYR D 523
 None
 0.88A 2dxrA-4b8cD:
undetectable		 2dxrA-4b8cD:
19.89
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.
4c60 OCHRATOXINASE

(Aspergillus
niger) 		PF01979
(Amidohydro_1) 		3 THR A 385
PRO A 381
TYR A 154
 None
 0.49A 2dxrA-4c60A:
undetectable		 2dxrA-4c60A:
22.37
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.
4cuk D-LACTATE
DEHYDROGENASE

(Salmonella
enterica) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		3 THR A 152
PRO A 177
TYR A 188
 None
 0.93A 2dxrA-4cukA:
2.0		 2dxrA-4cukA:
23.59
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.
4df9 PUTATIVE PEPTIDASE

(Bacteroides
fragilis) 		PF09471
(Peptidase_M64)
PF16217
(M64_N) 		3 THR A 361
PRO A 365
TYR A 376
 None
 0.88A 2dxrA-4df9A:
undetectable		 2dxrA-4df9A:
19.24
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.
4eip PUTATIVE
FAD-MONOOXYGENASE

(Lechevalieria
aerocolonigenes) 		PF01494
(FAD_binding_3) 		3 THR A 447
PRO A 437
TYR A 494
 None
 0.95A 2dxrA-4eipA:
undetectable		 2dxrA-4eipA:
19.50
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.
4f53 SUSD HOMOLOG

(Bacteroides
ovatus) 		PF12741
(SusD-like) 		3 THR A 432
PRO A 475
TYR A 290
 None
 0.82A 2dxrA-4f53A:
undetectable		 2dxrA-4f53A:
21.39
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4fim LACTOTRANSFERRIN

(Bos taurus) 		PF00405
(Transferrin) 		3 THR A 430
PRO A 593
TYR A 660
 None
CEL  A 711 (-4.3A)
CEL  A 711 (-4.4A)
 0.16A 2dxrA-4fimA:
58.0		 2dxrA-4fimA:
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.
4i3h TOPOISOMERASE IV
SUBUNIT B, DNA
TOPOISOMERASE 4
SUBUNIT A CHIMERA

(Streptococcus
pneumoniae) 		PF00204
(DNA_gyraseB)
PF00521
(DNA_topoisoIV)
PF00986
(DNA_gyraseB_C)
PF01751
(Toprim)
PF02518
(HATPase_c) 		3 THR A1168
PRO A1180
TYR A1261
 None
 0.96A 2dxrA-4i3hA:
undetectable		 2dxrA-4i3hA:
16.13
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.
4iqn PUTATIVE CYTOPLASMIC
PROTEIN

(Salmonella
enterica) 		PF16728
(DUF5066) 		3 THR C  46
PRO C  49
TYR C 146
 None
 0.94A 2dxrA-4iqnC:
undetectable		 2dxrA-4iqnC:
18.84
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.
4lgl GLYCINE
DEHYDROGENASE
[DECARBOXYLATING]

(Synechocystis
sp. PCC 6803) 		PF02347
(GDC-P) 		3 THR A 111
PRO A 114
TYR A 366
 None
 0.88A 2dxrA-4lglA:
undetectable		 2dxrA-4lglA:
16.11
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.
4lr2 BIS(5'-ADENOSYL)-TRI
PHOSPHATASE ENPP4

(Homo sapiens) 		PF01663
(Phosphodiest) 		3 THR A 122
PRO A 382
TYR A 371
 None
 0.78A 2dxrA-4lr2A:
undetectable		 2dxrA-4lr2A:
21.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4nrd UNCHARACTERIZED
PROTEIN

(Bacteroides
ovatus) 		PF16255
(Lipase_GDSL_lke) 		3 THR A  57
PRO A 208
TYR A  49
 None
 0.97A 2dxrA-4nrdA:
undetectable		 2dxrA-4nrdA:
20.28
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.
4o0l NADPH-DEPENDENT
3-QUINUCLIDINONE
REDUCTASE

(Rhodotorula
mucilaginosa) 		PF13561
(adh_short_C2) 		3 THR A 134
PRO A 179
TYR A 126
 None
 0.95A 2dxrA-4o0lA:
0.5		 2dxrA-4o0lA:
21.19
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.
4p05 ARYLSULFATE
SULFOTRANSFERASE
ASST

(Escherichia
coli) 		PF05935
(Arylsulfotrans)
PF17425
(Arylsulfotran_N) 		3 THR A 141
PRO A 175
TYR A 196
 None
 0.96A 2dxrA-4p05A:
undetectable		 2dxrA-4p05A:
20.37
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.
4p08 COCAINE ESTERASE

(Rhodococcus sp.
MB1) 		PF02129
(Peptidase_S15)
PF08530
(PepX_C) 		3 THR A  74
PRO A  86
TYR A 118
 None
 0.86A 2dxrA-4p08A:
undetectable		 2dxrA-4p08A:
21.39
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.
4qaw XYN30D

(Paenibacillus
barcinonensis) 		PF03422
(CBM_6)
PF17189
(Glyco_hydro_30C) 		3 THR A 146
PRO A  87
TYR A 112
 None
 0.92A 2dxrA-4qawA:
undetectable		 2dxrA-4qawA:
20.84
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.
4qre METHIONYL-TRNA
SYNTHETASE

(Staphylococcus
aureus) 		PF08264
(Anticodon_1)
PF09334
(tRNA-synt_1g) 		3 THR A  48
PRO A  11
TYR A  13
 None
ATP  A 602 ( 4.3A)
ATP  A 602 (-4.5A)
 0.97A 2dxrA-4qreA:
undetectable		 2dxrA-4qreA:
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.
4uf7 GLYCOPROTEIN

(Ghanaian bat
henipavirus) 		PF00423
(HN) 		3 THR A 446
PRO A 390
TYR A 409
 None
 0.97A 2dxrA-4uf7A:
undetectable		 2dxrA-4uf7A:
21.15
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.
4uri CHITINASE-RELATED
AGGLUTININ

(Robinia
pseudoacacia) 		PF00704
(Glyco_hydro_18) 		3 THR A 163
PRO A 118
TYR A 168
 None
 0.96A 2dxrA-4uriA:
undetectable		 2dxrA-4uriA:
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.
4xwh ALPHA-N-ACETYLGLUCOS
AMINIDASE

(Homo sapiens) 		PF05089
(NAGLU)
PF12971
(NAGLU_N)
PF12972
(NAGLU_C) 		3 THR A 263
PRO A 283
TYR A 326
 None
NAG  A2004 (-4.3A)
None
 0.78A 2dxrA-4xwhA:
undetectable		 2dxrA-4xwhA:
17.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ye4 HT593.1 GP120

(Human
immunodeficiency
virus) 		PF00516
(GP120) 		3 THR G 257
PRO G 369
TYR G 384
 None
 0.96A 2dxrA-4ye4G:
undetectable		 2dxrA-4ye4G:
20.10
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.
4yn5 MANNAN
ENDO-1,4-BETA-MANNOS
IDASE

(Bacillus sp.
JAMB750) 		PF02156
(Glyco_hydro_26) 		3 THR A 362
PRO A 375
TYR A 341
 None
 0.88A 2dxrA-4yn5A:
undetectable		 2dxrA-4yn5A:
21.15
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.
4yra L-THREONINE
3-DEHYDROGENASE,
MITOCHONDRIAL

(Mus musculus) 		PF01370
(Epimerase) 		3 THR A 275
PRO A 168
TYR A 128
 None
 0.90A 2dxrA-4yraA:
undetectable		 2dxrA-4yraA:
20.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zy8 PROTEIN LST4

(Kluyveromyces
lactis) 		no annotation 3 THR C 137
PRO C 141
TYR C 131
 None
 0.98A 2dxrA-4zy8C:
undetectable		 2dxrA-4zy8C:
19.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5c1e PECTINESTERASE

(Aspergillus
niger) 		PF01095
(Pectinesterase) 		3 THR A 213
PRO A 250
TYR A 284
 None
 0.85A 2dxrA-5c1eA:
undetectable		 2dxrA-5c1eA:
23.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5c8s GUANINE-N7
METHYLTRANSFERASE

(Severe acute
respiratory
syndrome-related
coronavirus) 		PF06471
(NSP11) 		3 THR B 437
PRO B 393
TYR B 370
 None
 0.92A 2dxrA-5c8sB:
undetectable		 2dxrA-5c8sB:
21.22
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.
5cn1 ADP-RIBOSYLATION
FACTOR-BINDING
PROTEIN GGA1

(Saccharomyces
cerevisiae) 		PF02883
(Alpha_adaptinC2) 		3 THR A 552
PRO A 555
TYR A 457
 None
 0.81A 2dxrA-5cn1A:
undetectable		 2dxrA-5cn1A:
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.
5czw MYROILYSIN

(Myroides
profundi) 		PF01400
(Astacin) 		3 THR A  99
PRO A  14
TYR A 175
 None
 0.87A 2dxrA-5czwA:
undetectable		 2dxrA-5czwA:
17.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ege ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 6

(Mus musculus) 		PF01663
(Phosphodiest) 		3 THR A 126
PRO A 400
TYR A 389
 None
 0.70A 2dxrA-5egeA:
undetectable		 2dxrA-5egeA:
19.50
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.
5fp2 FERRIC ENTEROBACTIN
RECEPTOR PIRA

(Pseudomonas
aeruginosa) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		3 THR A 155
PRO A 124
TYR A 201
 None
 0.97A 2dxrA-5fp2A:
undetectable		 2dxrA-5fp2A:
19.18
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.
5fpw PRO CATHEPSIN B S9

(Trypanosoma
congolense) 		PF00112
(Peptidase_C1) 		3 THR A  69
PRO A  72
TYR A 225
 None
 0.83A 2dxrA-5fpwA:
undetectable		 2dxrA-5fpwA:
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.
5ik2 ATP SYNTHASE GAMMA
CHAIN
ATP SYNTHASE EPSILON
CHAIN

(Caldalkalibacillus
thermarum;
Caldalkalibacillus
thermarum) 		PF00231
(ATP-synt)
PF02823
(ATP-synt_DE_N) 		3 THR G  38
PRO H  11
TYR G 227
 None
 0.68A 2dxrA-5ik2G:
undetectable		 2dxrA-5ik2G:
22.10
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.
5je3 METHYL TRANSFERASE

(Burkholderia
glumae) 		PF13847
(Methyltransf_31) 		3 THR A 144
PRO A 147
TYR A 197
 None
 0.91A 2dxrA-5je3A:
undetectable		 2dxrA-5je3A:
19.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jj7 ADENOSINE
MONOPHOSPHATE-PROTEI
N TRANSFERASE FICD
HOMOLOG

(Caenorhabditis
elegans) 		PF02661
(Fic) 		3 THR A 262
PRO A 428
TYR A 470
 None
 0.96A 2dxrA-5jj7A:
undetectable		 2dxrA-5jj7A:
22.14
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.
5ktg GREEN FLUORESCENT
PROTEIN, BCL-2
HOMOLOGOUS
ANTAGONIST/KILLER

(Aequorea
victoria;
Mus musculus) 		PF00452
(Bcl-2)
PF01353
(GFP) 		3 THR A  62
PRO A  58
TYR A 145
 None
None
CR2  A  66 ( 4.1A)
 0.94A 2dxrA-5ktgA:
undetectable		 2dxrA-5ktgA:
21.98
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.
5l7l ELP3 FAMILY, ELP3
FAMILY

(Dehalococcoides
mccartyi) 		PF04055
(Radical_SAM)
PF16199
(Radical_SAM_C) 		3 THR A  41
PRO A  37
TYR A 231
 None
 0.86A 2dxrA-5l7lA:
undetectable		 2dxrA-5l7lA:
22.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mzs FERRIC ENTEROBACTIN
RECEPTOR

(Pseudomonas
aeruginosa) 		no annotation 3 THR A 148
PRO A 117
TYR A 194
 None
 0.87A 2dxrA-5mzsA:
undetectable		 2dxrA-5mzsA:
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.
5nfr MALATE DEHYDROGENASE

(Plasmodium
falciparum) 		no annotation 3 THR A 185
PRO A 180
TYR A 151
 None
 0.97A 2dxrA-5nfrA:
undetectable		 2dxrA-5nfrA:
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.
5oas MALATE SYNTHASE G

(Pseudomonas
aeruginosa) 		no annotation 3 THR A 253
PRO A 249
TYR A 160
 None
 0.93A 2dxrA-5oasA:
undetectable		 2dxrA-5oasA:
19.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5tr0 SEED LINOLEATE
13S-LIPOXYGENASE-1

(Glycine max) 		no annotation 3 THR A 773
PRO A 523
TYR A 628
 None
 0.91A 2dxrA-5tr0A:
undetectable		 2dxrA-5tr0A:
17.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5udy ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 7

(Homo sapiens) 		PF01663
(Phosphodiest) 		3 THR A 129
PRO A 399
TYR A 388
 None
 0.86A 2dxrA-5udyA:
undetectable		 2dxrA-5udyA:
21.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5vfr PROTEASOME SUBUNIT
ALPHA TYPE-2

(Homo sapiens) 		no annotation 3 THR H  12
PRO H  15
TYR H   6
 None
 0.77A 2dxrA-5vfrH:
undetectable		 2dxrA-5vfrH:
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.
5vqd BETA-GLUCOSIDE
PHOSPHORYLASE BGLX

(unidentified) 		no annotation 3 THR A 144
PRO A 147
TYR A 179
 None
 0.98A 2dxrA-5vqdA:
undetectable		 2dxrA-5vqdA:
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.
5whr INDOLEAMINE
2,3-DIOXYGENASE 1

(Homo sapiens) 		no annotation 3 THR A  87
PRO A 122
TYR A 249
 None
 0.88A 2dxrA-5whrA:
undetectable		 2dxrA-5whrA:
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.
5wmm NRPS

(Micromonospora
sp. ML1) 		no annotation 3 THR A 692
PRO A 688
TYR A 838
 None
 0.88A 2dxrA-5wmmA:
1.8		 2dxrA-5wmmA:
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.
5xft DEHYDROASCORBATE
REDUCTASE

(Chlamydomonas
reinhardtii) 		no annotation 3 THR A 154
PRO A  96
TYR A 135
 None
 0.75A 2dxrA-5xftA:
undetectable		 2dxrA-5xftA:
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.
5yy0 CYTOSOLIC
NIFE-HYDROGENASE,
ALPHA SUBUNIT

(Thermococcus
kodakarensis) 		no annotation 3 THR A 351
PRO A 354
TYR A 100
 None
 0.94A 2dxrA-5yy0A:
undetectable		 2dxrA-5yy0A:
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.
6f0x MAD2L1-BINDING
PROTEIN

(Homo sapiens) 		no annotation 3 THR P 145
PRO P 148
TYR P 260
 None
 0.94A 2dxrA-6f0xP:
undetectable		 2dxrA-6f0xP:
undetectable