SIMILAR PATTERNS OF AMINO ACIDS FOR 1X70_B_715B801_2

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.
1amy 1,4-ALPHA-D-GLUCAN
GLUCANOHYDROLASE

(Hordeum vulgare) 		PF00128
(Alpha-amylase)
PF07821
(Alpha-amyl_C2) 		3 PHE A 173
TYR A  19
TYR A  64
 None
 0.90A 1x70B-1amyA:
0.0		 1x70B-1amyA:
19.15
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.
1izo CYTOCHROME P450
152A1

(Bacillus
subtilis) 		PF00067
(p450) 		3 PHE A 253
TYR A  22
TYR A 319
 None
 1.06A 1x70B-1izoA:
undetectable		 1x70B-1izoA:
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.
1jmz AMINE DEHYDROGENASE

(Pseudomonas
putida) 		PF08992
(QH-AmDH_gamma)
no annotation 		3 PHE G  20
TYR B 233
TYR B 257
 None
 0.78A 1x70B-1jmzG:
undetectable		 1x70B-1jmzG:
7.45
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.
1k0g P-AMINOBENZOATE
SYNTHASE COMPONENT I

(Escherichia
coli) 		PF00425
(Chorismate_bind)
PF04715
(Anth_synt_I_N) 		3 PHE A 218
TYR A 437
TYR A 193
 None
 0.97A 1x70B-1k0gA:
0.0		 1x70B-1k0gA:
21.11
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.
1m2x CLASS B
CARBAPENEMASE BLAB-1

(Elizabethkingia
meningoseptica) 		PF00753
(Lactamase_B) 		3 PHE A 128
TYR A  55
TYR A  73
 None
 0.97A 1x70B-1m2xA:
0.5		 1x70B-1m2xA:
13.87
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.
1no7 MAJOR CAPSID PROTEIN

(Human
alphaherpesvirus
1) 		PF03122
(Herpes_MCP) 		3 PHE A 618
TYR A 813
TYR A 668
 None
 1.01A 1x70B-1no7A:
0.0		 1x70B-1no7A:
19.63
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.
1og3 T-CELL
ECTO-ADP-RIBOSYLTRAN
SFERASE 2

(Rattus
norvegicus) 		PF01129
(ART) 		3 PHE A 145
TYR A  18
TYR A 107
 None
 1.05A 1x70B-1og3A:
undetectable		 1x70B-1og3A:
15.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1s04 HYPOTHETICAL PROTEIN
PF0455

(Pyrococcus
furiosus) 		PF04266
(ASCH) 		3 PHE A  11
TYR A  90
TYR A  86
 None
 1.05A 1x70B-1s04A:
undetectable		 1x70B-1s04A:
10.42
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.
1v9t CYCLOPHILIN B

(Escherichia
coli) 		PF00160
(Pro_isomerase) 		3 PHE A 125
TYR A  41
TYR A  35
 None
 0.95A 1x70B-1v9tA:
undetectable		 1x70B-1v9tA:
12.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1w2u ENDOGLUCANASE

(Humicola grisea) 		PF01670
(Glyco_hydro_12) 		3 PHE A 105
TYR A  64
TYR A  66
 None
BGC  A 303 (-4.1A)
None
 0.89A 1x70B-1w2uA:
0.5		 1x70B-1w2uA:
15.12
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.
2a5y APOPTOSIS REGULATOR
CED-9

(Caenorhabditis
elegans) 		PF00452
(Bcl-2)
PF02180
(BH4) 		3 PHE A  88
TYR A 149
TYR A 201
 None
 0.89A 1x70B-2a5yA:
undetectable		 1x70B-2a5yA:
13.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2bco SUCCINYLGLUTAMATE
DESUCCINYLASE

(Vibrio
parahaemolyticus) 		PF04952
(AstE_AspA) 		3 PHE A 203
TYR A 141
TYR A 211
 None
 0.94A 1x70B-2bcoA:
4.0		 1x70B-2bcoA:
18.82
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2buc DIPEPTIDYL PEPTIDASE
IV

(Sus scrofa) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		3 PHE A 357
TYR A 547
TYR A 631
 008  A1767 (-3.5A)
SO4  A1769 ( 4.5A)
None
 0.25A 1x70B-2bucA:
56.0		 1x70B-2bucA:
88.05
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.
2bxy MALTOOLIGOSYLTREHALO
SE TREHALOHYDROLASE

(Deinococcus
radiodurans) 		PF00128
(Alpha-amylase)
PF02922
(CBM_48)
PF11941
(DUF3459) 		3 PHE A 492
TYR A 189
TYR A 186
 None
 0.99A 1x70B-2bxyA:
0.4		 1x70B-2bxyA:
20.45
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.
2fnc MALTOSE ABC
TRANSPORTER,
PERIPLASMIC
MALTOSE-BINDING
PROTEIN

(Thermotoga
maritima) 		PF13416
(SBP_bac_8) 		3 PHE A 323
TYR A 245
TYR A 238
 None
 0.95A 1x70B-2fncA:
undetectable		 1x70B-2fncA:
21.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo sapiens) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		3 PHE A 357
TYR A 547
TYR A 631
 None
ACF  A 800 (-4.5A)
None
 0.18A 1x70B-2g5tA:
57.8		 1x70B-2g5tA:
99.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ghb MALTOSE ABC
TRANSPORTER,
PERIPLASMIC
MALTOSE-BINDING
PROTEIN

(Thermotoga
maritima) 		PF13416
(SBP_bac_8) 		3 PHE A 323
TYR A 245
TYR A 238
 None
 1.03A 1x70B-2ghbA:
undetectable		 1x70B-2ghbA:
20.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2h1n OLIGOENDOPEPTIDASE F

(Geobacillus
stearothermophilus) 		PF01432
(Peptidase_M3) 		3 PHE A   3
TYR A  70
TYR A   8
 None
 1.02A 1x70B-2h1nA:
undetectable		 1x70B-2h1nA:
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.
2h7g DNA TOPOISOMERASE 1

(Variola virus) 		PF01028
(Topoisom_I)
PF09266
(VirDNA-topo-I_N) 		3 PHE X 297
TYR X 225
TYR X  92
 None
 1.03A 1x70B-2h7gX:
undetectable		 1x70B-2h7gX:
17.82
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.
2ime 2-HYDROXYCHROMENE-2-
CARBOXYLATE
ISOMERASE

(Pseudomonas
putida) 		PF01323
(DSBA) 		3 PHE A   7
TYR A  94
TYR A 153
 None
 0.80A 1x70B-2imeA:
undetectable		 1x70B-2imeA:
14.53
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.
2j7c BETA-GLUCOSIDASE A

(Thermotoga
maritima) 		PF00232
(Glyco_hydro_1) 		3 PHE A 221
TYR A 256
TYR A 342
 None
 1.07A 1x70B-2j7cA:
1.2		 1x70B-2j7cA:
20.95
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.
2nul PEPTIDYLPROLYL
ISOMERASE

(Escherichia
coli) 		PF00160
(Pro_isomerase) 		3 PHE A 123
TYR A  36
TYR A  30
 None
 0.94A 1x70B-2nulA:
undetectable		 1x70B-2nulA:
12.21
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.
2o8r POLYPHOSPHATE KINASE

(Porphyromonas
gingivalis) 		PF02503
(PP_kinase)
PF13089
(PP_kinase_N)
PF13090
(PP_kinase_C) 		3 PHE A 206
TYR A 101
TYR A  97
 None
None
SO4  A 705 (-4.5A)
 0.95A 1x70B-2o8rA:
0.7		 1x70B-2o8rA:
22.85
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2oae DIPEPTIDYL PEPTIDASE
4

(Rattus
norvegicus) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		3 PHE A 355
TYR A 548
TYR A 632
 AIL  A 901 (-3.7A)
SO4  A 801 (-4.3A)
None
 0.20A 1x70B-2oaeA:
52.6		 1x70B-2oaeA:
84.40
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.
2qps ALPHA-AMYLASE TYPE A
ISOZYME

(Hordeum vulgare) 		PF00128
(Alpha-amylase)
PF07821
(Alpha-amyl_C2) 		3 PHE A 174
TYR A  20
TYR A  65
 None
 0.95A 1x70B-2qpsA:
undetectable		 1x70B-2qpsA:
20.41
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.
2qw8 EUGENOL SYNTHASE 1

(Ocimum
basilicum) 		PF05368
(NmrA) 		3 PHE A 314
TYR A 157
TYR A 161
 PEG  A 901 (-4.8A)
NAP  A 401 (-4.5A)
None
 0.91A 1x70B-2qw8A:
3.7		 1x70B-2qw8A:
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.
2uv8 FATTY ACID SYNTHASE
SUBUNIT BETA (FAS1)

(Saccharomyces
cerevisiae) 		PF00698
(Acyl_transf_1)
PF01575
(MaoC_dehydratas)
PF08354
(DUF1729)
PF13452
(MaoC_dehydrat_N)
PF16073
(SAT) 		3 PHE G1776
TYR G1733
TYR G1702
 None
 0.93A 1x70B-2uv8G:
undetectable		 1x70B-2uv8G:
16.43
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.
2v7b BENZOATE-COENZYME A
LIGASE

(Paraburkholderia
xenovorans) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		3 PHE A 341
TYR A 414
TYR A 422
 None
 0.92A 1x70B-2v7bA:
undetectable		 1x70B-2v7bA:
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.
2w9f CELL DIVISION
PROTEIN KINASE 4

(Homo sapiens) 		PF00069
(Pkinase) 		3 PHE B  93
TYR B 165
TYR B  17
 None
 0.93A 1x70B-2w9fB:
undetectable		 1x70B-2w9fB:
18.07
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.
2yg6 PUTRESCINE OXIDASE

(Rhodococcus
erythropolis) 		PF01593
(Amino_oxidase) 		3 PHE A 168
TYR A 100
TYR A  90
 None
 1.00A 1x70B-2yg6A:
undetectable		 1x70B-2yg6A:
21.09
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.
2z37 CHITINASE

(Brassica juncea) 		PF00182
(Glyco_hydro_19) 		3 PHE A 297
TYR A 157
TYR A 176
 None
 0.94A 1x70B-2z37A:
undetectable		 1x70B-2z37A:
15.97
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.
3ahm OLIGOPEPTIDASE

(Geobacillus sp.
MO-1) 		no annotation 3 PHE A   3
TYR A  70
TYR A   8
 None
 1.06A 1x70B-3ahmA:
undetectable		 1x70B-3ahmA:
21.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3apo DNAJ HOMOLOG
SUBFAMILY C MEMBER
10

(Mus musculus) 		PF00085
(Thioredoxin)
PF00226
(DnaJ) 		3 PHE A 622
TYR A 637
TYR A 647
 None
 1.01A 1x70B-3apoA:
undetectable		 1x70B-3apoA:
22.25
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.
3e79 HIGH AFFINITY
TRANSPORT SYSTEM
PROTEIN P37

(Mycoplasma
hyorhinis) 		PF06646
(Mycoplasma_p37) 		3 PHE A  72
TYR A 384
TYR A 381
 None
 0.75A 1x70B-3e79A:
undetectable		 1x70B-3e79A:
21.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3e79 HIGH AFFINITY
TRANSPORT SYSTEM
PROTEIN P37

(Mycoplasma
hyorhinis) 		PF06646
(Mycoplasma_p37) 		3 PHE A 122
TYR A 384
TYR A 381
 None
 0.76A 1x70B-3e79A:
undetectable		 1x70B-3e79A:
21.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3h9m P-AMINOBENZOATE
SYNTHETASE,
COMPONENT I

(Cytophaga
hutchinsonii) 		PF00425
(Chorismate_bind) 		3 PHE A 190
TYR A 411
TYR A 165
 None
 0.98A 1x70B-3h9mA:
undetectable		 1x70B-3h9mA:
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.
3h9x UNCHARACTERIZED
PROTEIN PSPTO_3016

(Pseudomonas
syringae group
genomosp. 3) 		PF04237
(YjbR) 		3 PHE A   6
TYR A  40
TYR A  14
 None
 0.89A 1x70B-3h9xA:
undetectable		 1x70B-3h9xA:
10.29
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.
3htx HEN1

(Arabidopsis
thaliana) 		PF13847
(Methyltransf_31) 		3 PHE A 817
TYR A 924
TYR A 775
 None
 1.03A 1x70B-3htxA:
undetectable		 1x70B-3htxA:
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.
3iwg ACETYLTRANSFERASE,
GNAT FAMILY

(Colwellia
psychrerythraea) 		PF00583
(Acetyltransf_1) 		3 PHE A 270
TYR A 106
TYR A  66
 None
 0.67A 1x70B-3iwgA:
undetectable		 1x70B-3iwgA:
17.62
Potential target for repurposing, i.e. matched protein structure has less than 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) 		3 PHE A 240
TYR A 266
TYR A 258
 None
 0.94A 1x70B-3jq3A:
undetectable		 1x70B-3jq3A:
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.
3mi6 ALPHA-GALACTOSIDASE

(Lactobacillus
brevis) 		PF02065
(Melibiase)
PF16874
(Glyco_hydro_36C)
PF16875
(Glyco_hydro_36N) 		3 PHE A 250
TYR A  36
TYR A 300
 None
 0.96A 1x70B-3mi6A:
undetectable		 1x70B-3mi6A:
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.
3myu HIGH AFFINITY
TRANSPORT SYSTEM
PROTEIN P37

(Mycoplasma
genitalium) 		PF06646
(Mycoplasma_p37) 		3 PHE A  51
TYR A 348
TYR A 345
 None
 0.56A 1x70B-3myuA:
undetectable		 1x70B-3myuA:
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.
3myu HIGH AFFINITY
TRANSPORT SYSTEM
PROTEIN P37

(Mycoplasma
genitalium) 		PF06646
(Mycoplasma_p37) 		3 PHE A  91
TYR A 348
TYR A 345
 None
 0.79A 1x70B-3myuA:
undetectable		 1x70B-3myuA:
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.
3o98 BIFUNCTIONAL
GLUTATHIONYLSPERMIDI
NE
SYNTHETASE/AMIDASE

(Escherichia
coli) 		PF03738
(GSP_synth)
PF05257
(CHAP) 		3 PHE A 319
TYR A 274
TYR A 331
 None
 1.06A 1x70B-3o98A:
undetectable		 1x70B-3o98A:
21.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pg7 NEUROFIBROMIN

(Homo sapiens) 		PF13716
(CRAL_TRIO_2) 		3 PHE A1572
TYR A1618
TYR A1614
 PTY  A 400 (-4.6A)
None
None
 0.95A 1x70B-3pg7A:
undetectable		 1x70B-3pg7A:
17.40
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.
3r11 ENZYME OF ENOLASE
SUPERFAMILY

(Francisella
philomiragia) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 PHE A  92
TYR A 109
TYR A  84
 None
 1.00A 1x70B-3r11A:
undetectable		 1x70B-3r11A:
19.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rh3 UNCHARACTERIZED
DUF3829-LIKE PROTEIN

(Bacteroides
thetaiotaomicron) 		no annotation 3 PHE A 257
TYR A 206
TYR A 275
 None
 1.04A 1x70B-3rh3A:
undetectable		 1x70B-3rh3A:
16.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3s6m PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE

(Burkholderia
pseudomallei) 		PF00160
(Pro_isomerase) 		3 PHE A 123
TYR A  36
TYR A  30
 None
 0.89A 1x70B-3s6mA:
undetectable		 1x70B-3s6mA:
11.87
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.
3sip CASPASE

(Drosophila
melanogaster) 		PF00656
(Peptidase_C14) 		3 PHE A 117
TYR A  68
TYR A 109
 None
 1.02A 1x70B-3sipA:
undetectable		 1x70B-3sipA:
11.59
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.
3t1u PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE

(Azotobacter
vinelandii) 		PF00160
(Pro_isomerase) 		3 PHE A 123
TYR A  36
TYR A  30
 None
 0.93A 1x70B-3t1uA:
undetectable		 1x70B-3t1uA:
12.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3vmw PECTATE LYASE

(Bacillus sp.
N16-5) 		PF00544
(Pec_lyase_C) 		3 PHE A 298
TYR A 302
TYR A 304
 None
 0.95A 1x70B-3vmwA:
undetectable		 1x70B-3vmwA:
19.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3voo FATTY ACID
ALPHA-HYDROXYLASE

(Sphingomonas
paucimobilis) 		PF00067
(p450) 		3 PHE A 252
TYR A  21
TYR A 317
 None
 1.02A 1x70B-3vooA:
undetectable		 1x70B-3vooA:
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.
3w5f BETA-GALACTOSIDASE

(Solanum
lycopersicum) 		PF01301
(Glyco_hydro_35) 		3 PHE A 232
TYR A 312
TYR A 256
 None
 1.01A 1x70B-3w5fA:
undetectable		 1x70B-3w5fA:
21.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wn6 ALPHA-AMYLASE

(Oryza sativa) 		PF00128
(Alpha-amylase)
PF07821
(Alpha-amyl_C2) 		3 PHE A 197
TYR A  44
TYR A  89
 None
 0.87A 1x70B-3wn6A:
undetectable		 1x70B-3wn6A:
20.55
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.
4ags THIOL-DEPENDENT
REDUCTASE 1

(Leishmania
infantum) 		PF13417
(GST_N_3)
PF16865
(GST_C_5) 		3 PHE A  69
TYR A  46
TYR A   9
 None
 0.94A 1x70B-4agsA:
undetectable		 1x70B-4agsA:
19.71
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.
4amc GLUCANSUCRASE

(Lactobacillus
reuteri) 		PF01473
(CW_binding_1)
PF02324
(Glyco_hydro_70) 		3 PHE A1447
TYR A1212
TYR A1206
 None
 0.95A 1x70B-4amcA:
undetectable		 1x70B-4amcA:
21.42
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.
4gk8 HISTIDINOL-PHOSPHATA
SE

(Lactococcus
lactis) 		PF02811
(PHP) 		3 PHE A 152
TYR A 135
TYR A 157
 None
None
GK8  A 305 (-4.6A)
 1.06A 1x70B-4gk8A:
undetectable		 1x70B-4gk8A:
17.80
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.
4gl8 OLIGOPEPTIDE ABC
TRANSPORTER OPPAIV

(Borreliella
burgdorferi) 		PF00496
(SBP_bac_5) 		3 PHE A 495
TYR A 454
TYR A 459
 None
 0.97A 1x70B-4gl8A:
undetectable		 1x70B-4gl8A:
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.
4hdt 3-HYDROXYISOBUTYRYL-
COA HYDROLASE

(Mycolicibacterium
thermoresistibile) 		PF16113
(ECH_2) 		3 PHE A 144
TYR A  92
TYR A 290
 None
 0.96A 1x70B-4hdtA:
undetectable		 1x70B-4hdtA:
18.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hoj REGF PROTEIN

(Neisseria
gonorrhoeae) 		PF00043
(GST_C)
PF02798
(GST_N) 		3 PHE A  18
TYR A 178
TYR A 141
 None
 0.89A 1x70B-4hojA:
undetectable		 1x70B-4hojA:
14.63
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.
4k0v TEK TYROSINE KINASE
VARIANT

(Homo sapiens) 		PF00041
(fn3)
PF10430
(Ig_Tie2_1) 		3 PHE A 536
TYR A 513
TYR A 483
 None
 1.08A 1x70B-4k0vA:
undetectable		 1x70B-4k0vA:
20.52
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.
4l9c F-BOX ONLY PROTEIN 7

(Homo sapiens) 		PF11566
(PI31_Prot_N) 		3 PHE A 308
TYR A 238
TYR A 212
 None
 1.00A 1x70B-4l9cA:
undetectable		 1x70B-4l9cA:
12.74
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.
4lr4 HYPOTHETICAL PROTEIN

([Eubacterium]
rectale) 		no annotation 3 PHE A  93
TYR A 244
TYR A 130
 None
None
GOL  A 402 ( 4.5A)
 0.96A 1x70B-4lr4A:
undetectable		 1x70B-4lr4A:
21.66
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.
4lxf TREHALOSE SYNTHASE

(Mycobacterium
tuberculosis) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		3 PHE A 106
TYR A 164
TYR A 163
 None
 0.97A 1x70B-4lxfA:
undetectable		 1x70B-4lxfA:
20.36
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.
4nj5 PROBABLE
HISTONE-LYSINE
N-METHYLTRANSFERASE,
H3 LYSINE-9 SPECIFIC
SUVH9

(Arabidopsis
thaliana) 		PF00856
(SET)
PF02182
(SAD_SRA)
PF05033
(Pre-SET) 		3 PHE A 366
TYR A 382
TYR A 397
 None
 1.03A 1x70B-4nj5A:
undetectable		 1x70B-4nj5A:
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.
4nky STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE

(Homo sapiens) 		PF00067
(p450) 		3 PHE A  42
TYR A  64
TYR A  60
 None
 1.04A 1x70B-4nkyA:
undetectable		 1x70B-4nkyA:
21.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ny4 CYTOCHROME P450 3A4

(Homo sapiens) 		PF00067
(p450) 		3 PHE A 447
TYR A 179
TYR A 152
 None
 1.04A 1x70B-4ny4A:
undetectable		 1x70B-4ny4A:
21.46
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.
4ptf DNA POLYMERASE
EPSILON CATALYTIC
SUBUNIT A

(Saccharomyces
cerevisiae) 		PF00136
(DNA_pol_B)
PF03104
(DNA_pol_B_exo1) 		3 PHE A 119
TYR A 249
TYR A 135
 None
 0.93A 1x70B-4ptfA:
undetectable		 1x70B-4ptfA:
21.46
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.
4rit PYRIDOXAL-DEPENDENT
DECARBOXYLASE

(Sphaerobacter
thermophilus) 		no annotation 3 PHE B 300
TYR B 371
TYR B 307
 None
None
LLP  B 304 ( 4.8A)
 1.04A 1x70B-4ritB:
undetectable		 1x70B-4ritB:
20.05
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.
4rlq BENZOATE-COENZYME A
LIGASE

(Rhodopseudomonas
palustris) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		3 PHE A 335
TYR A 408
TYR A 416
 None
 0.98A 1x70B-4rlqA:
undetectable		 1x70B-4rlqA:
21.28
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.
4tvc DEXTRANSUCRASE

(Leuconostoc
mesenteroides) 		PF02324
(Glyco_hydro_70) 		3 PHE A1966
TYR A1893
TYR A1974
 None
 0.99A 1x70B-4tvcA:
undetectable		 1x70B-4tvcA:
19.98
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.
4u9i PERIPLASMIC [NIFE]
HYDROGENASE LARGE
SUBUNIT

(Desulfovibrio
vulgaris) 		PF00374
(NiFeSe_Hases) 		3 PHE L 136
TYR L 129
TYR L 273
 None
 0.93A 1x70B-4u9iL:
undetectable		 1x70B-4u9iL:
21.27
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.
4x9e DEOXYGUANOSINETRIPHO
SPHATE
TRIPHOSPHOHYDROLASE

(Escherichia
coli) 		PF01966
(HD) 		3 PHE A 469
TYR A 455
TYR A 476
 None
 1.01A 1x70B-4x9eA:
undetectable		 1x70B-4x9eA:
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.
4xgc ORIGIN RECOGNITION
COMPLEX SUBUNIT 3
ORIGIN RECOGNITION
COMPLEX SUBUNIT 5

(Drosophila
melanogaster) 		PF07034
(ORC3_N)
PF13191
(AAA_16)
PF14630
(ORC5_C) 		3 PHE E 389
TYR C 307
TYR C 306
 None
 1.06A 1x70B-4xgcE:
undetectable		 1x70B-4xgcE:
20.82
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.
4z3l MAJOR POLLEN
ALLERGEN BET V 1-A

(Betula pendula) 		PF00407
(Bet_v_1) 		3 PHE A  30
TYR A  81
TYR A  83
 None
 0.82A 1x70B-4z3lA:
undetectable		 1x70B-4z3lA:
13.02
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.
5hlb PENICILLIN-BINDING
PROTEIN 1B

(Escherichia
coli) 		PF00905
(Transpeptidase)
PF00912
(Transgly)
PF14814
(UB2H) 		3 PHE A  76
TYR A 292
TYR A  83
 None
 0.96A 1x70B-5hlbA:
undetectable		 1x70B-5hlbA:
21.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ikj CRYPTIC LOCI
REGULATOR 2

(Schizosaccharomyces
pombe) 		PF10383
(Clr2)
PF16761
(Clr2_transil) 		3 PHE A 489
TYR A 279
TYR A 277
 None
 0.86A 1x70B-5ikjA:
undetectable		 1x70B-5ikjA:
22.59
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.
5ikz OXALATE BIOSYNTHETIC
COMPONENT 1

(Burkholderia
thailandensis) 		PF05853
(BKACE) 		3 PHE A 636
TYR A 568
TYR A 689
 None
 1.03A 1x70B-5ikzA:
undetectable		 1x70B-5ikzA:
20.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5j7z PUTATIVE SECRETED
ENDOGLYCOSYLCERAMIDA
SE

(Rhodococcus
hoagii) 		PF00150
(Cellulase) 		3 PHE A 424
TYR A 430
TYR A 434
 None
 1.08A 1x70B-5j7zA:
undetectable		 1x70B-5j7zA:
21.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jbe INACTIVE
GLUCANSUCRASE

(Lactobacillus
reuteri) 		PF02324
(Glyco_hydro_70) 		3 PHE A1009
TYR A1403
TYR A1456
 None
 0.96A 1x70B-5jbeA:
undetectable		 1x70B-5jbeA:
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.
5jbe INACTIVE
GLUCANSUCRASE

(Lactobacillus
reuteri) 		PF02324
(Glyco_hydro_70) 		3 PHE A1421
TYR A1207
TYR A1201
 None
 0.92A 1x70B-5jbeA:
undetectable		 1x70B-5jbeA:
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.
5l44 K-26 DIPEPTIDYL
CARBOXYPEPTIDASE

(Astrosporangium
hypotensionis) 		PF01432
(Peptidase_M3) 		3 PHE A 591
TYR A 544
TYR A 606
 None
None
SO4  A1004 ( 3.7A)
 0.97A 1x70B-5l44A:
undetectable		 1x70B-5l44A:
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.
5l7k PROTEIN UNC-119
HOMOLOG A

(Homo sapiens) 		PF05351
(GMP_PDE_delta) 		3 PHE A 196
TYR A 236
TYR A 234
 None
 0.95A 1x70B-5l7kA:
undetectable		 1x70B-5l7kA:
13.44
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.
5m0o TERMINAL
OLEFIN-FORMING FATTY
ACID DECARBOXYLASE

(Jeotgalicoccus
sp. ATCC 8456) 		PF00067
(p450) 		3 PHE A 256
TYR A  21
TYR A 321
 None
 1.03A 1x70B-5m0oA:
undetectable		 1x70B-5m0oA:
20.69
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.
5m2d ENDOGLUCANASE-LIKE
PROTEIN

(Acremonium
chrysogenum) 		no annotation 3 PHE A 108
TYR A  67
TYR A  69
 None
 0.92A 1x70B-5m2dA:
undetectable		 1x70B-5m2dA:
15.35
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.
5m86 TA1207

(Thermoplasma
acidophilum) 		no annotation 3 PHE A 190
TYR A 216
TYR A 214
 None
 1.01A 1x70B-5m86A:
undetectable		 1x70B-5m86A:
17.63
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.
5nd4 TUBULIN ALPHA CHAIN

(Bos taurus) 		PF00091
(Tubulin)
PF03953
(Tubulin_C) 		3 PHE A 395
TYR A 408
TYR A 103
 None
 0.87A 1x70B-5nd4A:
undetectable		 1x70B-5nd4A:
21.67
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.
5ngw OPGH99A

(Ochrovirga
pacifica) 		no annotation 3 PHE A 194
TYR A 120
TYR A 122
 None
 0.75A 1x70B-5ngwA:
undetectable		 1x70B-5ngwA:
8.16
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.
5tj7 NEDD4-LIKE E3
UBIQUITIN-PROTEIN
LIGASE WWP2

(Homo sapiens) 		PF00397
(WW)
PF00632
(HECT) 		3 PHE A 621
TYR A 499
TYR A 392
 None
 0.94A 1x70B-5tj7A:
undetectable		 1x70B-5tj7A:
20.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5u89 AMINO ACID
ADENYLATION DOMAIN
PROTEIN

(Geobacillus sp.
Y4.1MC1) 		PF00501
(AMP-binding)
PF00550
(PP-binding)
PF00668
(Condensation)
PF13193
(AMP-binding_C) 		3 PHE A 459
TYR A 534
TYR A 607
 None
 0.98A 1x70B-5u89A:
3.5		 1x70B-5u89A:
20.35
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.
5uid AMINOTRANSFERASE
TLMJ

(Streptoalloteichus
hindustanus) 		PF01041
(DegT_DnrJ_EryC1) 		3 PHE A   7
TYR A 327
TYR A 131
 None
LLP  A 184 ( 4.3A)
None
 0.95A 1x70B-5uidA:
undetectable		 1x70B-5uidA:
20.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5veu CYTOCHROME P450 3A5

(Homo sapiens) 		no annotation 3 PHE A 446
TYR A 179
TYR A 152
 HEM  A 601 ( 4.9A)
None
None
 0.70A 1x70B-5veuA:
undetectable		 1x70B-5veuA:
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.
5w8q BIS3 BIPHENYL
SYNTHASE

(Malus domestica) 		no annotation 3 PHE A 193
TYR A  31
TYR A  26
 BU4  A 400 (-4.0A)
BU4  A 400 (-4.5A)
None
 1.07A 1x70B-5w8qA:
undetectable		 1x70B-5w8qA:
7.39
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.
5wc8 SIAD

(Mannheimia
haemolytica) 		no annotation 3 PHE M 255
TYR M 267
TYR M 260
 None
 0.83A 1x70B-5wc8M:
undetectable		 1x70B-5wc8M:
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.
5wlh LBACAS13A H328A
(C2C2)

(Lachnospiraceae
bacterium
NK4A179) 		no annotation 3 PHE A 277
TYR A 445
TYR A 284
 None
 1.04A 1x70B-5wlhA:
undetectable		 1x70B-5wlhA:
18.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5wy0 SMALL RNA
2'-O-METHYLTRANSFERA
SE

(Homo sapiens) 		no annotation 3 PHE A  95
TYR A  81
TYR A 220
 None
 0.93A 1x70B-5wy0A:
undetectable		 1x70B-5wy0A:
8.27
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.
5yhj CYTOCHROME P450

(Exiguobacterium
sp. AT1b) 		no annotation 3 PHE A 250
TYR A  22
TYR A 315
 None
 1.03A 1x70B-5yhjA:
undetectable		 1x70B-5yhjA:
8.25
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.
5zal ENDORIBONUCLEASE
DICER

(Homo sapiens) 		no annotation 3 PHE A1666
TYR A1692
TYR A1694
 None
 0.90A 1x70B-5zalA:
undetectable		 1x70B-5zalA:
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.
6ar3 GSI-IIC RT

(Geobacillus
stearothermophilus) 		no annotation 3 PHE A 108
TYR A 126
TYR A 228
 None
 0.99A 1x70B-6ar3A:
undetectable		 1x70B-6ar3A:
17.91
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.
6ces RAS-RELATED
GTP-BINDING PROTEIN
A

(Homo sapiens) 		no annotation 3 PHE A  74
TYR A  90
TYR A 106
 None
 1.03A 1x70B-6cesA:
undetectable		 1x70B-6cesA:
6.99