SIMILAR PATTERNS OF AMINO ACIDS FOR 3KO0_L_TFPL201

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.
1att ANTITHROMBIN III

(Bos taurus) 		PF00079
(Serpin) 		4 GLY A 340
PHE A 124
PHE A 107
PHE A 109
 None
 1.15A 3ko0L-1attA:
0.4
3ko0N-1attA:
0.3		 3ko0L-1attA:
11.81
3ko0N-1attA:
11.81
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.
1b8g PROTEIN
(1-AMINOCYCLOPROPANE
-1-CARBOXYLATE
SYNTHASE)

(Malus domestica) 		PF00155
(Aminotran_1_2) 		4 GLY A 404
MET A  43
CYH A 409
PHE A 410
 None
 1.07A 3ko0L-1b8gA:
undetectable
3ko0N-1b8gA:
undetectable		 3ko0L-1b8gA:
13.21
3ko0N-1b8gA:
13.21
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.
1brl BACTERIAL LUCIFERASE

(Vibrio harveyi) 		PF00296
(Bac_luciferase) 		4 CYH A 324
PHE A   3
PHE A  36
PHE A 327
 None
 1.08A 3ko0L-1brlA:
undetectable
3ko0N-1brlA:
undetectable		 3ko0L-1brlA:
15.34
3ko0N-1brlA:
15.34
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.
1cle CHOLESTEROL ESTERASE

([Candida]
cylindracea) 		PF00135
(COesterase) 		4 GLY A 123
MET A 445
PHE A 403
PHE A 345
 CLL  A 801 (-3.3A)
None
None
CLL  A 801 ( 4.9A)
 0.99A 3ko0L-1cleA:
2.3
3ko0N-1cleA:
2.3		 3ko0L-1cleA:
10.15
3ko0N-1cleA:
10.15
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.
1cle CHOLESTEROL ESTERASE

([Candida]
cylindracea) 		PF00135
(COesterase) 		4 GLY A 124
MET A 445
PHE A 403
PHE A 345
 CLL  A 801 (-3.3A)
None
None
CLL  A 801 ( 4.9A)
 1.03A 3ko0L-1cleA:
2.3
3ko0N-1cleA:
2.3		 3ko0L-1cleA:
10.15
3ko0N-1cleA:
10.15
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.
1d1t ALCOHOL
DEHYDROGENASE CLASS
IV SIGMA CHAIN

(Homo sapiens) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		4 GLY A 119
CYH A  46
PHE A 359
PHE A 140
 None
ZN  A 376 ( 2.3A)
None
None
 1.00A 3ko0L-1d1tA:
undetectable
3ko0N-1d1tA:
undetectable		 3ko0L-1d1tA:
15.01
3ko0N-1d1tA:
15.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1dx8 RUBREDOXIN

(Guillardia
theta) 		PF00301
(Rubredoxin) 		4 GLY A  27
CYH A  10
PHE A  41
PHE A  34
 None
ZN  A  71 (-2.3A)
None
None
 1.10A 3ko0L-1dx8A:
undetectable
3ko0N-1dx8A:
undetectable		 3ko0L-1dx8A:
21.36
3ko0N-1dx8A:
21.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1h7v RUBREDOXIN

(Guillardia
theta) 		PF00301
(Rubredoxin) 		4 GLY A  27
CYH A  10
PHE A  41
PHE A  34
 None
ZN  A  61 (-2.3A)
None
None
 1.13A 3ko0L-1h7vA:
undetectable
3ko0N-1h7vA:
undetectable		 3ko0L-1h7vA:
21.78
3ko0N-1h7vA:
21.78
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.
1kzh PHOSPHOFRUCTOKINASE

(Borreliella
burgdorferi) 		PF00365
(PFK) 		4 GLY A 313
CYH A 329
PHE A 332
PHE A 351
 None
 1.12A 3ko0L-1kzhA:
undetectable
3ko0N-1kzhA:
undetectable		 3ko0L-1kzhA:
10.99
3ko0N-1kzhA:
10.99
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.
1lvg GUANYLATE KINASE

(Mus musculus) 		PF00625
(Guanylate_kin) 		4 GLY A 106
CYH A  98
PHE A  32
PHE A  25
 5GP  A1202 (-3.2A)
None
None
None
 1.08A 3ko0L-1lvgA:
undetectable
3ko0N-1lvgA:
undetectable		 3ko0L-1lvgA:
20.83
3ko0N-1lvgA:
20.83
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.
1ofe FERREDOXIN-DEPENDENT
GLUTAMATE SYNTHASE 2

(Synechocystis
sp. PCC 6803) 		PF00310
(GATase_2)
PF01493
(GXGXG)
PF01645
(Glu_synthase)
PF04898
(Glu_syn_central) 		4 GLY A 970
CYH A 871
PHE A 870
PHE A1174
 None
 0.96A 3ko0L-1ofeA:
undetectable
3ko0N-1ofeA:
undetectable		 3ko0L-1ofeA:
6.25
3ko0N-1ofeA:
6.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1psu PHENYLACETIC ACID
DEGRADATION PROTEIN
PAAI

(Escherichia
coli) 		PF03061
(4HBT) 		4 GLY A  47
PHE A  57
PHE A 125
PHE A  84
 None
 1.00A 3ko0L-1psuA:
undetectable
3ko0N-1psuA:
undetectable		 3ko0L-1psuA:
21.62
3ko0N-1psuA:
21.62
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.
1qnr ENDO-1,4-B-D-MANNANA
SE

(Trichoderma
reesei) 		PF00150
(Cellulase) 		4 GLY A 254
PHE A 237
PHE A 240
PHE A 226
 None
 0.62A 3ko0L-1qnrA:
undetectable
3ko0N-1qnrA:
undetectable		 3ko0L-1qnrA:
13.95
3ko0N-1qnrA:
13.95
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.
1qnr ENDO-1,4-B-D-MANNANA
SE

(Trichoderma
reesei) 		PF00150
(Cellulase) 		4 GLY A 256
PHE A 237
PHE A 240
PHE A 226
 None
 1.13A 3ko0L-1qnrA:
undetectable
3ko0N-1qnrA:
undetectable		 3ko0L-1qnrA:
13.95
3ko0N-1qnrA:
13.95
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.
1r8w GLYCEROL DEHYDRATASE

(Clostridium
butyricum) 		PF01228
(Gly_radical)
PF02901
(PFL-like) 		4 GLY A 163
PHE A 269
PHE A 177
PHE A 521
 None
 1.07A 3ko0L-1r8wA:
0.2
3ko0N-1r8wA:
0.2		 3ko0L-1r8wA:
9.70
3ko0N-1r8wA:
9.70
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.
1r8w GLYCEROL DEHYDRATASE

(Clostridium
butyricum) 		PF01228
(Gly_radical)
PF02901
(PFL-like) 		4 GLY A 280
PHE A 269
PHE A 177
PHE A 521
 None
 0.84A 3ko0L-1r8wA:
0.2
3ko0N-1r8wA:
0.2		 3ko0L-1r8wA:
9.70
3ko0N-1r8wA:
9.70
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.
1rw9 CHONDROITIN AC LYASE

(Paenarthrobacter
aurescens) 		PF02278
(Lyase_8)
PF02884
(Lyase_8_C)
PF08124
(Lyase_8_N) 		4 GLY A 389
MET A 627
CYH A 513
PHE A 660
 None
 0.97A 3ko0L-1rw9A:
undetectable
3ko0N-1rw9A:
0.1		 3ko0L-1rw9A:
8.45
3ko0N-1rw9A:
8.45
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.
1s1d APYRASE

(Homo sapiens) 		PF06079
(Apyrase) 		4 GLY A 160
PHE A 279
PHE A 227
PHE A 277
 None
 0.98A 3ko0L-1s1dA:
undetectable
3ko0N-1s1dA:
undetectable		 3ko0L-1s1dA:
13.98
3ko0N-1s1dA:
13.98
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.
1t84 WISKOTT-ALDRICH
SYNDROME PROTEIN

(Homo sapiens) 		PF00786
(PBD) 		4 GLY A  80
PHE A  17
PHE A  52
PHE A  30
 None
WSK  A 108 (-3.7A)
None
None
 1.02A 3ko0L-1t84A:
undetectable
3ko0N-1t84A:
undetectable		 3ko0L-1t84A:
23.01
3ko0N-1t84A:
23.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1usy ATP
PHOSPHORIBOSYLTRANSF
ERASE REGULATORY
SUBUNIT

(Thermotoga
maritima) 		PF13393
(tRNA-synt_His) 		4 GLY C 266
PHE C  10
PHE C  12
PHE C 120
 None
 0.80A 3ko0L-1usyC:
undetectable
3ko0N-1usyC:
undetectable		 3ko0L-1usyC:
16.79
3ko0N-1usyC:
16.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1v5s MAP/MICROTUBULE
AFFINITY-REGULATING
KINASE 3

(Mus musculus) 		PF02149
(KA1) 		4 GLY A 122
CYH A  67
PHE A  97
PHE A 107
 None
 0.86A 3ko0L-1v5sA:
undetectable
3ko0N-1v5sA:
undetectable		 3ko0L-1v5sA:
23.26
3ko0N-1v5sA:
23.26
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.
1xc6 BETA-GALACTOSIDASE

(Penicillium sp.) 		PF01301
(Glyco_hydro_35)
PF10435
(BetaGal_dom2)
PF13363
(BetaGal_dom3)
PF13364
(BetaGal_dom4_5) 		4 GLY A  89
PHE A  95
PHE A 120
PHE A  82
 None
 1.14A 3ko0L-1xc6A:
undetectable
3ko0N-1xc6A:
undetectable		 3ko0L-1xc6A:
6.85
3ko0N-1xc6A:
6.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2b4x ANTITHROMBIN-III

(Homo sapiens) 		PF00079
(Serpin) 		4 GLY I 339
PHE I 123
PHE I 106
PHE I 108
 None
 0.88A 3ko0L-2b4xI:
undetectable
3ko0N-2b4xI:
undetectable		 3ko0L-2b4xI:
15.12
3ko0N-2b4xI:
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.
2c2n MALONYL COA-ACYL
CARRIER PROTEIN
TRANSACYLASE

(Homo sapiens) 		PF00698
(Acyl_transf_1) 		4 GLY A 183
PHE A 170
PHE A 219
PHE A 211
 None
 1.00A 3ko0L-2c2nA:
undetectable
3ko0N-2c2nA:
undetectable		 3ko0L-2c2nA:
13.91
3ko0N-2c2nA:
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.
2d7s RNA-DEPENDENT RNA
POLYMERASE

(Foot-and-mouth
disease virus) 		PF00680
(RdRP_1) 		4 GLY A 208
PHE A 265
PHE A 267
PHE A 199
 None
 1.09A 3ko0L-2d7sA:
undetectable
3ko0N-2d7sA:
undetectable		 3ko0L-2d7sA:
12.39
3ko0N-2d7sA:
12.39
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.
2eng ENDOGLUCANASE V

(Humicola
insolens) 		PF02015
(Glyco_hydro_45) 		4 GLY A 149
PHE A 182
PHE A  94
PHE A 174
 None
 1.14A 3ko0L-2engA:
undetectable
3ko0N-2engA:
undetectable		 3ko0L-2engA:
18.57
3ko0N-2engA:
18.57
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.
2g3n ALPHA-GLUCOSIDASE

(Sulfolobus
solfataricus) 		PF01055
(Glyco_hydro_31)
PF13802
(Gal_mutarotas_2) 		4 GLY A 448
PHE A 411
PHE A 396
PHE A 210
 None
 1.08A 3ko0L-2g3nA:
undetectable
3ko0N-2g3nA:
undetectable		 3ko0L-2g3nA:
11.28
3ko0N-2g3nA:
11.28
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.
2gmi UBIQUITIN-CONJUGATIN
G ENZYME VARIANT
MMS2

(Saccharomyces
cerevisiae) 		PF00179
(UQ_con) 		4 GLY B  43
CYH B  85
PHE B  77
PHE B 137
 None
 0.94A 3ko0L-2gmiB:
undetectable
3ko0N-2gmiB:
undetectable		 3ko0L-2gmiB:
20.15
3ko0N-2gmiB:
20.15
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.
2jok PUTATIVE
G-NUCLEOTIDE
EXCHANGE FACTOR

(Burkholderia
pseudomallei) 		PF07487
(SopE_GEF) 		4 GLY A 171
MET A 132
CYH A 131
PHE A 130
 None
 1.05A 3ko0L-2jokA:
undetectable
3ko0N-2jokA:
undetectable		 3ko0L-2jokA:
17.20
3ko0N-2jokA:
17.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jok PUTATIVE
G-NUCLEOTIDE
EXCHANGE FACTOR

(Burkholderia
pseudomallei) 		PF07487
(SopE_GEF) 		4 GLY A 173
MET A 132
CYH A 131
PHE A 130
 None
 1.13A 3ko0L-2jokA:
undetectable
3ko0N-2jokA:
undetectable		 3ko0L-2jokA:
17.20
3ko0N-2jokA:
17.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2mqs MATRIX
METALLOPROTEINASE-14

(Homo sapiens) 		PF00045
(Hemopexin) 		4 GLY A 352
PHE A 390
PHE A 381
PHE A 336
 None
 1.04A 3ko0L-2mqsA:
undetectable
3ko0N-2mqsA:
undetectable		 3ko0L-2mqsA:
24.71
3ko0N-2mqsA:
24.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2o5r GLUTAMYL-TRNA
SYNTHETASE 1

(Thermotoga
maritima) 		PF00749
(tRNA-synt_1c) 		4 PHE A 371
PHE A 341
PHE A 378
PHE A 379
 None
 0.98A 3ko0L-2o5rA:
undetectable
3ko0N-2o5rA:
undetectable		 3ko0L-2o5rA:
12.33
3ko0N-2o5rA:
12.33
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.
2o5r GLUTAMYL-TRNA
SYNTHETASE 1

(Thermotoga
maritima) 		PF00749
(tRNA-synt_1c) 		4 PHE A 378
PHE A 379
PHE A 371
PHE A 341
 None
 0.94A 3ko0L-2o5rA:
undetectable
3ko0N-2o5rA:
undetectable		 3ko0L-2o5rA:
12.33
3ko0N-2o5rA:
12.33
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.
2qy6 UPF0209 PROTEIN YFCK

(Escherichia
coli) 		PF05430
(Methyltransf_30) 		4 GLY A  86
PHE A 100
PHE A  72
PHE A 117
 None
 1.11A 3ko0L-2qy6A:
undetectable
3ko0N-2qy6A:
undetectable		 3ko0L-2qy6A:
18.18
3ko0N-2qy6A:
18.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2uyd HEMOPHORE HASA

(Serratia
marcescens) 		PF06438
(HasA) 		4 GLY X 138
PHE X  11
PHE X 166
PHE X 115
 None
 1.09A 3ko0L-2uydX:
0.6
3ko0N-2uydX:
undetectable		 3ko0L-2uydX:
16.13
3ko0N-2uydX:
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.
2vws YFAU, 2-KETO-3-DEOXY
SUGAR ALDOLASE

(Escherichia
coli) 		PF03328
(HpcH_HpaI) 		4 GLY A  90
PHE A 174
PHE A 233
PHE A   9
 None
 1.15A 3ko0L-2vwsA:
undetectable
3ko0N-2vwsA:
undetectable		 3ko0L-2vwsA:
15.67
3ko0N-2vwsA:
15.67
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.
2wae PENICILLIN-BINDING
PROTEIN 2B

(Streptococcus
pneumoniae) 		PF00905
(Transpeptidase)
PF03717
(PBP_dimer) 		4 GLY A 476
PHE A 415
PHE A 512
PHE A 509
 None
 1.15A 3ko0L-2waeA:
undetectable
3ko0N-2waeA:
undetectable		 3ko0L-2waeA:
9.10
3ko0N-2waeA:
9.10
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.
2wnw ACTIVATED BY
TRANSCRIPTION FACTOR
SSRB

(Salmonella
enterica) 		PF02055
(Glyco_hydro_30)
PF17189
(Glyco_hydro_30C) 		4 GLY A 295
PHE A 398
PHE A 328
PHE A 321
 None
 1.06A 3ko0L-2wnwA:
undetectable
3ko0N-2wnwA:
undetectable		 3ko0L-2wnwA:
12.09
3ko0N-2wnwA:
12.09
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.
3abz BETA-GLUCOSIDASE I

(Kluyveromyces
marxianus) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF07691
(PA14)
PF14310
(Fn3-like) 		4 GLY A 100
PHE A  74
PHE A 777
PHE A 118
 None
 1.10A 3ko0L-3abzA:
undetectable
3ko0N-3abzA:
undetectable		 3ko0L-3abzA:
9.16
3ko0N-3abzA:
9.16
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.
3cea MYO-INOSITOL
2-DEHYDROGENASE

(Lactobacillus
plantarum) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		4 GLY A  16
MET A 185
PHE A 172
PHE A 169
 NAD  A 400 (-3.3A)
None
NAD  A 400 (-4.4A)
None
 0.95A 3ko0L-3ceaA:
undetectable
3ko0N-3ceaA:
undetectable		 3ko0L-3ceaA:
15.03
3ko0N-3ceaA:
15.03
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.
3dmc NTF2-LIKE PROTEIN

(Trichormus
variabilis) 		PF12680
(SnoaL_2) 		4 GLY A 116
PHE A  20
PHE A  63
PHE A  40
 None
 1.15A 3ko0L-3dmcA:
undetectable
3ko0N-3dmcA:
undetectable		 3ko0L-3dmcA:
23.19
3ko0N-3dmcA:
23.19
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.
3fao NON-STRUCTURAL
PROTEIN

(Porcine
reproductive
and respiratory
syndrome virus) 		PF05579
(Peptidase_S32) 		4 GLY A 116
PHE A 165
PHE A 166
PHE A 112
 None
 1.14A 3ko0L-3faoA:
undetectable
3ko0N-3faoA:
undetectable		 3ko0L-3faoA:
17.71
3ko0N-3faoA:
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.
3ii6 DNA LIGASE 4

(Homo sapiens) 		PF00533
(BRCT)
PF11411
(DNA_ligase_IV) 		4 GLY X 866
PHE X 882
PHE X 875
PHE X 886
 None
 0.87A 3ko0L-3ii6X:
undetectable
3ko0N-3ii6X:
undetectable		 3ko0L-3ii6X:
17.36
3ko0N-3ii6X:
17.36
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.
3kf3 INVERTASE

(Schwanniomyces
occidentalis) 		PF00251
(Glyco_hydro_32N)
PF08244
(Glyco_hydro_32C) 		4 GLY A 112
PHE A 276
PHE A 271
PHE A 183
 None
 1.10A 3ko0L-3kf3A:
undetectable
3ko0N-3kf3A:
undetectable		 3ko0L-3kf3A:
10.78
3ko0N-3kf3A:
10.78
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.
3lws AROMATIC AMINO ACID
BETA-ELIMINATING
LYASE/THREONINE
ALDOLASE

(Exiguobacterium
sibiricum) 		PF01212
(Beta_elim_lyase) 		4 GLY A 206
PHE A 315
PHE A 271
PHE A 289
 LLP  A 205 ( 2.4A)
None
None
None
 1.10A 3ko0L-3lwsA:
undetectable
3ko0N-3lwsA:
undetectable		 3ko0L-3lwsA:
15.81
3ko0N-3lwsA:
15.81
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.
3lxz GLUTATHIONE
S-TRANSFERASE FAMILY
PROTEIN

(Pseudomonas
putida) 		PF13417
(GST_N_3)
PF14497
(GST_C_3) 		4 GLY A 169
PHE A 142
PHE A 133
PHE A 181
 None
 1.03A 3ko0L-3lxzA:
undetectable
3ko0N-3lxzA:
undetectable		 3ko0L-3lxzA:
19.65
3ko0N-3lxzA:
19.65
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.
3m6i L-ARABINITOL
4-DEHYDROGENASE

(Neurospora
crassa) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		4 GLY A  66
CYH A  53
PHE A 344
PHE A  59
 None
ZN  A 401 (-2.0A)
None
None
 1.15A 3ko0L-3m6iA:
undetectable
3ko0N-3m6iA:
undetectable		 3ko0L-3m6iA:
14.89
3ko0N-3m6iA:
14.89
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.
3mbf FRUCTOSE-BISPHOSPHAT
E ALDOLASE

(Encephalitozoon
cuniculi) 		PF00274
(Glycolytic) 		4 GLY A 258
PHE A 274
PHE A 261
PHE A 293
 None
 1.14A 3ko0L-3mbfA:
undetectable
3ko0N-3mbfA:
undetectable		 3ko0L-3mbfA:
16.02
3ko0N-3mbfA:
16.02
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.
3oaj PUTATIVE
RING-CLEAVING
DIOXYGENASE MHQO

(Bacillus
subtilis) 		PF00903
(Glyoxalase) 		4 GLY A 284
PHE A  25
PHE A  51
PHE A  64
 None
 1.16A 3ko0L-3oajA:
undetectable
3ko0N-3oajA:
undetectable		 3ko0L-3oajA:
15.87
3ko0N-3oajA:
15.87
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.
3ps9 TRNA
5-METHYLAMINOMETHYL-
2-THIOURIDINE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
MNMC

(Escherichia
coli) 		PF01266
(DAO)
PF05430
(Methyltransf_30) 		4 GLY A  66
PHE A  80
PHE A  52
PHE A  97
 SAM  A 670 (-3.5A)
None
None
None
 1.07A 3ko0L-3ps9A:
0.0
3ko0N-3ps9A:
undetectable		 3ko0L-3ps9A:
9.38
3ko0N-3ps9A:
9.38
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.
3qqw PUTATIVE CITRATE
LYASE

(Cupriavidus
pinatubonensis) 		PF03328
(HpcH_HpaI) 		4 GLY A 182
MET A 210
PHE A 246
PHE A 248
 None
 1.00A 3ko0L-3qqwA:
undetectable
3ko0N-3qqwA:
undetectable		 3ko0L-3qqwA:
15.50
3ko0N-3qqwA:
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.
3rpd METHIONINE SYNTHASE
(B12-INDEPENDENT)

(Shewanella sp.
W3-18-1) 		PF01717
(Meth_synt_2) 		4 GLY A 225
PHE A  83
PHE A 122
PHE A  79
 ZN  A 355 ( 4.7A)
None
None
None
 1.10A 3ko0L-3rpdA:
undetectable
3ko0N-3rpdA:
undetectable		 3ko0L-3rpdA:
16.20
3ko0N-3rpdA:
16.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3t5v NUCLEAR MRNA EXPORT
PROTEIN THP1

(Saccharomyces
cerevisiae) 		PF01399
(PCI) 		4 CYH B  65
PHE B  68
PHE B  90
PHE B  16
 None
 1.01A 3ko0L-3t5vB:
undetectable
3ko0N-3t5vB:
undetectable		 3ko0L-3t5vB:
13.08
3ko0N-3t5vB:
13.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tze TRYPTOPHANYL-TRNA
SYNTHETASE

(Encephalitozoon
cuniculi) 		PF00579
(tRNA-synt_1b) 		4 GLY A 201
CYH A 210
PHE A 215
PHE A 169
 None
 0.89A 3ko0L-3tzeA:
undetectable
3ko0N-3tzeA:
undetectable		 3ko0L-3tzeA:
13.90
3ko0N-3tzeA:
13.90
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.
3ujh GLUCOSE-6-PHOSPHATE
ISOMERASE

(Toxoplasma
gondii) 		PF00342
(PGI) 		4 GLY A 157
CYH A 248
PHE A 247
PHE A 216
 G6Q  A 571 ( 3.3A)
None
None
None
 0.89A 3ko0L-3ujhA:
1.9
3ko0N-3ujhA:
2.1		 3ko0L-3ujhA:
9.95
3ko0N-3ujhA:
9.95
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.
3ut2 CATALASE-PEROXIDASE
2

(Magnaporthe
oryzae) 		PF00141
(peroxidase) 		4 GLY A 734
PHE A 767
PHE A 763
PHE A 700
 None
 1.11A 3ko0L-3ut2A:
0.9
3ko0N-3ut2A:
0.9		 3ko0L-3ut2A:
8.77
3ko0N-3ut2A:
8.77
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.
3vxi DYP

(Bjerkandera
adusta) 		PF04261
(Dyp_perox) 		4 GLY A 124
PHE A 112
PHE A  26
PHE A  28
 None
 1.02A 3ko0L-3vxiA:
undetectable
3ko0N-3vxiA:
undetectable		 3ko0L-3vxiA:
12.18
3ko0N-3vxiA:
12.18
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.
3wfl BETA-MANNANASE

(Talaromyces
trachyspermus) 		PF00150
(Cellulase) 		4 GLY A 287
PHE A 270
PHE A 273
PHE A 259
 None
 0.60A 3ko0L-3wflA:
undetectable
3ko0N-3wflA:
undetectable		 3ko0L-3wflA:
13.24
3ko0N-3wflA:
13.24
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.
3ziz GH5
ENDO-BETA-1,4-MANNAN
ASE

(Podospora
anserina) 		PF00150
(Cellulase) 		4 GLY A 254
PHE A 237
PHE A 240
PHE A 226
 None
 0.64A 3ko0L-3zizA:
undetectable
3ko0N-3zizA:
undetectable		 3ko0L-3zizA:
11.52
3ko0N-3zizA:
11.52
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.
3ziz GH5
ENDO-BETA-1,4-MANNAN
ASE

(Podospora
anserina) 		PF00150
(Cellulase) 		4 GLY A 256
PHE A 237
PHE A 240
PHE A 226
 None
 1.15A 3ko0L-3zizA:
undetectable
3ko0N-3zizA:
undetectable		 3ko0L-3zizA:
11.52
3ko0N-3zizA:
11.52
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.
3zy3 PUTATIVE GDP-FUCOSE
PROTEIN
O-FUCOSYLTRANSFERASE
1

(Caenorhabditis
elegans) 		PF10250
(O-FucT) 		4 GLY A 156
PHE A  54
PHE A 118
PHE A 192
 None
 1.11A 3ko0L-3zy3A:
undetectable
3ko0N-3zy3A:
undetectable		 3ko0L-3zy3A:
16.10
3ko0N-3zy3A:
16.10
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.
4b5x 4-HYDROXY-2-OXO-HEPT
ANE-1,7-DIOATE
ALDOLASE

(Escherichia
coli) 		PF03328
(HpcH_HpaI) 		4 GLY A  86
PHE A 170
PHE A 229
PHE A   5
 None
 1.15A 3ko0L-4b5xA:
undetectable
3ko0N-4b5xA:
undetectable		 3ko0L-4b5xA:
15.27
3ko0N-4b5xA:
15.27
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.
4c1r MANNOSYL-6-PHOSPHATA
SE

(Bacteroides
thetaiotaomicron) 		PF03372
(Exo_endo_phos) 		4 GLY A 119
PHE A 309
PHE A 147
PHE A 156
 None
 1.10A 3ko0L-4c1rA:
undetectable
3ko0N-4c1rA:
undetectable		 3ko0L-4c1rA:
17.81
3ko0N-4c1rA:
17.81
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.
4c51 CATALASE-PEROXIDASE

(Mycobacterium
tuberculosis) 		PF00141
(peroxidase) 		4 GLY A 691
PHE A 724
PHE A 720
PHE A 658
 None
 1.15A 3ko0L-4c51A:
undetectable
3ko0N-4c51A:
undetectable		 3ko0L-4c51A:
9.18
3ko0N-4c51A:
9.18
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.
4cmr GLYCOSYL
HYDROLASE/DEACETYLAS
E FAMILY PROTEIN

(Pyrococcus sp.
ST04) 		no annotation 4 GLY A 463
PHE A 360
PHE A 362
PHE A 500
 None
 1.10A 3ko0L-4cmrA:
undetectable
3ko0N-4cmrA:
undetectable		 3ko0L-4cmrA:
11.89
3ko0N-4cmrA:
11.89
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.
4fch OUTER MEMBRANE
PROTEIN SUSE

(Bacteroides
thetaiotaomicron) 		PF16411
(SusF_SusE) 		4 GLY A 289
PHE A 314
PHE A 379
PHE A 340
 None
 1.02A 3ko0L-4fchA:
undetectable
3ko0N-4fchA:
undetectable		 3ko0L-4fchA:
15.07
3ko0N-4fchA:
15.07
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.
4fe9 OUTER MEMBRANE
PROTEIN SUSF

(Bacteroides
thetaiotaomicron) 		PF16411
(SusF_SusE)
PF17142
(DUF5115) 		4 GLY A 389
PHE A 416
PHE A 477
PHE A 446
 None
None
EDO  A 511 ( 4.9A)
None
 1.08A 3ko0L-4fe9A:
undetectable
3ko0N-4fe9A:
undetectable		 3ko0L-4fe9A:
11.54
3ko0N-4fe9A:
11.54
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.
4ga7 LEUKOCYTE ELASTASE
INHIBITOR

(Homo sapiens) 		PF00079
(Serpin) 		4 GLY A 292
PHE A  70
PHE A  58
PHE A  60
 None
 1.12A 3ko0L-4ga7A:
undetectable
3ko0N-4ga7A:
undetectable		 3ko0L-4ga7A:
14.47
3ko0N-4ga7A:
14.47
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.
4h41 PUTATIVE
ALPHA-L-FUCOSIDASE

(Bacteroides
thetaiotaomicron) 		PF14488
(DUF4434)
PF17134
(DUF5109) 		4 GLY A 198
CYH A 266
PHE A 220
PHE A 203
 PE4  A 405 ( 3.1A)
None
None
None
 1.04A 3ko0L-4h41A:
undetectable
3ko0N-4h41A:
undetectable		 3ko0L-4h41A:
16.76
3ko0N-4h41A:
16.76
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.
4iss ALLOPHANATE
HYDROLASE

(Kluyveromyces
lactis) 		PF01425
(Amidase) 		4 GLY A 178
CYH A 374
PHE A 294
PHE A 404
 None
 1.12A 3ko0L-4issA:
undetectable
3ko0N-4issA:
undetectable		 3ko0L-4issA:
9.94
3ko0N-4issA:
9.94
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.
4q1j POLYKETIDE
BIOSYNTHESIS
ENOYL-COA ISOMERASE
PKSI

(Bacillus
subtilis) 		PF00378
(ECH_1) 		4 GLY A 163
MET A 140
PHE A 144
PHE A 115
 EDO  A 303 ( 4.4A)
None
None
None
 1.14A 3ko0L-4q1jA:
undetectable
3ko0N-4q1jA:
undetectable		 3ko0L-4q1jA:
17.42
3ko0N-4q1jA:
17.42
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.
4rcm METHYLATED
RNA-BINDING PROTEIN
1

(Saccharomyces
cerevisiae) 		PF04146
(YTH) 		4 GLY A 175
CYH A 213
PHE A 212
PHE A 290
 UNX  A 405 ( 4.2A)
None
None
None
 1.07A 3ko0L-4rcmA:
undetectable
3ko0N-4rcmA:
undetectable		 3ko0L-4rcmA:
22.02
3ko0N-4rcmA:
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.
4rmm PUTATIVE
UNCHARACTERIZED
PROTEIN

(Chromobacterium
violaceum) 		PF03061
(4HBT) 		4 GLY A  63
PHE A 107
PHE A  48
PHE A  69
 None
 1.09A 3ko0L-4rmmA:
undetectable
3ko0N-4rmmA:
undetectable		 3ko0L-4rmmA:
18.06
3ko0N-4rmmA:
18.06
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.
4u8t ZYRO0G01672P

(Zygosaccharomyces
rouxii) 		PF04146
(YTH) 		4 GLY A 198
CYH A 236
PHE A 235
PHE A 313
 None
 0.99A 3ko0L-4u8tA:
undetectable
3ko0N-4u8tA:
undetectable		 3ko0L-4u8tA:
19.21
3ko0N-4u8tA:
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.
4x5s CARBONIC ANHYDRASE
(CARBONATE
DEHYDRATASE)

(Sulfurihydrogenibium
azorense) 		PF00194
(Carb_anhydrase) 		4 GLY A  63
MET A 107
PHE A 201
PHE A 138
 None
 1.12A 3ko0L-4x5sA:
undetectable
3ko0N-4x5sA:
undetectable		 3ko0L-4x5sA:
19.90
3ko0N-4x5sA:
19.90
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.
4xdq GLYCOSIDE HYDROLASE
FAMILY PROTEIN

(Mycolicibacterium
thermoresistibile) 		PF00722
(Glyco_hydro_16) 		4 GLY A 192
PHE A 147
PHE A 195
PHE A 206
 None
 0.89A 3ko0L-4xdqA:
undetectable
3ko0N-4xdqA:
undetectable		 3ko0L-4xdqA:
14.87
3ko0N-4xdqA:
14.87
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.
5cvz COAT PROTEIN

(Panicum
papanivirus 1) 		no annotation 4 GLY A  51
PHE A  39
PHE A  60
PHE A 147
 None
 0.79A 3ko0L-5cvzA:
undetectable
3ko0N-5cvzA:
undetectable		 3ko0L-5cvzA:
16.77
3ko0N-5cvzA:
16.77
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.
5d8w ENDOGLUCANASE

(Ganoderma
lucidum) 		PF00150
(Cellulase) 		4 GLY A  59
PHE A  24
PHE A 273
PHE A  75
 None
 1.12A 3ko0L-5d8wA:
undetectable
3ko0N-5d8wA:
undetectable		 3ko0L-5d8wA:
11.58
3ko0N-5d8wA:
11.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ei0 SERPIN A12

(Homo sapiens) 		PF00079
(Serpin) 		4 GLY A 327
PHE A 116
PHE A 102
PHE A 104
 None
 0.90A 3ko0L-5ei0A:
undetectable
3ko0N-5ei0A:
undetectable		 3ko0L-5ei0A:
13.45
3ko0N-5ei0A:
13.45
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.
5f2o FATTY ACID
O-METHYLTRANSFERASE

(Mycobacterium
marinum) 		PF03492
(Methyltransf_7) 		4 GLY A  64
PHE A 274
PHE A 268
PHE A 195
 SAH  A 400 (-3.8A)
None
None
None
 1.01A 3ko0L-5f2oA:
undetectable
3ko0N-5f2oA:
undetectable		 3ko0L-5f2oA:
13.62
3ko0N-5f2oA:
13.62
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.
5hdm GLUTAMATE-1-SEMIALDE
HYDE 2,1-AMINOMUTASE
1, CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF00202
(Aminotran_3) 		4 GLY A 362
PHE A 391
PHE A 387
PHE A 366
 None
 1.13A 3ko0L-5hdmA:
undetectable
3ko0N-5hdmA:
undetectable		 3ko0L-5hdmA:
15.70
3ko0N-5hdmA:
15.70
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.
5hgc SERPIN

(Taeniopygia
guttata) 		PF00079
(Serpin) 		4 GLY A 114
PHE A  56
PHE A 195
PHE A 389
 None
 1.15A 3ko0L-5hgcA:
undetectable
3ko0N-5hgcA:
undetectable		 3ko0L-5hgcA:
12.37
3ko0N-5hgcA:
12.37
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.
5i8i UREA AMIDOLYASE

(Kluyveromyces
lactis) 		PF00289
(Biotin_carb_N)
PF01425
(Amidase)
PF02626
(CT_A_B)
PF02682
(CT_C_D)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		4 GLY A 178
CYH A 374
PHE A 294
PHE A 404
 None
 1.11A 3ko0L-5i8iA:
undetectable
3ko0N-5i8iA:
undetectable		 3ko0L-5i8iA:
4.13
3ko0N-5i8iA:
4.13
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.
5ihr PROBABLE
BETA-GALACTOSIDASE A

(Aspergillus
niger) 		PF01301
(Glyco_hydro_35)
PF10435
(BetaGal_dom2)
PF13363
(BetaGal_dom3)
PF13364
(BetaGal_dom4_5) 		4 GLY A  89
PHE A  95
PHE A 120
PHE A  82
 None
 1.13A 3ko0L-5ihrA:
undetectable
3ko0N-5ihrA:
undetectable		 3ko0L-5ihrA:
6.99
3ko0N-5ihrA:
6.99
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.
5ihr PROBABLE
BETA-GALACTOSIDASE A

(Aspergillus
niger) 		PF01301
(Glyco_hydro_35)
PF10435
(BetaGal_dom2)
PF13363
(BetaGal_dom3)
PF13364
(BetaGal_dom4_5) 		4 GLY A 136
CYH A  92
PHE A  82
PHE A 120
 None
 1.00A 3ko0L-5ihrA:
undetectable
3ko0N-5ihrA:
undetectable		 3ko0L-5ihrA:
6.99
3ko0N-5ihrA:
6.99
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.
5keg DNA DC->DU-EDITING
ENZYME APOBEC-3A

(Homo sapiens) 		PF08210
(APOBEC_N) 		4 GLY A 178
PHE A  95
PHE A 158
PHE A  18
 None
 0.85A 3ko0L-5kegA:
undetectable
3ko0N-5kegA:
undetectable		 3ko0L-5kegA:
19.10
3ko0N-5kegA:
19.10
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.
5kqi CATALASE-PEROXIDASE

(Burkholderia
pseudomallei) 		PF00141
(peroxidase) 		4 GLY A 699
PHE A 732
PHE A 728
PHE A 665
 None
 1.14A 3ko0L-5kqiA:
undetectable
3ko0N-5kqiA:
undetectable		 3ko0L-5kqiA:
9.19
3ko0N-5kqiA:
9.19
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.
5nbs BETA-GLUCOSIDASE

(Neurospora
crassa) 		no annotation 4 GLY A 138
PHE A 112
PHE A 800
PHE A 157
 None
 1.15A 3ko0L-5nbsA:
undetectable
3ko0N-5nbsA:
undetectable		 3ko0L-5nbsA:
18.81
3ko0N-5nbsA:
18.81
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.
5no8 BACCELL_00875

(Bacteroides
cellulosilyticus) 		no annotation 4 GLY A 607
CYH A 647
PHE A 649
PHE A 650
 None
 1.15A 3ko0L-5no8A:
undetectable
3ko0N-5no8A:
0.0		 3ko0L-5no8A:
8.50
3ko0N-5no8A:
8.50
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.
5swi SUGAR HYDROLASE

(Streptococcus
pneumoniae) 		no annotation 5 GLY B 298
PHE B 317
PHE B 314
PHE B 301
PHE B 332
 None
 1.43A 3ko0L-5swiB:
undetectable
3ko0N-5swiB:
undetectable		 3ko0L-5swiB:
10.84
3ko0N-5swiB:
10.84
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.
5swi SUGAR HYDROLASE

(Streptococcus
pneumoniae) 		no annotation 4 GLY B 361
PHE B 270
PHE B  33
PHE B 328
 None
 1.08A 3ko0L-5swiB:
undetectable
3ko0N-5swiB:
undetectable		 3ko0L-5swiB:
10.84
3ko0N-5swiB:
10.84
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.
5ta1 GLYCOSIDE HYDROLASE

(Bacteroides
uniformis) 		no annotation 4 GLY A 193
CYH A 243
PHE A 264
PHE A 274
 None
 1.09A 3ko0L-5ta1A:
undetectable
3ko0N-5ta1A:
undetectable		 3ko0L-5ta1A:
9.09
3ko0N-5ta1A:
9.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5x2q TASTE RECEPTOR, TYPE
1, MEMBER 2A

(Oryzias latipes) 		PF01094
(ANF_receptor) 		4 GLY A 135
PHE A 367
PHE A 428
PHE A 420
 None
 1.16A 3ko0L-5x2qA:
undetectable
3ko0N-5x2qA:
undetectable		 3ko0L-5x2qA:
12.11
3ko0N-5x2qA:
12.11
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.
5x59 S PROTEIN

(Middle East
respiratory
syndrome-related
coronavirus) 		PF01601
(Corona_S2)
PF09408
(Spike_rec_bind) 		4 GLY A1011
PHE A 869
PHE A 972
PHE A1126
 None
 1.12A 3ko0L-5x59A:
0.7
3ko0N-5x59A:
0.7		 3ko0L-5x59A:
6.21
3ko0N-5x59A:
6.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5y00 GREEN FLUORESCENT
PROTEIN

(Olindias) 		no annotation 4 GLY A  37
PHE A  87
PHE A  73
PHE A  47
 None
None
CRQ  A  70 ( 3.8A)
CRQ  A  70 ( 4.7A)
 1.04A 3ko0L-5y00A:
undetectable
3ko0N-5y00A:
undetectable		 3ko0L-5y00A:
21.90
3ko0N-5y00A:
21.90
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.
6acd -

(-) 		no annotation 4 GLY A1026
PHE A 782
PHE A 784
PHE A1034
 None
 1.11A 3ko0L-6acdA:
1.2
3ko0N-6acdA:
1.2		 3ko0L-6acdA:
undetectable
3ko0N-6acdA:
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.
6b0k IOTA-CARRAGEENAN
SULFATASE

(Pseudoalteromonas) 		no annotation 4 GLY A 108
PHE A 224
PHE A 115
PHE A 148
 None
 1.00A 3ko0L-6b0kA:
undetectable
3ko0N-6b0kA:
undetectable		 3ko0L-6b0kA:
19.61
3ko0N-6b0kA:
19.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6bf6 INSULIN-DEGRADING
ENZYME

(Homo sapiens) 		no annotation 4 GLY A 260
PHE A 168
PHE A 169
PHE A 275
 None
 1.01A 3ko0L-6bf6A:
undetectable
3ko0N-6bf6A:
undetectable		 3ko0L-6bf6A:
21.57
3ko0N-6bf6A:
21.57
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.
6c5x SUPPRESSOR OF
CYTOKINE SIGNALLING
1

(Xenopus laevis) 		no annotation 4 GLY D  99
PHE D 209
PHE D 207
PHE D  79
 None
 1.00A 3ko0L-6c5xD:
undetectable
3ko0N-6c5xD:
undetectable		 3ko0L-6c5xD:
21.78
3ko0N-6c5xD:
21.78
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.
6fj4 ENDO-1,4-BETA-XYLANA
SE Y

(Ruminiclostridium
thermocellum) 		no annotation 4 GLY A 865
PHE A1011
PHE A1074
PHE A 860
 SEP  A 954 ( 3.7A)
None
None
None
 0.76A 3ko0L-6fj4A:
undetectable
3ko0N-6fj4A:
undetectable		 3ko0L-6fj4A:
17.27
3ko0N-6fj4A:
17.27