SIMILAR PATTERNS OF AMINO ACIDS FOR 1DVT_A_FLPA125

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.
1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A

(Corynebacterium
sp.) 		PF00248
(Aldo_ket_red) 		4 ALA A 129
LEU A 132
LEU A  76
THR A  74
 None
 0.80A 1dvtA-1a80A:
0.0
1dvtB-1a80A:
0.0		 1dvtA-1a80A:
19.55
1dvtB-1a80A:
19.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1atj PEROXIDASE C1A

(Armoracia
rusticana) 		PF00141
(peroxidase) 		4 ALA A 134
LEU A 145
LEU A 148
SER A 151
 None
None
HEM  A 350 ( 4.7A)
None
 0.92A 1dvtA-1atjA:
undetectable
1dvtB-1atjA:
undetectable		 1dvtA-1atjA:
15.69
1dvtB-1atjA:
15.69
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.
1e33 ARYLSULFATASE A

(Homo sapiens) 		PF00884
(Sulfatase)
PF14707
(Sulfatase_C) 		4 ALA P 464
LEU P 462
LEU P 441
LEU P 428
 None
 0.97A 1dvtA-1e33P:
0.0
1dvtB-1e33P:
undetectable		 1dvtA-1e33P:
13.82
1dvtB-1e33P:
13.82
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1gke TRANSTHYRETIN

(Rattus
norvegicus) 		PF00576
(Transthyretin) 		4 LEU A  17
LEU A 110
SER A 117
THR A 119
 None
 0.28A 1dvtA-1gkeA:
22.1
1dvtB-1gkeA:
21.1		 1dvtA-1gkeA:
84.62
1dvtB-1gkeA:
84.62
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.
1h2a HYDROGENASE

(Desulfovibrio
vulgaris) 		PF01058
(Oxidored_q6)
PF14720
(NiFe_hyd_SSU_C) 		4 LEU S  12
ALA S  72
LEU S 176
THR S 113
 None
None
None
SF4  S1001 (-4.7A)
 0.90A 1dvtA-1h2aS:
0.0
1dvtB-1h2aS:
0.0		 1dvtA-1h2aS:
17.42
1dvtB-1h2aS:
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.
1jd0 CARBONIC ANHYDRASE
XII

(Homo sapiens) 		PF00194
(Carb_anhydrase) 		4 LEU A  95
ALA A 116
LEU A 118
THR A 210
 None
 0.94A 1dvtA-1jd0A:
0.0
1dvtB-1jd0A:
0.0		 1dvtA-1jd0A:
17.00
1dvtB-1jd0A:
17.00
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.
1kcw CERULOPLASMIN

(Homo sapiens) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 LEU A 902
LEU A1007
LEU A 965
THR A1003
 None
 0.97A 1dvtA-1kcwA:
0.0
1dvtB-1kcwA:
0.0		 1dvtA-1kcwA:
8.42
1dvtB-1kcwA:
8.42
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.
1kkr 3-METHYLASPARTATE
AMMONIA-LYASE

(Citrobacter
amalonaticus) 		PF05034
(MAAL_N)
PF07476
(MAAL_C) 		4 LEU A 235
LEU A 270
LEU A 298
SER A 300
 None
 0.76A 1dvtA-1kkrA:
undetectable
1dvtB-1kkrA:
0.0		 1dvtA-1kkrA:
15.82
1dvtB-1kkrA:
15.82
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.
1ldj CULLIN HOMOLOG 1

(Homo sapiens) 		PF00888
(Cullin)
PF10557
(Cullin_Nedd8) 		4 ALA A 218
LEU A 133
SER A 161
THR A 166
 None
 0.79A 1dvtA-1ldjA:
undetectable
1dvtB-1ldjA:
undetectable		 1dvtA-1ldjA:
10.55
1dvtB-1ldjA:
10.55
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.
1o7d LYSOSOMAL
ALPHA-MANNOSIDASE

(Bos taurus) 		PF07748
(Glyco_hydro_38C)
PF09261
(Alpha-mann_mid) 		4 ALA B 419
LEU C 486
SER C 484
THR E 887
 None
 0.95A 1dvtA-1o7dB:
undetectable
1dvtB-1o7dB:
undetectable		 1dvtA-1o7dB:
21.31
1dvtB-1o7dB:
21.31
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.
1qq6 PROTEIN
(L-2-HALOACID
DEHALOGENASE)

(Xanthobacter
autotrophicus) 		PF00702
(Hydrolase) 		4 LEU A  75
LEU A  70
LEU A  43
THR A  62
 None
 0.79A 1dvtA-1qq6A:
undetectable
1dvtB-1qq6A:
undetectable		 1dvtA-1qq6A:
18.88
1dvtB-1qq6A:
18.88
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.
1rj6 CARBONIC ANHYDRASE
XIV

(Mus musculus) 		PF00194
(Carb_anhydrase) 		4 LEU A  95
ALA A 116
LEU A 118
THR A 210
 None
 0.90A 1dvtA-1rj6A:
undetectable
1dvtB-1rj6A:
undetectable		 1dvtA-1rj6A:
21.29
1dvtB-1rj6A:
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.
1s1f PUTATIVE CYTOCHROME
P450

(Streptomyces
coelicolor) 		PF00067
(p450) 		4 LEU A 104
LEU A 361
LEU A 358
THR A 113
 None
 0.93A 1dvtA-1s1fA:
undetectable
1dvtB-1s1fA:
undetectable		 1dvtA-1s1fA:
15.45
1dvtB-1s1fA:
15.45
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.
1sgj CITRATE LYASE, BETA
SUBUNIT

(Deinococcus
radiodurans) 		PF03328
(HpcH_HpaI) 		4 ALA A 182
LEU A 180
LEU A 169
LEU A 172
 None
 0.91A 1dvtA-1sgjA:
undetectable
1dvtB-1sgjA:
undetectable		 1dvtA-1sgjA:
18.09
1dvtB-1sgjA:
18.09
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.
1spx SHORT-CHAIN
REDUCTASE FAMILY
MEMBER (5L265)

(Caenorhabditis
elegans) 		PF13561
(adh_short_C2) 		4 ALA A 165
LEU A 128
SER A 124
THR A  69
 None
 0.96A 1dvtA-1spxA:
undetectable
1dvtB-1spxA:
undetectable		 1dvtA-1spxA:
16.91
1dvtB-1spxA:
16.91
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.
1sxj ACTIVATOR 1 40 KDA
SUBUNIT
ACTIVATOR 1 41 KDA
SUBUNIT

(Saccharomyces
cerevisiae) 		PF00004
(AAA)
PF08542
(Rep_fac_C)
PF13177
(DNA_pol3_delta2) 		4 LEU E 146
LEU D 139
SER D 144
THR D 146
 None
 0.91A 1dvtA-1sxjE:
undetectable
1dvtB-1sxjE:
undetectable		 1dvtA-1sxjE:
17.15
1dvtB-1sxjE:
17.15
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.
1szq 2-METHYLCITRATE
DEHYDRATASE

(Escherichia
coli) 		PF03972
(MmgE_PrpD) 		4 LEU A 200
ALA A 239
LEU A 235
LEU A  83
 None
 0.94A 1dvtA-1szqA:
undetectable
1dvtB-1szqA:
undetectable		 1dvtA-1szqA:
14.32
1dvtB-1szqA:
14.32
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.
1v3y PEPTIDE DEFORMYLASE

(Thermus
thermophilus) 		PF01327
(Pep_deformylase) 		4 ALA A  47
LEU A 108
LEU A 105
SER A 104
 None
None
OCS  A 102 ( 4.4A)
OCS  A 102 ( 3.3A)
 0.91A 1dvtA-1v3yA:
undetectable
1dvtB-1v3yA:
undetectable		 1dvtA-1v3yA:
20.81
1dvtB-1v3yA:
20.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wch PROTEIN TYROSINE
PHOSPHATASE,
NON-RECEPTOR TYPE 13

(Homo sapiens) 		PF00102
(Y_phosphatase) 		4 ALA A2473
LEU A2471
LEU A2207
LEU A2204
 None
 0.97A 1dvtA-1wchA:
undetectable
1dvtB-1wchA:
undetectable		 1dvtA-1wchA:
17.98
1dvtB-1wchA:
17.98
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.
1wmw GERANYLGERANYL
DIPHOSPHATE
SYNTHETASE

(Thermus
thermophilus) 		PF00348
(polyprenyl_synt) 		4 LEU A 261
ALA A 257
LEU A 284
THR A 237
 None
 0.96A 1dvtA-1wmwA:
undetectable
1dvtB-1wmwA:
undetectable		 1dvtA-1wmwA:
16.72
1dvtB-1wmwA:
16.72
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.
1zc6 PROBABLE
N-ACETYLGLUCOSAMINE
KINASE

(Chromobacterium
violaceum) 		PF01869
(BcrAD_BadFG) 		4 LEU A  35
LEU A  27
LEU A  81
THR A  23
 None
 0.83A 1dvtA-1zc6A:
undetectable
1dvtB-1zc6A:
undetectable		 1dvtA-1zc6A:
15.49
1dvtB-1zc6A:
15.49
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.
1zgj ISOFLAVANONE
4'-O-METHYLTRANSFERA
SE'

(Medicago
truncatula) 		PF00891
(Methyltransf_2)
PF08100
(Dimerisation) 		4 LYS A 294
ALA A 260
LEU A 262
LEU A 238
 None
 0.76A 1dvtA-1zgjA:
undetectable
1dvtB-1zgjA:
undetectable		 1dvtA-1zgjA:
15.34
1dvtB-1zgjA:
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.
2bid PROTEIN (BID)

(Homo sapiens) 		PF06393
(BID) 		4 LEU A 136
ALA A 132
LEU A 153
LEU A  22
 None
 0.96A 1dvtA-2bidA:
undetectable
1dvtB-2bidA:
undetectable		 1dvtA-2bidA:
19.70
1dvtB-2bidA:
19.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2dpg GLUCOSE 6-PHOSPHATE
DEHYDROGENASE

(Leuconostoc
mesenteroides) 		PF00479
(G6PD_N)
PF02781
(G6PD_C) 		4 LEU A 381
ALA A 367
LEU A 369
LEU A 320
 None
 0.94A 1dvtA-2dpgA:
undetectable
1dvtB-2dpgA:
undetectable		 1dvtA-2dpgA:
13.40
1dvtB-2dpgA:
13.40
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.
2gt1 LIPOPOLYSACCHARIDE
HEPTOSYLTRANSFERASE-
1

(Escherichia
coli) 		PF01075
(Glyco_transf_9) 		5 LEU A 264
ALA A 186
LEU A 184
LEU A 205
LEU A 202
 None
 1.34A 1dvtA-2gt1A:
undetectable
1dvtB-2gt1A:
undetectable		 1dvtA-2gt1A:
17.08
1dvtB-2gt1A:
17.08
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.
2gw1 MITOCHONDRIAL
PRECURSOR PROTEINS
IMPORT RECEPTOR

(Saccharomyces
cerevisiae) 		PF00515
(TPR_1)
PF13181
(TPR_8)
PF13432
(TPR_16) 		4 ALA A 301
LEU A 287
LEU A 316
LEU A 329
 None
 0.98A 1dvtA-2gw1A:
undetectable
1dvtB-2gw1A:
undetectable		 1dvtA-2gw1A:
13.83
1dvtB-2gw1A:
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.
2h0q SUPPRESSOR OF T-CELL
RECEPTOR SIGNALING 1

(Mus musculus) 		PF00300
(His_Phos_1) 		4 ALA A 511
LEU A 509
LEU A 474
LEU A 471
 None
 0.92A 1dvtA-2h0qA:
undetectable
1dvtB-2h0qA:
undetectable		 1dvtA-2h0qA:
18.22
1dvtB-2h0qA:
18.22
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.
2iag PROSTACYCLIN
SYNTHASE

(Homo sapiens) 		PF00067
(p450) 		4 LEU A 172
ALA A 291
LEU A 217
LEU A 214
 None
HEM  A 600 ( 3.8A)
None
None
 0.92A 1dvtA-2iagA:
undetectable
1dvtB-2iagA:
undetectable		 1dvtA-2iagA:
13.45
1dvtB-2iagA:
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.
2j3t TRAFFICKING PROTEIN
PARTICLE COMPLEX
SUBUNIT 1
TRAFFICKING PROTEIN
PARTICLE COMPLEX
SUBUNIT 4

(Homo sapiens;
Mus musculus) 		PF04099
(Sybindin) 		4 LEU D 158
LEU D 144
LEU C  71
THR C  66
 None
 0.91A 1dvtA-2j3tD:
undetectable
1dvtB-2j3tD:
undetectable		 1dvtA-2j3tD:
22.71
1dvtB-2j3tD:
22.71
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.
2j8x URACIL-DNA
GLYCOSYLASE

(Human
gammaherpesvirus
4) 		PF03167
(UDG) 		4 ALA A 102
LEU A  88
LEU A 238
THR A 210
 None
 0.98A 1dvtA-2j8xA:
undetectable
1dvtB-2j8xA:
undetectable		 1dvtA-2j8xA:
20.09
1dvtB-2j8xA:
20.09
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.
2le9 ADVANCED
GLYCOSYLATION END
PRODUCT-SPECIFIC
RECEPTOR

(Homo sapiens) 		PF13895
(Ig_2) 		4 LYS A  43
LEU A  48
LEU A  50
SER A  53
 None
 0.97A 1dvtA-2le9A:
undetectable
1dvtB-2le9A:
undetectable		 1dvtA-2le9A:
16.67
1dvtB-2le9A:
16.67
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.
2odo ALANINE RACEMASE

(Pseudomonas
fluorescens) 		PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N) 		4 LEU A 197
ALA A  20
LEU A 155
SER A 204
 None
 0.83A 1dvtA-2odoA:
undetectable
1dvtB-2odoA:
undetectable		 1dvtA-2odoA:
16.21
1dvtB-2odoA:
16.21
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.
2p90 HYPOTHETICAL PROTEIN
CGL1923

(Corynebacterium
glutamicum) 		PF09754
(PAC2) 		4 ALA A  36
LEU A  93
LEU A 107
THR A 135
 None
 0.96A 1dvtA-2p90A:
undetectable
1dvtB-2p90A:
undetectable		 1dvtA-2p90A:
18.37
1dvtB-2p90A:
18.37
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.
2ph5 HOMOSPERMIDINE
SYNTHASE

(Legionella
pneumophila) 		PF03435
(Sacchrp_dh_NADP)
PF16653
(Sacchrp_dh_C) 		4 LEU A  31
ALA A  27
LEU A  19
THR A  44
 None
 0.80A 1dvtA-2ph5A:
undetectable
1dvtB-2ph5A:
undetectable		 1dvtA-2ph5A:
14.70
1dvtB-2ph5A:
14.70
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.
2qny 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3

(Mycobacterium
tuberculosis) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		4 LEU A 308
ALA A 216
LEU A 301
THR A 177
 None
 0.92A 1dvtA-2qnyA:
undetectable
1dvtB-2qnyA:
undetectable		 1dvtA-2qnyA:
15.87
1dvtB-2qnyA:
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.
2qyo O-METHYLTRANSFERASE

(Medicago
truncatula) 		PF00891
(Methyltransf_2)
PF08100
(Dimerisation) 		4 LYS A 288
ALA A 254
LEU A 256
LEU A 232
 None
 0.85A 1dvtA-2qyoA:
undetectable
1dvtB-2qyoA:
undetectable		 1dvtA-2qyoA:
14.33
1dvtB-2qyoA:
14.33
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.
2rkc HEMAGGLUTININ

(Measles
morbillivirus) 		PF00423
(HN) 		4 ALA A 298
LEU A 324
LEU A 208
LEU A 205
 None
 0.91A 1dvtA-2rkcA:
undetectable
1dvtB-2rkcA:
undetectable		 1dvtA-2rkcA:
15.73
1dvtB-2rkcA:
15.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2w9m POLYMERASE X

(Deinococcus
radiodurans) 		PF14520
(HHH_5)
PF14716
(HHH_8) 		4 LEU A 321
ALA A 533
LEU A 547
SER A 546
 None
 0.86A 1dvtA-2w9mA:
undetectable
1dvtB-2w9mA:
undetectable		 1dvtA-2w9mA:
12.45
1dvtB-2w9mA:
12.45
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.
2wed PENICILLOPEPSIN

(Penicillium
janthinellum) 		PF00026
(Asp) 		4 LEU A  66
LEU A 122
LEU A  39
THR A 138
 None
 0.93A 1dvtA-2wedA:
undetectable
1dvtB-2wedA:
undetectable		 1dvtA-2wedA:
19.44
1dvtB-2wedA:
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.
2x49 INVASION PROTEIN
INVA

(Salmonella
enterica) 		PF00771
(FHIPEP) 		4 ALA A 477
LEU A 429
LEU A 470
LEU A 467
 None
 0.94A 1dvtA-2x49A:
undetectable
1dvtB-2x49A:
undetectable		 1dvtA-2x49A:
15.48
1dvtB-2x49A:
15.48
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.
2xax RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE 1
SUBUNIT ALPHA

(Escherichia
coli) 		PF00317
(Ribonuc_red_lgN)
PF02867
(Ribonuc_red_lgC)
PF03477
(ATP-cone) 		4 LYS A 575
ALA A 574
LEU A 489
LEU A 513
 None
 0.96A 1dvtA-2xaxA:
undetectable
1dvtB-2xaxA:
undetectable		 1dvtA-2xaxA:
10.30
1dvtB-2xaxA:
10.30
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.
2xs6 PHOSPHATIDYLINOSITOL
3-KINASE REGULATORY
SUBUNIT BETA

(Homo sapiens) 		PF00620
(RhoGAP) 		4 LEU A 111
LEU A 181
LEU A 255
THR A 187
 None
 0.98A 1dvtA-2xs6A:
undetectable
1dvtB-2xs6A:
undetectable		 1dvtA-2xs6A:
21.46
1dvtB-2xs6A:
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.
2z1k (NEO)PULLULANASE

(Thermus
thermophilus) 		PF00128
(Alpha-amylase) 		4 ALA A 422
LEU A 409
LEU A 446
LEU A 471
 None
 0.86A 1dvtA-2z1kA:
undetectable
1dvtB-2z1kA:
undetectable		 1dvtA-2z1kA:
14.70
1dvtB-2z1kA:
14.70
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.
2zt9 CYTOCHROME B6-F
COMPLEX SUBUNIT 4

(Nostoc sp. PCC
7120) 		PF00032
(Cytochrom_B_C) 		4 LEU B 149
LEU B  96
LEU B  91
SER B  90
 None
 0.98A 1dvtA-2zt9B:
undetectable
1dvtB-2zt9B:
undetectable		 1dvtA-2zt9B:
23.31
1dvtB-2zt9B:
23.31
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.
3aw8 PHOSPHORIBOSYLAMINOI
MIDAZOLE
CARBOXYLASE, ATPASE
SUBUNIT

(Thermus
thermophilus) 		PF02222
(ATP-grasp) 		4 LEU A  21
ALA A  17
LEU A  23
LEU A  28
 None
 0.98A 1dvtA-3aw8A:
undetectable
1dvtB-3aw8A:
undetectable		 1dvtA-3aw8A:
15.26
1dvtB-3aw8A:
15.26
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.
3b4y PROBABLE
F420-DEPENDENT
GLUCOSE-6-PHOSPHATE
DEHYDROGENASE FGD1

(Mycobacterium
tuberculosis) 		PF00296
(Bac_luciferase) 		4 LEU A 332
LEU A   6
LEU A  69
SER A  34
 None
 0.95A 1dvtA-3b4yA:
undetectable
1dvtB-3b4yA:
undetectable		 1dvtA-3b4yA:
16.82
1dvtB-3b4yA:
16.82
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.
3bg0 NUCLEOPORIN NUP145

(Saccharomyces
cerevisiae) 		PF12110
(Nup96) 		4 LEU B 434
ALA B 426
LEU B 424
THR B 456
 None
 0.94A 1dvtA-3bg0B:
undetectable
1dvtB-3bg0B:
undetectable		 1dvtA-3bg0B:
15.07
1dvtB-3bg0B:
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.
3blx ISOCITRATE
DEHYDROGENASE [NAD]
SUBUNIT 2

(Saccharomyces
cerevisiae) 		PF00180
(Iso_dh) 		4 ALA B  83
LEU B 133
SER B 267
THR B 265
 None
 0.95A 1dvtA-3blxB:
undetectable
1dvtB-3blxB:
undetectable		 1dvtA-3blxB:
17.85
1dvtB-3blxB:
17.85
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.
3cnj CHOLESTEROL OXIDASE

(Streptomyces
sp. SA-COO) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		4 LEU A 416
ALA A 360
LEU A  80
LEU A 432
 None
 0.88A 1dvtA-3cnjA:
undetectable
1dvtB-3cnjA:
undetectable		 1dvtA-3cnjA:
13.67
1dvtB-3cnjA:
13.67
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.
3d3d LYSOZYME

(Escherichia
virus Lambda) 		PF00959
(Phage_lysozyme) 		4 LEU A  12
LEU A  15
SER A  18
THR A  21
 None
 0.94A 1dvtA-3d3dA:
undetectable
1dvtB-3d3dA:
undetectable		 1dvtA-3d3dA:
19.75
1dvtB-3d3dA:
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.
3egj N-ACETYLGLUCOSAMINE-
6-PHOSPHATE
DEACETYLASE

(Vibrio cholerae) 		PF01979
(Amidohydro_1) 		5 LEU A 267
ALA A 328
LEU A   4
LEU A  51
SER A  52
 None
 1.31A 1dvtA-3egjA:
undetectable
1dvtB-3egjA:
undetectable		 1dvtA-3egjA:
16.01
1dvtB-3egjA:
16.01
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.
3evz METHYLTRANSFERASE

(Pyrococcus
furiosus) 		PF05175
(MTS) 		4 LYS A 135
LEU A 240
LEU A 202
SER A 154
 None
 0.90A 1dvtA-3evzA:
undetectable
1dvtB-3evzA:
undetectable		 1dvtA-3evzA:
19.64
1dvtB-3evzA:
19.64
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3fc8 TRANSTHYRETIN

(Homo sapiens) 		PF00576
(Transthyretin) 		4 LEU A  17
LEU A 110
SER A 117
THR A 119
 IFA  A3000 ( 4.7A)
IFA  A3000 (-4.1A)
IFA  A3000 (-3.9A)
IFA  A3000 ( 4.9A)
 0.32A 1dvtA-3fc8A:
24.1
1dvtB-3fc8A:
23.0		 1dvtA-3fc8A:
99.19
1dvtB-3fc8A:
99.19
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3fc8 TRANSTHYRETIN

(Homo sapiens) 		PF00576
(Transthyretin) 		4 LYS A  15
LEU A  17
ALA A 108
LEU A 110
 IFA  A3000 (-3.0A)
IFA  A3000 ( 4.7A)
IFA  A3000 (-3.1A)
IFA  A3000 (-4.1A)
 0.76A 1dvtA-3fc8A:
24.1
1dvtB-3fc8A:
23.0		 1dvtA-3fc8A:
99.19
1dvtB-3fc8A:
99.19
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.
3gfq FMN-DEPENDENT
NADPH-AZOREDUCTASE

(Bacillus
subtilis) 		PF03358
(FMN_red) 		4 LEU A 134
ALA A 100
LEU A 102
THR A   9
 None
None
None
FMN  A 200 (-2.9A)
 0.79A 1dvtA-3gfqA:
undetectable
1dvtB-3gfqA:
undetectable		 1dvtA-3gfqA:
21.05
1dvtB-3gfqA:
21.05
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.
3h0g DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB4

(Schizosaccharomyces
pombe) 		PF03874
(RNA_pol_Rpb4) 		4 LEU D  15
ALA D  10
LEU D 111
SER D 110
 None
 0.96A 1dvtA-3h0gD:
undetectable
1dvtB-3h0gD:
undetectable		 1dvtA-3h0gD:
20.55
1dvtB-3h0gD:
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.
3hft WBMS, POLYSACCHARIDE
DEACETYLASE INVOLVED
IN O-ANTIGEN
BIOSYNTHESIS

(Bordetella
bronchiseptica) 		no annotation 4 LEU A 252
LEU A 248
LEU A 183
THR A 215
 None
 0.92A 1dvtA-3hftA:
undetectable
1dvtB-3hftA:
undetectable		 1dvtA-3hftA:
17.87
1dvtB-3hftA:
17.87
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.
3hvm AGMATINE DEIMINASE

(Helicobacter
pylori) 		PF04371
(PAD_porph) 		4 ALA A 219
LEU A 254
LEU A 315
THR A 286
 None
 0.95A 1dvtA-3hvmA:
undetectable
1dvtB-3hvmA:
undetectable		 1dvtA-3hvmA:
14.89
1dvtB-3hvmA:
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.
3ir4 GLUTAREDOXIN 2

(Salmonella
enterica) 		PF04399
(Glutaredoxin2_C)
PF13417
(GST_N_3) 		4 ALA A 141
LEU A 143
LEU A 210
LEU A 184
 None
 0.94A 1dvtA-3ir4A:
undetectable
1dvtB-3ir4A:
undetectable		 1dvtA-3ir4A:
18.69
1dvtB-3ir4A:
18.69
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.
3ita D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE
DACC

(Escherichia
coli) 		PF00768
(Peptidase_S11)
PF07943
(PBP5_C) 		4 ALA A 238
LEU A 236
LEU A  27
LEU A  18
 None
 0.98A 1dvtA-3itaA:
undetectable
1dvtB-3itaA:
undetectable		 1dvtA-3itaA:
17.12
1dvtB-3itaA:
17.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3iwk AMINOALDEHYDE
DEHYDROGENASE

(Pisum sativum) 		PF00171
(Aldedh) 		4 LEU A 184
LEU A 157
SER A 235
THR A 237
 None
 0.86A 1dvtA-3iwkA:
undetectable
1dvtB-3iwkA:
undetectable		 1dvtA-3iwkA:
13.47
1dvtB-3iwkA:
13.47
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.
3k1z HALOACID
DEHALOGENASE-LIKE
HYDROLASE
DOMAIN-CONTAINING
PROTEIN 3

(Homo sapiens) 		PF13419
(HAD_2) 		4 LEU A 101
ALA A  28
LEU A  18
LEU A  19
 GOL  A   3 (-4.8A)
None
None
None
 0.93A 1dvtA-3k1zA:
undetectable
1dvtB-3k1zA:
undetectable		 1dvtA-3k1zA:
17.11
1dvtB-3k1zA:
17.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kg9 CURK

(Lyngbya
majuscula) 		PF14765
(PS-DH) 		4 LEU A1167
ALA A1158
LEU A1163
LEU A1020
 None
 0.94A 1dvtA-3kg9A:
undetectable
1dvtB-3kg9A:
undetectable		 1dvtA-3kg9A:
17.11
1dvtB-3kg9A:
17.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kve L-AMINO ACID OXIDASE

(Vipera
ammodytes) 		PF01593
(Amino_oxidase) 		4 LEU A 206
LEU A 207
LEU A 221
SER A 220
 None
 0.90A 1dvtA-3kveA:
undetectable
1dvtB-3kveA:
undetectable		 1dvtA-3kveA:
14.55
1dvtB-3kveA:
14.55
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.
3my9 MUCONATE
CYCLOISOMERASE

(Azorhizobium
caulinodans) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 ALA A  53
LEU A  39
LEU A 126
LEU A 112
 None
 0.72A 1dvtA-3my9A:
undetectable
1dvtB-3my9A:
undetectable		 1dvtA-3my9A:
16.62
1dvtB-3my9A:
16.62
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.
3om5 LEVANSUCRASE

(Bacillus
megaterium) 		PF02435
(Glyco_hydro_68) 		4 LEU A 365
ALA A 354
LEU A 178
THR A 105
 None
 0.87A 1dvtA-3om5A:
undetectable
1dvtB-3om5A:
undetectable		 1dvtA-3om5A:
14.86
1dvtB-3om5A:
14.86
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.
3on3 KETO/OXOACID
FERREDOXIN
OXIDOREDUCTASE,
GAMMA SUBUNIT

(Geobacter
sulfurreducens) 		PF01558
(POR) 		4 LEU A  95
ALA A  72
LEU A  74
SER A  53
 None
 0.90A 1dvtA-3on3A:
undetectable
1dvtB-3on3A:
undetectable		 1dvtA-3on3A:
23.43
1dvtB-3on3A:
23.43
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.
3os6 ISOCHORISMATE
SYNTHASE DHBC

(Bacillus
anthracis) 		PF00425
(Chorismate_bind) 		4 LEU A 149
ALA A 361
LEU A 359
THR A 190
 None
 0.78A 1dvtA-3os6A:
undetectable
1dvtB-3os6A:
undetectable		 1dvtA-3os6A:
17.13
1dvtB-3os6A:
17.13
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.
3ozx RNASE L INHIBITOR

(Sulfolobus
solfataricus) 		PF00005
(ABC_tran) 		4 LEU A 406
ALA A 478
LEU A 480
THR A 342
 None
 0.94A 1dvtA-3ozxA:
undetectable
1dvtB-3ozxA:
undetectable		 1dvtA-3ozxA:
12.69
1dvtB-3ozxA:
12.69
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.
3prx COBRA VENOM FACTOR

(Naja kaouthia) 		PF00207
(A2M)
PF01759
(NTR)
PF01821
(ANATO)
PF01835
(A2M_N)
PF07677
(A2M_recep)
PF07678
(A2M_comp)
PF07703
(A2M_N_2)
PF10569
(Thiol-ester_cl) 		4 LEU B 280
LEU B 264
SER B 317
THR B 319
 None
 0.61A 1dvtA-3prxB:
2.1
1dvtB-3prxB:
3.6		 1dvtA-3prxB:
6.45
1dvtB-3prxB:
6.45
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.
3q1x SERINE
ACETYLTRANSFERASE

(Entamoeba
histolytica) 		PF00132
(Hexapep) 		4 LEU A  93
ALA A   9
LEU A  96
THR A 102
 None
 0.92A 1dvtA-3q1xA:
undetectable
1dvtB-3q1xA:
undetectable		 1dvtA-3q1xA:
16.46
1dvtB-3q1xA:
16.46
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.
3qcw NEUREXIN-1-ALPHA

(Bos taurus) 		PF00008
(EGF)
PF02210
(Laminin_G_2) 		4 LEU A 900
LEU A 785
LEU A 776
THR A 765
 None
 0.91A 1dvtA-3qcwA:
undetectable
1dvtB-3qcwA:
undetectable		 1dvtA-3qcwA:
7.20
1dvtB-3qcwA:
7.20
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.
3qki GLUCOSE-6-PHOSPHATE
ISOMERASE

(Plasmodium
falciparum) 		PF00342
(PGI) 		4 LEU A  60
LEU A  63
LEU A   8
SER A  10
 None
 0.93A 1dvtA-3qkiA:
undetectable
1dvtB-3qkiA:
undetectable		 1dvtA-3qkiA:
11.49
1dvtB-3qkiA:
11.49
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.
3rbl AROMATIC L-AMINO
ACID DECARBOXYLASE

(Homo sapiens) 		PF00282
(Pyridoxal_deC) 		4 ALA A 151
LEU A 287
LEU A 243
THR A 245
 None
 0.98A 1dvtA-3rblA:
undetectable
1dvtB-3rblA:
undetectable		 1dvtA-3rblA:
12.88
1dvtB-3rblA:
12.88
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.
3s4w FANCONI ANEMIA GROUP
D2 PROTEIN HOMOLOG

(Mus musculus) 		PF14631
(FancD2) 		4 LEU B 303
LEU B 378
LEU B 454
LEU B 415
 None
 0.96A 1dvtA-3s4wB:
undetectable
1dvtB-3s4wB:
undetectable		 1dvtA-3s4wB:
6.02
1dvtB-3s4wB:
6.02
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.
3s6p CAPSID PROTEIN

(Helicoverpa
armigera stunt
virus) 		PF03566
(Peptidase_A21) 		4 ALA A 283
LEU A 417
LEU A 329
LEU A 307
 None
 0.87A 1dvtA-3s6pA:
undetectable
1dvtB-3s6pA:
undetectable		 1dvtA-3s6pA:
13.07
1dvtB-3s6pA:
13.07
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.
3t5v NUCLEAR MRNA EXPORT
PROTEIN THP1

(Saccharomyces
cerevisiae) 		PF01399
(PCI) 		4 LEU B 109
ALA B 103
LEU B  98
SER B 155
 None
 0.89A 1dvtA-3t5vB:
undetectable
1dvtB-3t5vB:
undetectable		 1dvtA-3t5vB:
12.75
1dvtB-3t5vB:
12.75
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.
3t6a BREAST CANCER
ANTI-ESTROGEN
RESISTANCE PROTEIN 3

(Homo sapiens) 		PF00617
(RasGEF) 		4 LEU A 716
LEU A 644
LEU A 709
THR A 746
 None
None
None
POG  A 834 ( 4.5A)
 0.89A 1dvtA-3t6aA:
undetectable
1dvtB-3t6aA:
undetectable		 1dvtA-3t6aA:
16.22
1dvtB-3t6aA:
16.22
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.
3t6g BREAST CANCER
ANTI-ESTROGEN
RESISTANCE PROTEIN 1

(Homo sapiens) 		PF12026
(DUF3513) 		4 LEU B 799
LEU B 822
LEU B 819
SER B 816
 None
 0.96A 1dvtA-3t6gB:
undetectable
1dvtB-3t6gB:
undetectable		 1dvtA-3t6gB:
19.65
1dvtB-3t6gB:
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.
3t6s CERJ

(Streptomyces
tendae) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		4 LEU A  80
ALA A 140
LEU A 308
LEU A 305
 None
 0.90A 1dvtA-3t6sA:
undetectable
1dvtB-3t6sA:
undetectable		 1dvtA-3t6sA:
16.20
1dvtB-3t6sA:
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.
3ufx SUCCINYL-COA
SYNTHETASE BETA
SUBUNIT

(Thermus
aquaticus) 		PF00549
(Ligase_CoA)
PF08442
(ATP-grasp_2) 		4 ALA B 213
LEU B 209
LEU B 115
LEU B 104
 None
 0.90A 1dvtA-3ufxB:
undetectable
1dvtB-3ufxB:
undetectable		 1dvtA-3ufxB:
16.05
1dvtB-3ufxB:
16.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ujh GLUCOSE-6-PHOSPHATE
ISOMERASE

(Toxoplasma
gondii) 		PF00342
(PGI) 		4 LEU A 321
LEU A 493
LEU A 160
THR A 361
 None
CL  A 565 ( 4.4A)
None
None
 0.99A 1dvtA-3ujhA:
undetectable
1dvtB-3ujhA:
undetectable		 1dvtA-3ujhA:
12.59
1dvtB-3ujhA:
12.59
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.
3vov GLUCOKINASE

(Thermus
thermophilus) 		PF00480
(ROK) 		4 ALA A 185
LEU A 180
LEU A 260
LEU A 259
 None
 0.98A 1dvtA-3vovA:
undetectable
1dvtB-3vovA:
undetectable		 1dvtA-3vovA:
17.54
1dvtB-3vovA:
17.54
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.
3wx5 CELLULASE

(uncultured
bacterium) 		PF01670
(Glyco_hydro_12) 		4 ALA A 184
LEU A 181
LEU A 258
LEU A 121
 None
 0.73A 1dvtA-3wx5A:
undetectable
1dvtB-3wx5A:
undetectable		 1dvtA-3wx5A:
18.80
1dvtB-3wx5A:
18.80
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.
3zyo LEUCINE-RICH
REPEAT-CONTAINING
PROTEIN 4B

(Mus musculus) 		PF00560
(LRR_1)
PF07679
(I-set)
PF13855
(LRR_8) 		4 LEU A 405
LEU A 399
SER A 450
THR A 452
 None
 0.79A 1dvtA-3zyoA:
undetectable
1dvtB-3zyoA:
3.0		 1dvtA-3zyoA:
14.36
1dvtB-3zyoA:
14.36
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.
4bas ADP-RIBOSYLATION
FACTOR, PUTATIVE
(SMALL GTPASE,
PUTATIVE)

(Trypanosoma
brucei) 		PF00025
(Arf) 		4 ALA A 136
LEU A 138
LEU A 173
LEU A 121
 None
 0.87A 1dvtA-4basA:
undetectable
1dvtB-4basA:
undetectable		 1dvtA-4basA:
19.70
1dvtB-4basA:
19.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bax GLUTAMINE SYNTHETASE

(Streptomyces
coelicolor) 		PF00120
(Gln-synt_C)
PF03951
(Gln-synt_N) 		4 LEU A 105
ALA A 101
LEU A 202
SER A 199
 None
 0.77A 1dvtA-4baxA:
undetectable
1dvtB-4baxA:
undetectable		 1dvtA-4baxA:
17.82
1dvtB-4baxA:
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.
4c22 L-FUCOSE ISOMERASE

(Streptococcus
pneumoniae) 		PF02952
(Fucose_iso_C)
PF07881
(Fucose_iso_N1)
PF07882
(Fucose_iso_N2) 		4 LEU A 317
ALA A 295
LEU A 165
LEU A 169
 None
 0.96A 1dvtA-4c22A:
undetectable
1dvtB-4c22A:
undetectable		 1dvtA-4c22A:
12.85
1dvtB-4c22A:
12.85
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.
4cak INTEGRIN ALPHA-IIB
INTEGRIN BETA-3

(Homo sapiens) 		PF00362
(Integrin_beta)
PF01839
(FG-GAP)
PF07965
(Integrin_B_tail)
PF07974
(EGF_2)
PF08441
(Integrin_alpha2)
PF17205
(PSI_integrin) 		4 ALA B  30
LEU B 383
LEU A 562
SER B 369
 None
None
None
NAG  B3371 (-4.0A)
 0.98A 1dvtA-4cakB:
undetectable
1dvtB-4cakB:
undetectable		 1dvtA-4cakB:
10.77
1dvtB-4cakB:
10.77
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.
4ccd GALACTOCEREBROSIDASE

(Mus musculus) 		PF02057
(Glyco_hydro_59)
PF17387
(Glyco_hydro_59M) 		4 LEU A  70
ALA A 121
LEU A  79
THR A 335
 None
 0.81A 1dvtA-4ccdA:
undetectable
1dvtB-4ccdA:
undetectable		 1dvtA-4ccdA:
12.05
1dvtB-4ccdA:
12.05
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.
4cgr PUTATIVE TETR-FAMILY
TRANSCRIPTIONAL
REGULATOR

(Streptomyces
coelicolor) 		PF00440
(TetR_N) 		4 LEU A 213
ALA A 216
LEU A 143
THR A 132
 None
 0.89A 1dvtA-4cgrA:
undetectable
1dvtB-4cgrA:
undetectable		 1dvtA-4cgrA:
19.91
1dvtB-4cgrA:
19.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4d1d HYDANTOIN TRANSPORT
PROTEIN

(Microbacterium
liquefaciens) 		PF02133
(Transp_cyt_pur) 		4 ALA A 316
LEU A 366
LEU A 113
SER A 114
 None
 0.97A 1dvtA-4d1dA:
undetectable
1dvtB-4d1dA:
undetectable		 1dvtA-4d1dA:
14.08
1dvtB-4d1dA:
14.08
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.
4ejq KINESIN-LIKE PROTEIN
KIF1A

(Homo sapiens) 		PF00498
(FHA)
PF16183
(Kinesin_assoc) 		4 LEU A 469
ALA A 475
LEU A 494
THR A 491
 None
 0.92A 1dvtA-4ejqA:
undetectable
1dvtB-4ejqA:
undetectable		 1dvtA-4ejqA:
25.52
1dvtB-4ejqA:
25.52
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.
4fcg UNCHARACTERIZED
PROTEIN

(Xanthomonas
euvesicatoria) 		PF13855
(LRR_8) 		4 ALA A 363
LEU A 340
LEU A 261
LEU A 285
 None
 0.94A 1dvtA-4fcgA:
undetectable
1dvtB-4fcgA:
undetectable		 1dvtA-4fcgA:
14.94
1dvtB-4fcgA:
14.94
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.
4fcg UNCHARACTERIZED
PROTEIN

(Xanthomonas
euvesicatoria) 		PF13855
(LRR_8) 		5 LEU A 261
LEU A 285
LEU A 364
LEU A 340
SER A 338
 None
 1.35A 1dvtA-4fcgA:
undetectable
1dvtB-4fcgA:
undetectable		 1dvtA-4fcgA:
14.94
1dvtB-4fcgA:
14.94
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.
4frt PROBABLE PORIN

(Pseudomonas
aeruginosa) 		PF03573
(OprD) 		4 LEU A  40
ALA A   8
LEU A  10
LEU A 360
 None
 0.77A 1dvtA-4frtA:
undetectable
1dvtB-4frtA:
undetectable		 1dvtA-4frtA:
13.88
1dvtB-4frtA:
13.88
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.
4gvl TRKA DOMAIN PROTEIN

(Geobacter
sulfurreducens) 		PF02080
(TrkA_C)
PF02254
(TrkA_N) 		4 LEU A 280
ALA A 278
LEU A 329
LEU A 530
 None
 0.91A 1dvtA-4gvlA:
undetectable
1dvtB-4gvlA:
undetectable		 1dvtA-4gvlA:
15.12
1dvtB-4gvlA:
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.
4hp8 2-DEOXY-D-GLUCONATE
3-DEHYDROGENASE

(Agrobacterium
fabrum) 		PF13561
(adh_short_C2) 		4 LYS A 112
ALA A 113
SER A  74
THR A  76
 None
 0.97A 1dvtA-4hp8A:
undetectable
1dvtB-4hp8A:
undetectable		 1dvtA-4hp8A:
20.56
1dvtB-4hp8A:
20.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hyj RHODOPSIN

(Exiguobacterium
sibiricum) 		PF01036
(Bac_rhodopsin) 		5 LEU A 160
ALA A 118
LEU A 115
LEU A  49
LEU A  92
 None
LFA  A 306 ( 4.2A)
None
None
None
 1.41A 1dvtA-4hyjA:
undetectable
1dvtB-4hyjA:
undetectable		 1dvtA-4hyjA:
21.03
1dvtB-4hyjA:
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.
4i1u DEPHOSPHO-COA KINASE

(Burkholderia
vietnamiensis) 		PF01121
(CoaE) 		4 ALA A  35
LEU A  33
LEU A 128
LEU A   6
 None
 0.75A 1dvtA-4i1uA:
undetectable
1dvtB-4i1uA:
undetectable		 1dvtA-4i1uA:
22.61
1dvtB-4i1uA:
22.61