SIMILAR PATTERNS OF AMINO ACIDS FOR 5E4D_B_BEZB202_0

List of similar pattern of amino acids derived from ASSAM search

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

(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ac5 KEX1(DELTA)P

(Saccharomyces
cerevisiae) 		PF00450
(Peptidase_S10) 		4 VAL A 441
THR A 439
VAL A 469
THR A 482
 None
 0.94A 5e4dA-1ac5A:
0.5
5e4dB-1ac5A:
0.5		 5e4dA-1ac5A:
20.10
5e4dB-1ac5A:
20.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ac5 KEX1(DELTA)P

(Saccharomyces
cerevisiae) 		PF00450
(Peptidase_S10) 		4 VAL A 469
THR A 482
VAL A 441
THR A 439
 None
 0.93A 5e4dA-1ac5A:
0.5
5e4dB-1ac5A:
0.5		 5e4dA-1ac5A:
20.10
5e4dB-1ac5A:
20.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1d4e FLAVOCYTOCHROME C
FUMARATE REDUCTASE

(Shewanella
oneidensis) 		PF00890
(FAD_binding_2)
PF14537
(Cytochrom_c3_2) 		4 VAL A 464
THR A 463
LEU A 449
VAL A 455
 None
 0.94A 5e4dA-1d4eA:
0.0
5e4dB-1d4eA:
0.0		 5e4dA-1d4eA:
16.49
5e4dB-1d4eA:
16.49
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.
1d9s CYCLIN-DEPENDENT
KINASE 4 INHIBITOR B

(Mus musculus) 		PF12796
(Ank_2) 		4 VAL A  90
THR A  87
LEU A  59
MET A  46
 None
 0.95A 5e4dA-1d9sA:
undetectable
5e4dB-1d9sA:
undetectable		 5e4dA-1d9sA:
17.92
5e4dB-1d9sA:
17.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1d9z EXCINUCLEASE UVRABC
COMPONENT UVRB

([Bacillus]
caldotenax) 		PF00271
(Helicase_C)
PF04851
(ResIII)
PF12344
(UvrB) 		4 VAL A  52
LEU A 334
VAL A  62
THR A  60
 None
 1.00A 5e4dA-1d9zA:
0.0
5e4dB-1d9zA:
0.0		 5e4dA-1d9zA:
14.81
5e4dB-1d9zA:
14.81
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.
1e6v METHYL-COENZYME M
REDUCTASE I BETA
SUBUNIT

(Methanopyrus
kandleri) 		PF02241
(MCR_beta)
PF02783
(MCR_beta_N) 		4 VAL B 257
LEU B 400
VAL B 213
THR B 209
 None
 1.03A 5e4dA-1e6vB:
2.2
5e4dB-1e6vB:
undetectable		 5e4dA-1e6vB:
19.25
5e4dB-1e6vB:
19.25
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.
1eov ASPARTYL-TRNA
SYNTHETASE

(Saccharomyces
cerevisiae) 		PF00152
(tRNA-synt_2)
PF01336
(tRNA_anti-codon) 		4 VAL A 166
THR A 196
LEU A 128
THR A 118
 None
 1.04A 5e4dA-1eovA:
0.0
5e4dB-1eovA:
0.0		 5e4dA-1eovA:
18.31
5e4dB-1eovA:
18.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1i7n SYNAPSIN II

(Rattus
norvegicus) 		PF02078
(Synapsin)
PF02750
(Synapsin_C) 		4 VAL A 144
MET A 415
VAL A 411
THR A 408
 None
 0.90A 5e4dA-1i7nA:
0.0
5e4dB-1i7nA:
undetectable		 5e4dA-1i7nA:
21.41
5e4dB-1i7nA:
21.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1jo0 HYPOTHETICAL PROTEIN
HI1333

(Haemophilus
influenzae) 		PF01985
(CRS1_YhbY) 		4 VAL A  50
LEU A  42
VAL A  68
THR A  71
 None
None
GOL  A 103 (-4.5A)
None
 1.04A 5e4dA-1jo0A:
undetectable
5e4dB-1jo0A:
undetectable		 5e4dA-1jo0A:
17.59
5e4dB-1jo0A:
17.59
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.
1jye LACTOSE OPERON
REPRESSOR

(Escherichia
coli) 		PF13377
(Peripla_BP_3) 		4 VAL A 244
LEU A 286
VAL A 264
THR A 328
 None
 1.03A 5e4dA-1jyeA:
undetectable
5e4dB-1jyeA:
0.0		 5e4dA-1jyeA:
20.57
5e4dB-1jyeA:
20.57
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.
1kb0 QUINOHEMOPROTEIN
ALCOHOL
DEHYDROGENASE

(Comamonas
testosteroni) 		PF13360
(PQQ_2)
PF13442
(Cytochrome_CBB3) 		4 VAL A 120
THR A 167
ARG A  67
LEU A 547
 None
PQQ  A1800 (-2.9A)
HEC  A 802 (-4.2A)
None
 0.92A 5e4dA-1kb0A:
0.0
5e4dB-1kb0A:
0.0		 5e4dA-1kb0A:
15.20
5e4dB-1kb0A:
15.20
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.
1li7 CYSTEINYL-TRNA
SYNTHETASE

(Escherichia
coli) 		PF01406
(tRNA-synt_1e)
PF09190
(DALR_2) 		4 VAL A 280
LEU A 293
MET A 267
VAL A 260
 None
 1.02A 5e4dA-1li7A:
undetectable
5e4dB-1li7A:
undetectable		 5e4dA-1li7A:
17.03
5e4dB-1li7A:
17.03
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.
1lqs INTERLEUKIN-10-LIKE
PROTEIN

(Human
betaherpesvirus
5) 		PF00726
(IL10) 		4 VAL L  33
THR L  36
LEU L  91
VAL L  83
 None
 1.01A 5e4dA-1lqsL:
undetectable
5e4dB-1lqsL:
undetectable		 5e4dA-1lqsL:
20.29
5e4dB-1lqsL:
20.29
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.
1nvm ACETALDEHYDE
DEHYDROGENASE
(ACYLATING)

(Pseudomonas sp.
CF600) 		PF01118
(Semialdhyde_dh)
PF09290
(AcetDehyd-dimer) 		4 VAL B 147
LEU B 269
VAL B 247
THR B 271
 None
 0.99A 5e4dA-1nvmB:
undetectable
5e4dB-1nvmB:
undetectable		 5e4dA-1nvmB:
19.56
5e4dB-1nvmB:
19.56
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.
1q2l PROTEASE III

(Escherichia
coli) 		PF00675
(Peptidase_M16)
PF05193
(Peptidase_M16_C)
PF16187
(Peptidase_M16_M) 		4 VAL A  58
LEU A 428
VAL A 424
THR A 427
 None
 1.04A 5e4dA-1q2lA:
2.0
5e4dB-1q2lA:
2.2		 5e4dA-1q2lA:
13.31
5e4dB-1q2lA:
13.31
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.
1tlf LAC REPRESSOR

(Escherichia
coli) 		PF13377
(Peripla_BP_3) 		4 VAL A 244
LEU A 286
VAL A 264
THR A 328
 None
 0.99A 5e4dA-1tlfA:
undetectable
5e4dB-1tlfA:
undetectable		 5e4dA-1tlfA:
18.98
5e4dB-1tlfA:
18.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1u3o HUNTINGTIN-ASSOCIATE
D
PROTEIN-INTERACTING
PROTEIN

(Rattus
norvegicus) 		PF00018
(SH3_1) 		4 VAL A  42
THR A  20
LEU A  34
VAL A  70
 None
 0.98A 5e4dA-1u3oA:
undetectable
5e4dB-1u3oA:
undetectable		 5e4dA-1u3oA:
22.70
5e4dB-1u3oA:
22.70
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.
1vkz PHOSPHORIBOSYLAMINE-
-GLYCINE LIGASE

(Thermotoga
maritima) 		PF01071
(GARS_A)
PF02843
(GARS_C)
PF02844
(GARS_N) 		4 VAL A  62
LEU A 278
VAL A 287
THR A 283
 None
 0.78A 5e4dA-1vkzA:
undetectable
5e4dB-1vkzA:
undetectable		 5e4dA-1vkzA:
19.32
5e4dB-1vkzA:
19.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1vpv UPF0230 PROTEIN
TM1468

(Thermotoga
maritima) 		PF02645
(DegV) 		4 VAL A 164
THR A 276
LEU A 200
MET A 264
 None
 1.02A 5e4dA-1vpvA:
undetectable
5e4dB-1vpvA:
undetectable		 5e4dA-1vpvA:
22.55
5e4dB-1vpvA:
22.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1vr0 PROBABLE
2-PHOSPHOSULFOLACTAT
E PHOSPHATASE

(Clostridium
acetobutylicum) 		PF04029
(2-ph_phosp) 		4 LEU A 119
MET A   1
VAL A 140
THR A  21
 None
 1.02A 5e4dA-1vr0A:
undetectable
5e4dB-1vr0A:
undetectable		 5e4dA-1vr0A:
21.84
5e4dB-1vr0A:
21.84
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.
1woz 177AA LONG CONSERVED
HYPOTHETICAL PROTEIN
(ST1454)

(Sulfurisphaera
tokodaii) 		PF01923
(Cob_adeno_trans) 		4 VAL A  57
LEU A  34
MET A 156
THR A 117
 None
 1.04A 5e4dA-1wozA:
undetectable
5e4dB-1wozA:
undetectable		 5e4dA-1wozA:
19.74
5e4dB-1wozA:
19.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xf1 C5A PEPTIDASE

(Streptococcus
pyogenes) 		PF00082
(Peptidase_S8)
PF02225
(PA)
PF06280
(fn3_5)
PF13585
(CHU_C) 		4 VAL A 866
THR A 863
LEU A 719
VAL A 907
 None
 1.05A 5e4dA-1xf1A:
undetectable
5e4dB-1xf1A:
undetectable		 5e4dA-1xf1A:
12.65
5e4dB-1xf1A:
12.65
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.
2dfu PROBABLE
2-HYDROXYHEPTA-2,4-D
IENE-1,7-DIOATE
ISOMERASE

(Thermus
thermophilus) 		PF01557
(FAA_hydrolase)
PF10370
(DUF2437) 		4 VAL A 246
THR A 183
VAL A 206
THR A 227
 None
 1.04A 5e4dA-2dfuA:
undetectable
5e4dB-2dfuA:
undetectable		 5e4dA-2dfuA:
20.74
5e4dB-2dfuA:
20.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2dxa PROTEIN YBAK

(Escherichia
coli) 		PF04073
(tRNA_edit) 		4 VAL A 128
LEU A 148
VAL A  61
THR A 114
 None
 0.97A 5e4dA-2dxaA:
undetectable
5e4dB-2dxaA:
undetectable		 5e4dA-2dxaA:
19.72
5e4dB-2dxaA:
19.72
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.
2evr COG0791: CELL
WALL-ASSOCIATED
HYDROLASES
(INVASION-ASSOCIATED
PROTEINS)

(Nostoc
punctiforme) 		PF00877
(NLPC_P60) 		4 VAL A 225
THR A 152
LEU A 179
VAL A 177
 None
 1.04A 5e4dA-2evrA:
undetectable
5e4dB-2evrA:
undetectable		 5e4dA-2evrA:
22.57
5e4dB-2evrA:
22.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2g64 PUTATIVE 6-PYRUVOYL
TETRAHYDROBIOPTERIN
SYNTHASE

(Caenorhabditis
elegans) 		PF01242
(PTPS) 		4 VAL A  98
THR A 100
LEU A  26
THR A  34
 None
 1.02A 5e4dA-2g64A:
undetectable
5e4dB-2g64A:
undetectable		 5e4dA-2g64A:
18.14
5e4dB-2g64A:
18.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hbw NLP/P60 PROTEIN

(Trichormus
variabilis) 		PF00877
(NLPC_P60) 		4 VAL A 225
THR A 152
LEU A 179
VAL A 177
 None
 1.00A 5e4dA-2hbwA:
undetectable
5e4dB-2hbwA:
undetectable		 5e4dA-2hbwA:
18.88
5e4dB-2hbwA:
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.
2nux 2-KETO-3-DEOXYGLUCON
ATE/2-KETO-3-DEOXY-6
-PHOSPHO GLUCONATE
ALDOLASE

(Sulfolobus
acidocaldarius) 		PF00701
(DHDPS) 		4 VAL A  64
THR A  65
LEU A  22
VAL A  39
 None
 1.04A 5e4dA-2nuxA:
undetectable
5e4dB-2nuxA:
undetectable		 5e4dA-2nuxA:
21.36
5e4dB-2nuxA:
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.
2q7v THIOREDOXIN
REDUCTASE

(Deinococcus
radiodurans) 		PF07992
(Pyr_redox_2) 		4 VAL A 254
THR A 251
LEU A 279
THR A 274
 None
 1.01A 5e4dA-2q7vA:
undetectable
5e4dB-2q7vA:
undetectable		 5e4dA-2q7vA:
19.82
5e4dB-2q7vA:
19.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qbu PRECORRIN-2
METHYLTRANSFERASE

(Methanothermobacter
thermautotrophicus) 		PF00590
(TP_methylase) 		4 VAL A 226
THR A 224
LEU A 166
VAL A 158
 None
 0.96A 5e4dA-2qbuA:
undetectable
5e4dB-2qbuA:
undetectable		 5e4dA-2qbuA:
21.89
5e4dB-2qbuA:
21.89
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.
2rdp PUTATIVE
TRANSCRIPTIONAL
REGULATOR MARR

(Geobacillus
stearothermophilus) 		PF01047
(MarR) 		4 VAL A  43
LEU A  65
MET A  77
THR A  70
 None
 1.02A 5e4dA-2rdpA:
undetectable
5e4dB-2rdpA:
undetectable		 5e4dA-2rdpA:
18.91
5e4dB-2rdpA:
18.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2tpt THYMIDINE
PHOSPHORYLASE

(Escherichia
coli) 		PF00591
(Glycos_transf_3)
PF02885
(Glycos_trans_3N)
PF07831
(PYNP_C) 		4 LEU A 192
MET A  53
VAL A  57
THR A  60
 None
 0.95A 5e4dA-2tptA:
undetectable
5e4dB-2tptA:
undetectable		 5e4dA-2tptA:
18.18
5e4dB-2tptA:
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.
2v0j BIFUNCTIONAL PROTEIN
GLMU

(Haemophilus
influenzae) 		PF00132
(Hexapep)
PF12804
(NTP_transf_3) 		4 VAL A 172
THR A 170
LEU A 114
THR A 113
 None
 1.01A 5e4dA-2v0jA:
undetectable
5e4dB-2v0jA:
undetectable		 5e4dA-2v0jA:
18.52
5e4dB-2v0jA:
18.52
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.
2v5p CATION-INDEPENDENT
MANNOSE-6-PHOSPHATE
RECEPTOR

(Homo sapiens) 		PF00040
(fn2)
PF00878
(CIMR) 		4 VAL A1986
THR A1983
LEU A1874
VAL A1838
 None
 0.98A 5e4dA-2v5pA:
undetectable
5e4dB-2v5pA:
undetectable		 5e4dA-2v5pA:
17.31
5e4dB-2v5pA:
17.31
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.
2weu TRYPTOPHAN
5-HALOGENASE

(Streptomyces
rugosporus) 		PF04820
(Trp_halogenase) 		4 VAL A 195
THR A 211
LEU A 232
VAL A   6
 None
 1.05A 5e4dA-2weuA:
0.6
5e4dB-2weuA:
0.6		 5e4dA-2weuA:
16.96
5e4dB-2weuA:
16.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2x7q POSSIBLE THIAMINE
BIOSYNTHESIS ENZYME

(Candida
albicans) 		PF09084
(NMT1) 		4 THR A 269
LEU A 260
VAL A 191
THR A  80
 None
 0.84A 5e4dA-2x7qA:
undetectable
5e4dB-2x7qA:
undetectable		 5e4dA-2x7qA:
23.82
5e4dB-2x7qA:
23.82
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.
2yd7 PTPRD PROTEIN

(Homo sapiens) 		PF07679
(I-set) 		4 VAL A  31
ARG A  28
VAL A 202
THR A 158
 None
 1.02A 5e4dA-2yd7A:
undetectable
5e4dB-2yd7A:
undetectable		 5e4dA-2yd7A:
20.33
5e4dB-2yd7A:
20.33
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.
2zqp PREPROTEIN
TRANSLOCASE SECY
SUBUNIT

(Thermus
thermophilus) 		PF00344
(SecY) 		4 THR Y 411
LEU Y  25
VAL Y  18
THR Y  21
 None
 1.00A 5e4dA-2zqpY:
undetectable
5e4dB-2zqpY:
undetectable		 5e4dA-2zqpY:
18.75
5e4dB-2zqpY:
18.75
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.
2zqp PREPROTEIN
TRANSLOCASE SECY
SUBUNIT

(Thermus
thermophilus) 		PF00344
(SecY) 		4 VAL Y 407
THR Y 411
VAL Y  18
THR Y  21
 None
 1.04A 5e4dA-2zqpY:
undetectable
5e4dB-2zqpY:
undetectable		 5e4dA-2zqpY:
18.75
5e4dB-2zqpY:
18.75
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.
3abz BETA-GLUCOSIDASE I

(Kluyveromyces
marxianus) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF07691
(PA14)
PF14310
(Fn3-like) 		4 THR A  30
LEU A  99
MET A 281
THR A 144
 None
GOL  A5001 ( 3.9A)
None
None
 1.04A 5e4dA-3abzA:
undetectable
5e4dB-3abzA:
undetectable		 5e4dA-3abzA:
13.39
5e4dB-3abzA:
13.39
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.
3bjv RMPA

(Streptococcus
mutans) 		PF00359
(PTS_EIIA_2) 		4 VAL A  99
THR A  84
LEU A 122
VAL A 141
 None
 1.04A 5e4dA-3bjvA:
undetectable
5e4dB-3bjvA:
undetectable		 5e4dA-3bjvA:
22.13
5e4dB-3bjvA:
22.13
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.
3bw2 2-NITROPROPANE
DIOXYGENASE

(Streptomyces
ansochromogenes) 		PF03060
(NMO) 		4 VAL A  69
LEU A 141
VAL A 123
THR A 146
 None
 0.92A 5e4dA-3bw2A:
undetectable
5e4dB-3bw2A:
undetectable		 5e4dA-3bw2A:
17.56
5e4dB-3bw2A:
17.56
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.
3cgx PUTATIVE
NUCLEOTIDE-DIPHOSPHO
-SUGAR TRANSFERASE

(Desulfovibrio
alaskensis) 		PF09837
(DUF2064) 		4 VAL A 191
LEU A 218
MET A  42
THR A 214
 None
 1.05A 5e4dA-3cgxA:
undetectable
5e4dB-3cgxA:
undetectable		 5e4dA-3cgxA:
17.77
5e4dB-3cgxA:
17.77
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.
3crw XPD/RAD3 RELATED DNA
HELICASE

(Sulfolobus
acidocaldarius) 		PF06733
(DEAD_2)
PF13307
(Helicase_C_2) 		4 VAL 1  15
LEU 1  27
MET 1 176
VAL 1 178
 None
 1.04A 5e4dA-3crw1:
undetectable
5e4dB-3crw1:
undetectable		 5e4dA-3crw1:
15.41
5e4dB-3crw1:
15.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dkn PREPROTEIN
TRANSLOCASE SUBUNIT
SECY

(Canis lupus) 		PF00344
(SecY) 		4 VAL A 219
THR A 216
VAL A 178
THR A 405
 None
 1.05A 5e4dA-3dknA:
undetectable
5e4dB-3dknA:
undetectable		 5e4dA-3dknA:
18.18
5e4dB-3dknA:
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.
3e0l GUANINE DEAMINASE

(Homo sapiens) 		PF01979
(Amidohydro_1) 		4 VAL A 422
MET A  26
VAL A  28
THR A  16
 None
 1.04A 5e4dA-3e0lA:
undetectable
5e4dB-3e0lA:
undetectable		 5e4dA-3e0lA:
18.10
5e4dB-3e0lA:
18.10
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.
3ele AMINO TRANSFERASE

([Eubacterium]
rectale) 		PF00155
(Aminotran_1_2) 		4 VAL A 241
THR A 239
ARG A 220
THR A  94
 None
 1.03A 5e4dA-3eleA:
1.4
5e4dB-3eleA:
1.4		 5e4dA-3eleA:
18.97
5e4dB-3eleA:
18.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gas HEME OXYGENASE

(Helicobacter
pylori) 		PF01243
(Putative_PNPOx)
PF10615
(DUF2470) 		4 VAL A 101
LEU A 213
VAL A 147
THR A 171
 None
 0.89A 5e4dA-3gasA:
undetectable
5e4dB-3gasA:
undetectable		 5e4dA-3gasA:
21.64
5e4dB-3gasA:
21.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gyu NUCLEAR HORMONE
RECEPTOR OF THE
STEROID/THYROID
HORMONE RECEPTORS
SUPERFAMILY

(Strongyloides
stercoralis) 		PF00104
(Hormone_recep) 		4 VAL A 601
THR A 602
LEU A 721
VAL A 663
 None
 1.02A 5e4dA-3gyuA:
undetectable
5e4dB-3gyuA:
undetectable		 5e4dA-3gyuA:
21.40
5e4dB-3gyuA:
21.40
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.
3iv7 ALCOHOL
DEHYDROGENASE IV

(Corynebacterium
glutamicum) 		PF00465
(Fe-ADH) 		4 THR A 324
LEU A 253
VAL A 262
THR A 258
 None
 0.92A 5e4dA-3iv7A:
undetectable
5e4dB-3iv7A:
undetectable		 5e4dA-3iv7A:
20.80
5e4dB-3iv7A:
20.80
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.
3jb9 PRE-MRNA-SPLICING
FACTOR SPP42

(Schizosaccharomyces
pombe) 		PF08082
(PRO8NT)
PF08083
(PROCN)
PF10596
(U6-snRNA_bdg)
PF10597
(U5_2-snRNA_bdg)
PF10598
(RRM_4)
PF12134
(PRP8_domainIV) 		4 VAL A1118
LEU A1186
VAL A1007
THR A1191
 None
 0.95A 5e4dA-3jb9A:
undetectable
5e4dB-3jb9A:
undetectable		 5e4dA-3jb9A:
5.99
5e4dB-3jb9A:
5.99
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.
3jb9 SMALL NUCLEAR
RIBONUCLEOPROTEIN-AS
SOCIATED PROTEIN B
SMALL NUCLEAR
RIBONUCLEOPROTEIN SM
D1

(Schizosaccharomyces
pombe;
Schizosaccharomyces
pombe) 		PF01423
(LSM)
PF01423
(LSM) 		4 VAL F  47
THR F  23
VAL E  76
THR E  17
 None
 1.03A 5e4dA-3jb9F:
undetectable
5e4dB-3jb9F:
undetectable		 5e4dA-3jb9F:
19.72
5e4dB-3jb9F:
19.72
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.
3li9 HYPOTHETICAL SENSORY
TRANSDUCTION
HISTIDINE KINASE

(Methanosarcina
mazei) 		PF02743
(dCache_1) 		4 VAL A 285
THR A 287
LEU A 230
VAL A 180
 None
 1.04A 5e4dA-3li9A:
undetectable
5e4dB-3li9A:
undetectable		 5e4dA-3li9A:
23.21
5e4dB-3li9A:
23.21
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.
3ne5 CATION EFFLUX SYSTEM
PROTEIN CUSA

(Escherichia
coli) 		PF00873
(ACR_tran) 		4 VAL A 624
THR A 626
LEU A 658
VAL A 653
 None
 0.92A 5e4dA-3ne5A:
3.8
5e4dB-3ne5A:
3.8		 5e4dA-3ne5A:
11.04
5e4dB-3ne5A:
11.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3obv PROTEIN DIAPHANOUS
HOMOLOG 1

(Mus musculus) 		PF02181
(FH2)
PF06345
(Drf_DAD) 		4 THR E 993
MET E 970
VAL E 966
THR E 963
 None
 0.94A 5e4dA-3obvE:
undetectable
5e4dB-3obvE:
undetectable		 5e4dA-3obvE:
17.90
5e4dB-3obvE:
17.90
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.
3p4s FUMARATE REDUCTASE
FLAVOPROTEIN SUBUNIT

(Escherichia
coli) 		PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C) 		4 VAL A 229
THR A 357
MET A 213
VAL A 514
 None
 0.95A 5e4dA-3p4sA:
undetectable
5e4dB-3p4sA:
undetectable		 5e4dA-3p4sA:
15.81
5e4dB-3p4sA:
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.
3s2u UDP-N-ACETYLGLUCOSAM
INE--N-ACETYLMURAMYL
-(PENTAPEPTIDE)
PYROPHOSPHORYL-UNDEC
APRENOL
N-ACETYLGLUCOSAMINE
TRANSFERASE

(Pseudomonas
aeruginosa) 		PF03033
(Glyco_transf_28)
PF04101
(Glyco_tran_28_C) 		4 VAL A 119
ARG A 140
LEU A 156
THR A 158
 None
 0.88A 5e4dA-3s2uA:
undetectable
5e4dB-3s2uA:
undetectable		 5e4dA-3s2uA:
19.20
5e4dB-3s2uA:
19.20
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.
3tlm SARCOPLASMIC/ENDOPLA
SMIC RETICULUM
CALCIUM ATPASE 1

(Bos taurus) 		PF00122
(E1-E2_ATPase)
PF00689
(Cation_ATPase_C)
PF00690
(Cation_ATPase_N)
PF08282
(Hydrolase_3)
PF13246
(Cation_ATPase) 		4 VAL A 794
THR A 798
VAL A 843
THR A 847
 None
CA  A1004 (-3.8A)
None
None
 0.87A 5e4dA-3tlmA:
undetectable
5e4dB-3tlmA:
undetectable		 5e4dA-3tlmA:
12.22
5e4dB-3tlmA:
12.22
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.
3tlm SARCOPLASMIC/ENDOPLA
SMIC RETICULUM
CALCIUM ATPASE 1

(Bos taurus) 		PF00122
(E1-E2_ATPase)
PF00689
(Cation_ATPase_C)
PF00690
(Cation_ATPase_N)
PF08282
(Hydrolase_3)
PF13246
(Cation_ATPase) 		4 VAL A 843
THR A 847
VAL A 794
THR A 798
 None
None
None
CA  A1004 (-3.8A)
 0.87A 5e4dA-3tlmA:
undetectable
5e4dB-3tlmA:
undetectable		 5e4dA-3tlmA:
12.22
5e4dB-3tlmA:
12.22
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.
3uai H/ACA
RIBONUCLEOPROTEIN
COMPLEX SUBUNIT 4

(Saccharomyces
cerevisiae) 		PF01472
(PUA)
PF01509
(TruB_N)
PF08068
(DKCLD)
PF16198
(TruB_C_2) 		4 ARG A 162
MET A 205
VAL A 201
THR A 198
 None
 0.96A 5e4dA-3uaiA:
undetectable
5e4dB-3uaiA:
undetectable		 5e4dA-3uaiA:
20.65
5e4dB-3uaiA:
20.65
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.
3uai H/ACA
RIBONUCLEOPROTEIN
COMPLEX SUBUNIT 4
H/ACA
RIBONUCLEOPROTEIN
COMPLEX SUBUNIT 1

(Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae) 		PF01472
(PUA)
PF01509
(TruB_N)
PF08068
(DKCLD)
PF16198
(TruB_C_2)
PF04410
(Gar1) 		4 THR C  91
MET A 205
VAL A 201
THR A 198
 None
 1.01A 5e4dA-3uaiC:
undetectable
5e4dB-3uaiC:
undetectable		 5e4dA-3uaiC:
20.40
5e4dB-3uaiC:
20.40
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.
3uaj ENVELOPE PROTEIN

(Dengue virus) 		no annotation 4 VAL B 270
THR B 205
LEU B 135
VAL B  53
 None
 0.90A 5e4dA-3uajB:
undetectable
5e4dB-3uajB:
undetectable		 5e4dA-3uajB:
20.05
5e4dB-3uajB:
20.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3vsk PENICILLIN-BINDING
PROTEIN 3

(Staphylococcus
aureus) 		PF00905
(Transpeptidase)
PF03717
(PBP_dimer) 		4 VAL A 390
THR A 635
LEU A 491
VAL A 537
 None
 0.94A 5e4dA-3vskA:
undetectable
5e4dB-3vskA:
undetectable		 5e4dA-3vskA:
14.66
5e4dB-3vskA:
14.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3vuq TRANSCRIPTIONAL
REGULATOR (TETR/ACRR
FAMILY)

(Thermus
thermophilus) 		PF00440
(TetR_N) 		4 ARG A 147
LEU A 150
VAL A 158
THR A 155
 None
 1.01A 5e4dA-3vuqA:
undetectable
5e4dB-3vuqA:
undetectable		 5e4dA-3vuqA:
18.52
5e4dB-3vuqA:
18.52
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.
3wqy ALANINE--TRNA LIGASE

(Archaeoglobus
fulgidus) 		PF01411
(tRNA-synt_2c)
PF02272
(DHHA1)
PF07973
(tRNA_SAD) 		4 VAL A 848
THR A 850
LEU A 888
VAL A 896
 None
 0.99A 5e4dA-3wqyA:
undetectable
5e4dB-3wqyA:
undetectable		 5e4dA-3wqyA:
11.73
5e4dB-3wqyA:
11.73
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.
4avx HEPATOCYTE GROWTH
FACTOR-REGULATED
TYROSINE KINASE
SUBSTRATE

(Homo sapiens) 		PF00790
(VHS)
PF01363
(FYVE) 		4 VAL A  53
LEU A  92
VAL A  83
THR A  88
 EDO  A1230 ( 4.8A)
EDO  A1230 ( 4.7A)
None
EDO  A1230 ( 4.0A)
 0.93A 5e4dA-4avxA:
undetectable
5e4dB-4avxA:
undetectable		 5e4dA-4avxA:
18.78
5e4dB-4avxA:
18.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4c7p RALF

(Legionella
pneumophila) 		PF01369
(Sec7) 		4 VAL A 233
LEU A 264
VAL A 245
THR A 243
 None
 1.00A 5e4dA-4c7pA:
2.4
5e4dB-4c7pA:
2.5		 5e4dA-4c7pA:
22.08
5e4dB-4c7pA:
22.08
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.
4cvy DIOXYGENASE
RV3406/MT3514

(Mycobacterium
tuberculosis) 		PF02668
(TauD) 		4 VAL A 220
LEU A 143
VAL A 185
THR A 144
 None
 0.94A 5e4dA-4cvyA:
undetectable
5e4dB-4cvyA:
undetectable		 5e4dA-4cvyA:
21.53
5e4dB-4cvyA:
21.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4e6u ACYL-[ACYL-CARRIER-P
ROTEIN]--UDP-N-ACETY
LGLUCOSAMINE
O-ACYLTRANSFERASE

(Acinetobacter
baumannii) 		PF00132
(Hexapep)
PF13720
(Acetyltransf_11) 		4 VAL A 128
LEU A 116
VAL A 138
THR A 120
 None
 1.03A 5e4dA-4e6uA:
undetectable
5e4dB-4e6uA:
undetectable		 5e4dA-4e6uA:
21.99
5e4dB-4e6uA:
21.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fgw GLYCEROL-3-PHOSPHATE
DEHYDROGENASE
[NAD(+)] 1

(Saccharomyces
cerevisiae) 		PF01210
(NAD_Gly3P_dh_N)
PF07479
(NAD_Gly3P_dh_C) 		4 VAL A 198
THR A 196
LEU A 221
VAL A  52
 None
 0.96A 5e4dA-4fgwA:
undetectable
5e4dB-4fgwA:
undetectable		 5e4dA-4fgwA:
19.27
5e4dB-4fgwA:
19.27
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.
4fo1 LINCOSAMIDE
RESISTANCE PROTEIN

(Staphylococcus
haemolyticus) 		PF10706
(Aminoglyc_resit) 		4 VAL A  59
THR A  56
LEU A  89
MET A  75
 None
 0.94A 5e4dA-4fo1A:
undetectable
5e4dB-4fo1A:
undetectable		 5e4dA-4fo1A:
20.29
5e4dB-4fo1A:
20.29
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.
4gu7 PUTATIVE
UNCHARACTERIZED
PROTEIN SCO7193

(Streptomyces
coelicolor) 		PF04261
(Dyp_perox) 		4 VAL A  63
THR A 303
ARG A 108
VAL A 166
 None
 0.91A 5e4dA-4gu7A:
1.4
5e4dB-4gu7A:
1.5		 5e4dA-4gu7A:
22.67
5e4dB-4gu7A:
22.67
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.
4iiw LMO1499 PROTEIN

(Listeria
monocytogenes) 		PF02618
(YceG) 		4 VAL A 226
ARG A 216
VAL A 205
THR A 208
 None
 1.03A 5e4dA-4iiwA:
undetectable
5e4dB-4iiwA:
undetectable		 5e4dA-4iiwA:
22.13
5e4dB-4iiwA:
22.13
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.
4j2q S-ARRESTIN

(Bos taurus) 		PF00339
(Arrestin_N)
PF02752
(Arrestin_C) 		4 VAL A 325
THR A 310
LEU A 132
VAL A 145
 None
 1.00A 5e4dA-4j2qA:
undetectable
5e4dB-4j2qA:
undetectable		 5e4dA-4j2qA:
20.58
5e4dB-4j2qA:
20.58
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.
4j72 PHOSPHO-N-ACETYLMURA
MOYL-PENTAPEPTIDE-TR
ANSFERASE

(Aquifex
aeolicus) 		PF00953
(Glycos_transf_4)
PF10555
(MraY_sig1) 		4 VAL A 189
THR A 192
LEU A 275
THR A 206
 None
 0.99A 5e4dA-4j72A:
undetectable
5e4dB-4j72A:
undetectable		 5e4dA-4j72A:
20.44
5e4dB-4j72A:
20.44
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.
4js5 EXODEOXYRIBONUCLEASE
I

(Escherichia
coli) 		PF00929
(RNase_T)
PF08411
(Exonuc_X-T_C) 		5 THR A 314
ARG A 322
LEU A 323
VAL A 232
THR A 243
 None
 1.25A 5e4dA-4js5A:
undetectable
5e4dB-4js5A:
undetectable		 5e4dA-4js5A:
17.87
5e4dB-4js5A:
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.
4pet EXTRACELLULAR
SOLUTE-BINDING
PROTEIN, FAMILY 7

(Colwellia
psychrerythraea) 		PF03480
(DctP) 		4 VAL A 250
LEU A 258
MET A  56
VAL A  60
 None
 1.00A 5e4dA-4petA:
undetectable
5e4dB-4petA:
undetectable		 5e4dA-4petA:
21.97
5e4dB-4petA:
21.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4r5z PUTATIVE
PHENYLALANINE
AMINOTRANSFERASE

(Mycobacterium
tuberculosis) 		PF00155
(Aminotran_1_2) 		4 VAL A 210
LEU A 149
VAL A  95
THR A  96
 None
 0.84A 5e4dA-4r5zA:
undetectable
5e4dB-4r5zA:
undetectable		 5e4dA-4r5zA:
19.28
5e4dB-4r5zA:
19.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yzo PUTATIVE ACYL-COA
ACYLTRANSFERASE

(Sulfurisphaera
tokodaii) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		4 VAL A  38
LEU A  31
VAL A  23
THR A  27
 None
 1.01A 5e4dA-4yzoA:
undetectable
5e4dB-4yzoA:
undetectable		 5e4dA-4yzoA:
18.44
5e4dB-4yzoA:
18.44
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.
4yzo PUTATIVE ACYL-COA
ACYLTRANSFERASE

(Sulfurisphaera
tokodaii) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		4 VAL A  40
LEU A  62
VAL A  26
THR A  27
 None
 1.02A 5e4dA-4yzoA:
undetectable
5e4dB-4yzoA:
undetectable		 5e4dA-4yzoA:
18.44
5e4dB-4yzoA:
18.44
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.
4z7f FOLATE ECF
TRANSPORTER

(Enterococcus
faecalis) 		PF12822
(ECF_trnsprt) 		4 VAL A 112
THR A 113
VAL A 154
THR A 157
 None
 1.05A 5e4dA-4z7fA:
undetectable
5e4dB-4z7fA:
undetectable		 5e4dA-4z7fA:
23.11
5e4dB-4z7fA:
23.11
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.
4z7f FOLATE ECF
TRANSPORTER

(Enterococcus
faecalis) 		PF12822
(ECF_trnsprt) 		4 VAL A 154
THR A 157
VAL A 112
THR A 113
 None
 1.03A 5e4dA-4z7fA:
undetectable
5e4dB-4z7fA:
undetectable		 5e4dA-4z7fA:
23.11
5e4dB-4z7fA:
23.11
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.
4zwj CHIMERA PROTEIN OF
HUMAN RHODOPSIN,
MOUSE S-ARRESTIN,
AND T4 ENDOLYSIN

(Homo sapiens;
Mus musculus;
Escherichia
virus T4) 		PF00001
(7tm_1)
PF00339
(Arrestin_N)
PF00959
(Phage_lysozyme)
PF02752
(Arrestin_C)
PF10413
(Rhodopsin_N) 		4 VAL A2326
THR A2311
LEU A2133
VAL A2146
 None
 0.97A 5e4dA-4zwjA:
undetectable
5e4dB-4zwjA:
undetectable		 5e4dA-4zwjA:
13.24
5e4dB-4zwjA:
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.
5cdh MAJOR ACID
PHOSPHATASE

(Legionella
pneumophila) 		PF00328
(His_Phos_2) 		4 VAL A 203
THR A 206
VAL A  46
THR A  45
 None
 1.04A 5e4dA-5cdhA:
undetectable
5e4dB-5cdhA:
undetectable		 5e4dA-5cdhA:
20.43
5e4dB-5cdhA:
20.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5cm6 TRAP DICARBOXYLATE
TRANSPORTER-DCTP
SUBUNIT

(Pseudoalteromonas
atlantica) 		PF03480
(DctP) 		4 VAL A 244
LEU A 252
MET A  50
VAL A  54
 None
 0.93A 5e4dA-5cm6A:
undetectable
5e4dB-5cm6A:
undetectable		 5e4dA-5cm6A:
21.65
5e4dB-5cm6A:
21.65
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5e4m HYDROXYNITRILE LYASE

(Davallia
tyermannii) 		no annotation 4 LEU A  17
MET A 100
VAL A 118
THR A 141
 None
 0.23A 5e4dA-5e4mA:
31.8
5e4dB-5e4mA:
31.2		 5e4dA-5e4mA:
100.00
5e4dB-5e4mA:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5epa SNOK

(Streptomyces
nogalater) 		PF05721
(PhyH) 		4 VAL A  27
LEU A  13
VAL A  32
THR A   8
 None
 0.90A 5e4dA-5epaA:
undetectable
5e4dB-5epaA:
undetectable		 5e4dA-5epaA:
23.24
5e4dB-5epaA:
23.24
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.
5irr SEPTIN-LIKE PROTEIN

(Chlamydomonas
reinhardtii) 		PF00735
(Septin) 		4 VAL A 322
THR A 262
LEU A 130
VAL A 115
 None
 1.03A 5e4dA-5irrA:
undetectable
5e4dB-5irrA:
undetectable		 5e4dA-5irrA:
20.38
5e4dB-5irrA:
20.38
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.
5j4a IMMUNITY PROTEIN
CDII

(Burkholderia
pseudomallei) 		no annotation 4 VAL B  42
THR B  56
VAL B  71
THR B  70
 None
 1.02A 5e4dA-5j4aB:
undetectable
5e4dB-5j4aB:
undetectable		 5e4dA-5j4aB:
20.00
5e4dB-5j4aB:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5j4a IMMUNITY PROTEIN
CDII

(Burkholderia
pseudomallei) 		no annotation 4 VAL B  71
THR B  70
VAL B  42
THR B  56
 None
 1.00A 5e4dA-5j4aB:
undetectable
5e4dB-5j4aB:
undetectable		 5e4dA-5j4aB:
20.00
5e4dB-5j4aB:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jfm ALDEHYDE
DEHYDROGENASE

(Rhodopseudomonas
palustris) 		PF00171
(Aldedh) 		4 THR A 197
MET A 146
VAL A 383
THR A 380
 1VU  A 601 ( 4.8A)
1VU  A 601 ( 4.1A)
1VU  A 601 ( 4.7A)
1VU  A 601 (-3.8A)
 1.02A 5e4dA-5jfmA:
undetectable
5e4dB-5jfmA:
undetectable		 5e4dA-5jfmA:
15.91
5e4dB-5jfmA:
15.91
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.
5n8p S-LAYER PROTEIN

(Caulobacter
vibrioides) 		PF00353
(HemolysinCabind) 		4 VAL A 335
THR A 331
LEU A 296
VAL A 321
 None
 0.82A 5e4dA-5n8pA:
undetectable
5e4dB-5n8pA:
undetectable		 5e4dA-5n8pA:
11.66
5e4dB-5n8pA:
11.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5n97 S-LAYER PROTEIN RSAA

(Caulobacter
vibrioides) 		PF00353
(HemolysinCabind) 		4 VAL A 335
THR A 331
LEU A 296
VAL A 321
 None
 0.82A 5e4dA-5n97A:
undetectable
5e4dB-5n97A:
undetectable		 5e4dA-5n97A:
14.15
5e4dB-5n97A:
14.15
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.
5nn8 LYSOSOMAL
ALPHA-GLUCOSIDASE

(Homo sapiens) 		no annotation 4 VAL A 310
LEU A 248
VAL A 220
THR A 234
 None
 1.00A 5e4dA-5nn8A:
undetectable
5e4dB-5nn8A:
undetectable		 5e4dA-5nn8A:
13.48
5e4dB-5nn8A:
13.48
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.
5nug CYTOPLASMIC DYNEIN 1
HEAVY CHAIN 1

(Homo sapiens) 		PF03028
(Dynein_heavy)
PF07728
(AAA_5)
PF08393
(DHC_N2)
PF12774
(AAA_6)
PF12775
(AAA_7)
PF12777
(MT)
PF12780
(AAA_8)
PF12781
(AAA_9) 		4 VAL A4642
LEU A4585
VAL A4543
THR A4588
 None
 1.02A 5e4dA-5nugA:
undetectable
5e4dB-5nugA:
undetectable		 5e4dA-5nugA:
3.68
5e4dB-5nugA:
3.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ovu BETA-PROTEOBACTERIA
PROTEASOME HOMOLOGUE

(Cupriavidus
metallidurans) 		no annotation 4 VAL A  76
THR A  79
MET A  64
VAL A  40
 None
 1.04A 5e4dA-5ovuA:
undetectable
5e4dB-5ovuA:
undetectable		 5e4dA-5ovuA:
undetectable
5e4dB-5ovuA:
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.
5vod FAB 9I6 HEAVY CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		4 VAL H 136
LEU H 105
MET H  67
VAL H  87
 None
 1.02A 5e4dA-5vodH:
undetectable
5e4dB-5vodH:
undetectable		 5e4dA-5vodH:
20.89
5e4dB-5vodH:
20.89
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.
5xgs RCC1-LIKE G
EXCHANGING
FACTOR-LIKE PROTEIN

(Homo sapiens) 		PF00415
(RCC1)
PF13540
(RCC1_2) 		4 VAL A 449
THR A 458
MET A 442
VAL A 440
 None
 0.86A 5e4dA-5xgsA:
undetectable
5e4dB-5xgsA:
undetectable		 5e4dA-5xgsA:
18.29
5e4dB-5xgsA:
18.29
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.
6exs PEPTIDE ABC
TRANSPORTER PERMEASE

(Staphylococcus
hominis) 		no annotation 4 THR A 263
LEU A 255
VAL A 245
THR A 249
 None
OLC  A 513 (-4.2A)
None
None
 0.92A 5e4dA-6exsA:
undetectable
5e4dB-6exsA:
undetectable		 5e4dA-6exsA:
undetectable
5e4dB-6exsA:
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.
6fcx METHYLENETETRAHYDROF
OLATE REDUCTASE

(Homo sapiens) 		no annotation 4 VAL A 636
THR A 639
LEU A 513
VAL A 619
 None
 1.02A 5e4dA-6fcxA:
undetectable
5e4dB-6fcxA:
undetectable		 5e4dA-6fcxA:
undetectable
5e4dB-6fcxA:
undetectable