SIMILAR PATTERNS OF AMINO ACIDS FOR 6CDU_A_EY4A502_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.
1aq0 1,3-1,4-BETA-GLUCANA
SE

(Hordeum vulgare) 		PF00332
(Glyco_hydro_17) 		4 ALA A 217
THR A 216
TYR A 215
GLN A 129
 None
 0.51A 6cduA-1aq0A:
0.0
6cduE-1aq0A:
undetectable		 6cduA-1aq0A:
22.25
6cduE-1aq0A:
22.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1awb MYO-INOSITOL
MONOPHOSPHATASE

(Homo sapiens) 		PF00459
(Inositol_P) 		4 ALA A 133
THR A 132
TYR A 131
GLN A 147
 None
 0.89A 6cduA-1awbA:
0.0
6cduE-1awbA:
0.0		 6cduA-1awbA:
22.71
6cduE-1awbA:
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.
1b8h DNA POLYMERASE
PROCESSIVITY
COMPONENT

(Escherichia
virus RB69) 		PF02916
(DNA_PPF)
PF09116
(gp45-slide_C) 		4 ALA A  40
THR A  31
GLN A 213
VAL A 214
 None
 0.93A 6cduA-1b8hA:
undetectable
6cduE-1b8hA:
undetectable		 6cduA-1b8hA:
21.39
6cduE-1b8hA:
21.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ekb ENTEROPEPTIDASE

(Bos taurus) 		PF00089
(Trypsin) 		4 ALA B 221
TYR B 184
GLN B 156
VAL B  17
 None
 0.97A 6cduA-1ekbB:
undetectable
6cduE-1ekbB:
0.0		 6cduA-1ekbB:
19.24
6cduE-1ekbB:
19.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1jsm HAEMAGGLUTININ (HA2
CHAIN)

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		4 ALA B  96
THR B  93
TYR B  94
VAL B 100
 None
 0.94A 6cduA-1jsmB:
2.4
6cduE-1jsmB:
2.4		 6cduA-1jsmB:
20.07
6cduE-1jsmB:
20.07
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.
1o94 TRIMETHYLAMINE
DEHYDROGENASE

(Methylophilus
methylotrophus) 		PF00724
(Oxidored_FMN)
PF07992
(Pyr_redox_2) 		4 ALA A 155
TYR A 151
VAL A 166
PRO A  28
 None
None
None
FMN  A1730 (-4.8A)
 0.92A 6cduA-1o94A:
0.0
6cduE-1o94A:
0.0		 6cduA-1o94A:
17.78
6cduE-1o94A:
17.78
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.
1ofe FERREDOXIN-DEPENDENT
GLUTAMATE SYNTHASE 2

(Synechocystis
sp. PCC 6803) 		PF00310
(GATase_2)
PF01493
(GXGXG)
PF01645
(Glu_synthase)
PF04898
(Glu_syn_central) 		4 ALA A 454
THR A 453
TYR A 452
PRO A 471
 None
 0.93A 6cduA-1ofeA:
0.0
6cduE-1ofeA:
0.0		 6cduA-1ofeA:
11.64
6cduE-1ofeA:
11.64
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.
1omo ALANINE
DEHYDROGENASE

(Archaeoglobus
fulgidus) 		PF02423
(OCD_Mu_crystall) 		4 ALA A 101
THR A 102
TYR A 103
GLN A 296
 ALA  A 101 ( 0.0A)
THR  A 102 ( 0.8A)
TYR  A 103 ( 1.3A)
GLN  A 296 ( 0.6A)
 0.68A 6cduA-1omoA:
0.0
6cduE-1omoA:
0.0		 6cduA-1omoA:
22.70
6cduE-1omoA:
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.
1v2x TRNA (GM18)
METHYLTRANSFERASE

(Thermus
thermophilus) 		PF00588
(SpoU_methylase)
PF12105
(SpoU_methylas_C) 		4 ALA A  51
TYR A  75
GLN A  20
VAL A  48
 None
 0.90A 6cduA-1v2xA:
undetectable
6cduE-1v2xA:
undetectable		 6cduA-1v2xA:
19.08
6cduE-1v2xA:
19.08
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.
1vbf 231AA LONG
HYPOTHETICAL
PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Sulfurisphaera
tokodaii) 		PF01135
(PCMT) 		4 ALA A  86
THR A  85
TYR A  84
PRO A  30
 None
 0.86A 6cduA-1vbfA:
undetectable
6cduE-1vbfA:
undetectable		 6cduA-1vbfA:
21.47
6cduE-1vbfA:
21.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ven BETA-AMYLASE

(Bacillus cereus) 		PF00686
(CBM_20)
PF01373
(Glyco_hydro_14) 		4 ALA A 148
THR A 147
TYR A 146
PRO A 104
 None
 0.96A 6cduA-1venA:
undetectable
6cduE-1venA:
undetectable		 6cduA-1venA:
20.46
6cduE-1venA:
20.46
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.
1w8o BACTERIAL SIALIDASE

(Micromonospora
viridifaciens) 		PF00754
(F5_F8_type_C)
PF10633
(NPCBM_assoc)
PF13088
(BNR_2) 		4 ALA A 175
THR A 176
GLN A 115
VAL A 117
 None
 0.89A 6cduA-1w8oA:
3.2
6cduE-1w8oA:
undetectable		 6cduA-1w8oA:
21.89
6cduE-1w8oA:
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.
1yzv HYPOTHETICAL PROTEIN

(Trypanosoma
cruzi) 		PF00857
(Isochorismatase) 		4 ALA A 133
THR A 164
GLN A 104
VAL A 106
 None
 0.92A 6cduA-1yzvA:
undetectable
6cduE-1yzvA:
undetectable		 6cduA-1yzvA:
21.36
6cduE-1yzvA:
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.
1zq1 GLUTAMYL-TRNA(GLN)
AMIDOTRANSFERASE
SUBUNIT D

(Pyrococcus
abyssi) 		PF00710
(Asparaginase) 		4 ALA A 185
THR A 184
TYR A 183
VAL A 254
 None
 0.78A 6cduA-1zq1A:
undetectable
6cduE-1zq1A:
undetectable		 6cduA-1zq1A:
22.05
6cduE-1zq1A:
22.05
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.
2bas YKUI PROTEIN

(Bacillus
subtilis) 		PF00563
(EAL)
PF10388
(YkuI_C) 		4 ALA A 302
THR A 306
GLN A 336
VAL A 326
 None
 0.96A 6cduA-2basA:
undetectable
6cduE-2basA:
undetectable		 6cduA-2basA:
21.62
6cduE-2basA:
21.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2cde INKT-TCR

(Homo sapiens) 		PF07686
(V-set)
PF09291
(DUF1968) 		4 ALA A  64
THR A  63
TYR A  62
PRO A   8
 None
 0.94A 6cduA-2cdeA:
undetectable
6cduE-2cdeA:
undetectable		 6cduA-2cdeA:
20.31
6cduE-2cdeA:
20.31
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.
2dtc RAL GUANINE
NUCLEOTIDE EXCHANGE
FACTOR RALGPS1A

(Mus musculus) 		PF00169
(PH) 		4 ALA A  34
THR A  35
VAL A  63
TRP A  65
 None
 0.89A 6cduA-2dtcA:
undetectable
6cduE-2dtcA:
undetectable		 6cduA-2dtcA:
17.24
6cduE-2dtcA:
17.24
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.
2g0b FEEM

(uncultured
bacterium) 		no annotation 5 ALA A 129
THR A 127
GLN A 183
VAL A 177
TRP A 180
 None
 1.42A 6cduA-2g0bA:
undetectable
6cduE-2g0bA:
undetectable		 6cduA-2g0bA:
20.61
6cduE-2g0bA:
20.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pyy IONOTROPIC GLUTAMATE
RECEPTOR BACTERIAL
HOMOLOGUE

(Nostoc
punctiforme) 		PF00497
(SBP_bac_3) 		4 ALA A 122
THR A 123
TYR A 124
VAL A 132
 None
 0.94A 6cduA-2pyyA:
undetectable
6cduE-2pyyA:
undetectable		 6cduA-2pyyA:
22.48
6cduE-2pyyA:
22.48
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.
2q9g CYTOCHROME P450 46A1

(Homo sapiens) 		PF00067
(p450) 		4 ALA A 188
THR A 187
TYR A 186
PRO A 478
 None
None
GOL  A 601 ( 4.5A)
None
 0.70A 6cduA-2q9gA:
undetectable
6cduE-2q9gA:
undetectable		 6cduA-2q9gA:
23.11
6cduE-2q9gA:
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.
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium etli) 		PF00289
(Biotin_carb_N)
PF00364
(Biotin_lipoyl)
PF00682
(HMGL-like)
PF02436
(PYC_OADA)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		4 ALA A 481
THR A 478
TYR A 479
VAL A 485
 None
 0.95A 6cduA-2qf7A:
undetectable
6cduE-2qf7A:
undetectable		 6cduA-2qf7A:
13.75
6cduE-2qf7A:
13.75
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.
2rez MULTIFUNCTIONAL
CYCLASE-DEHYDRATASE-
3-O-METHYL
TRANSFERASE TCMN

(Streptomyces
glaucescens) 		PF03364
(Polyketide_cyc) 		5 THR A  77
TYR A  97
GLN A 110
VAL A 109
TRP A  95
 None
 1.34A 6cduA-2rezA:
undetectable
6cduE-2rezA:
undetectable		 6cduA-2rezA:
19.75
6cduE-2rezA:
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.
2rjb UNCHARACTERIZED
PROTEIN

(Shigella
flexneri) 		PF07063
(DUF1338) 		4 ALA A 203
THR A 200
TYR A 201
PRO A 105
 None
 0.94A 6cduA-2rjbA:
undetectable
6cduE-2rjbA:
undetectable		 6cduA-2rjbA:
21.55
6cduE-2rjbA:
21.55
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.
2v55 RHO-ASSOCIATED
PROTEIN KINASE 1

(Homo sapiens) 		PF00069
(Pkinase) 		4 ALA A 180
THR A 179
TYR A 178
GLN A 342
 None
 0.72A 6cduA-2v55A:
undetectable
6cduE-2v55A:
undetectable		 6cduA-2v55A:
20.82
6cduE-2v55A:
20.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vn7 GLUCOAMYLASE

(Trichoderma
reesei) 		PF00686
(CBM_20)
PF00723
(Glyco_hydro_15) 		4 ALA A 380
TYR A 384
GLN A 356
VAL A 359
 None
 0.96A 6cduA-2vn7A:
undetectable
6cduE-2vn7A:
2.0		 6cduA-2vn7A:
20.17
6cduE-2vn7A:
20.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wbe BIPOLAR KINESIN
KRP-130

(Drosophila
melanogaster) 		PF00225
(Kinesin) 		4 ALA C 319
THR C 320
GLN C   9
VAL C  10
 None
 0.92A 6cduA-2wbeC:
undetectable
6cduE-2wbeC:
undetectable		 6cduA-2wbeC:
21.66
6cduE-2wbeC:
21.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wvg PYRUVATE
DECARBOXYLASE

(Zymomonas
mobilis) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		4 ALA A  10
THR A   7
TYR A   8
VAL A  14
 None
 0.88A 6cduA-2wvgA:
undetectable
6cduE-2wvgA:
undetectable		 6cduA-2wvgA:
18.36
6cduE-2wvgA:
18.36
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.
2wvw RBCX PROTEIN

(Anabaena sp. CA
= ATCC 33047) 		PF02341
(RcbX) 		4 ALA I  22
THR I  19
TYR I  20
VAL I  26
 None
 0.97A 6cduA-2wvwI:
undetectable
6cduE-2wvwI:
undetectable		 6cduA-2wvwI:
18.38
6cduE-2wvwI:
18.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ww9 SEC SIXTY-ONE
PROTEIN HOMOLOG

(Saccharomyces
cerevisiae) 		PF00344
(SecY)
PF10559
(Plug_translocon) 		4 ALA A 372
THR A 369
TYR A 370
VAL A 376
 None
 0.97A 6cduA-2ww9A:
1.8
6cduE-2ww9A:
1.7		 6cduA-2ww9A:
20.85
6cduE-2ww9A:
20.85
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.
2y2w ARABINOFURANOSIDASE

(Bifidobacterium
longum) 		PF06964
(Alpha-L-AF_C) 		4 ALA A 382
THR A 381
TYR A 380
VAL A 386
 None
 0.85A 6cduA-2y2wA:
undetectable
6cduE-2y2wA:
undetectable		 6cduA-2y2wA:
19.38
6cduE-2y2wA:
19.38
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.
2zc4 PENICILLIN-BINDING
PROTEIN 2X

(Streptococcus
pneumoniae) 		PF03793
(PASTA) 		4 ALA C 707
THR C 706
GLN C 728
VAL C 727
 None
 0.93A 6cduA-2zc4C:
undetectable
6cduE-2zc4C:
undetectable		 6cduA-2zc4C:
17.85
6cduE-2zc4C:
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.
2zqp PREPROTEIN
TRANSLOCASE SECY
SUBUNIT

(Thermus
thermophilus) 		PF00344
(SecY) 		4 THR Y 323
TYR Y 324
VAL Y 329
PRO Y 333
 None
 0.93A 6cduA-2zqpY:
undetectable
6cduE-2zqpY:
undetectable		 6cduA-2zqpY:
19.30
6cduE-2zqpY:
19.30
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.
3ayf NITRIC OXIDE
REDUCTASE

(Geobacillus
stearothermophilus) 		PF00115
(COX1) 		4 ALA A 100
THR A  99
TYR A  98
GLN A 712
 None
 0.63A 6cduA-3ayfA:
5.2
6cduE-3ayfA:
5.2		 6cduA-3ayfA:
18.31
6cduE-3ayfA:
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.
3cq0 PUTATIVE
TRANSALDOLASE
YGR043C

(Saccharomyces
cerevisiae) 		PF00923
(TAL_FSA) 		4 ALA A 209
THR A 208
TYR A 207
VAL A 215
 None
 0.96A 6cduA-3cq0A:
undetectable
6cduE-3cq0A:
undetectable		 6cduA-3cq0A:
22.87
6cduE-3cq0A:
22.87
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.
3egw RESPIRATORY NITRATE
REDUCTASE 1 ALPHA
CHAIN

(Escherichia
coli) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF14710
(Nitr_red_alph_N) 		4 ALA A 894
THR A 895
TYR A 896
GLN A 942
 None
 0.85A 6cduA-3egwA:
undetectable
6cduE-3egwA:
undetectable		 6cduA-3egwA:
13.25
6cduE-3egwA:
13.25
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.
3fw6 CELLULASE

(uncultured
bacterium) 		PF12891
(Glyco_hydro_44) 		5 ALA A 409
THR A 407
GLN A 512
VAL A 541
PRO A 537
 None
 1.44A 6cduA-3fw6A:
undetectable
6cduE-3fw6A:
undetectable		 6cduA-3fw6A:
22.84
6cduE-3fw6A:
22.84
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.
3g5l PUTATIVE
S-ADENOSYLMETHIONINE
DEPENDENT
METHYLTRANSFERASE

(Listeria
monocytogenes) 		PF13649
(Methyltransf_25) 		4 ALA A 150
THR A 149
VAL A 169
TRP A 167
 None
 0.84A 6cduA-3g5lA:
undetectable
6cduE-3g5lA:
undetectable		 6cduA-3g5lA:
18.98
6cduE-3g5lA:
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.
3go7 RIBOKINASE RBSK

(Mycobacterium
tuberculosis) 		PF00294
(PfkB) 		4 ALA A 276
THR A 277
GLN A  56
VAL A 243
 None
 0.93A 6cduA-3go7A:
undetectable
6cduE-3go7A:
undetectable		 6cduA-3go7A:
21.45
6cduE-3go7A:
21.45
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.
3i1i HOMOSERINE
O-ACETYLTRANSFERASE

(Bacillus
anthracis) 		PF00561
(Abhydrolase_1) 		4 ALA A 281
THR A 280
TYR A 279
PRO A 213
 None
 0.71A 6cduA-3i1iA:
undetectable
6cduE-3i1iA:
undetectable		 6cduA-3i1iA:
22.60
6cduE-3i1iA:
22.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3l2k EHPF

(Pantoea
agglomerans) 		PF00501
(AMP-binding) 		4 ALA A 260
TYR A 262
GLN A 282
VAL A 283
 None
 0.94A 6cduA-3l2kA:
undetectable
6cduE-3l2kA:
undetectable		 6cduA-3l2kA:
23.25
6cduE-3l2kA:
23.25
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.
3mcs PUTATIVE
MONOOXYGENASE

(Fusobacterium
nucleatum) 		PF03992
(ABM) 		4 ALA A  25
THR A  26
TYR A  29
VAL A  82
 None
 0.71A 6cduA-3mcsA:
undetectable
6cduE-3mcsA:
undetectable		 6cduA-3mcsA:
21.45
6cduE-3mcsA:
21.45
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.
3ng0 GLUTAMINE SYNTHETASE

(Synechocystis
sp. PCC 6803) 		PF00120
(Gln-synt_C)
PF03951
(Gln-synt_N) 		4 ALA A  77
THR A  76
GLN A   6
VAL A   8
 None
 0.76A 6cduA-3ng0A:
undetectable
6cduE-3ng0A:
undetectable		 6cduA-3ng0A:
21.15
6cduE-3ng0A:
21.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3owa ACYL-COA
DEHYDROGENASE

(Bacillus
anthracis) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		4 ALA A 318
THR A 315
TYR A 316
VAL A 322
 None
 0.86A 6cduA-3owaA:
3.8
6cduE-3owaA:
3.6		 6cduA-3owaA:
20.07
6cduE-3owaA:
20.07
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.
3pco PHENYLALANYL-TRNA
SYNTHETASE, ALPHA
SUBUNIT
PHENYLALANYL-TRNA
SYNTHETASE, BETA
CHAIN

(Escherichia
coli;
Escherichia
coli) 		PF01409
(tRNA-synt_2d)
PF02912
(Phe_tRNA-synt_N)
PF01588
(tRNA_bind)
PF03147
(FDX-ACB)
PF03483
(B3_4)
PF03484
(B5) 		4 ALA B 554
THR B 555
TYR B 558
PRO A 204
 None
 0.87A 6cduA-3pcoB:
undetectable
6cduE-3pcoB:
undetectable		 6cduA-3pcoB:
18.99
6cduE-3pcoB:
18.99
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.
3q41 GLUTAMATE [NMDA]
RECEPTOR SUBUNIT
ZETA-1

(Rattus
norvegicus) 		PF01094
(ANF_receptor) 		4 ALA A 111
THR A 110
TYR A 109
VAL A 118
 None
 0.88A 6cduA-3q41A:
undetectable
6cduE-3q41A:
undetectable		 6cduA-3q41A:
20.71
6cduE-3q41A:
20.71
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.
3sql GLYCOSYL HYDROLASE
FAMILY 3

(Synechococcus
sp. PCC 7002) 		PF00933
(Glyco_hydro_3) 		4 ALA A 321
THR A 320
VAL A 295
PRO A 308
 None
 0.92A 6cduA-3sqlA:
undetectable
6cduE-3sqlA:
undetectable		 6cduA-3sqlA:
22.57
6cduE-3sqlA:
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.
3syb GLYCINE-GLUTAMATE
DIPEPTIDE PORIN OPDP

(Pseudomonas
aeruginosa) 		PF03573
(OprD) 		4 ALA A  80
GLN A  83
VAL A  82
TRP A  81
 None
C8E  A 472 ( 3.6A)
None
None
 0.94A 6cduA-3sybA:
undetectable
6cduE-3sybA:
undetectable		 6cduA-3sybA:
21.35
6cduE-3sybA:
21.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wuf ENDO-1,4-BETA-XYLANA
SE A

(Streptomyces
sp.) 		PF00331
(Glyco_hydro_10) 		4 ALA A 101
THR A 100
TYR A  99
PRO A 128
 None
ZN  A 402 (-3.8A)
None
None
 0.71A 6cduA-3wufA:
undetectable
6cduE-3wufA:
undetectable		 6cduA-3wufA:
25.00
6cduE-3wufA:
25.00
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.
4au2 SERPIN PEPTIDASE
INHIBITOR, CLADE H
(HEAT SHOCK PROTEIN
47), MEMBER 1,
(COLLAGEN BINDING
PROTEIN 1)

(Canis lupus) 		PF00079
(Serpin) 		4 ALA A 356
THR A 355
VAL A 310
PRO A 307
 None
 0.97A 6cduA-4au2A:
undetectable
6cduE-4au2A:
undetectable		 6cduA-4au2A:
19.44
6cduE-4au2A:
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.
4cj0 ENDOGLUCANASE D
E12 AFFITIN

(Ruminiclostridium
thermocellum;
synthetic
construct) 		PF00759
(Glyco_hydro_9)
PF02927
(CelD_N)
PF02294
(7kD_DNA_binding) 		4 ALA B  54
GLN B  35
VAL B  34
PRO A 539
 None
 0.84A 6cduA-4cj0B:
undetectable
6cduE-4cj0B:
undetectable		 6cduA-4cj0B:
13.27
6cduE-4cj0B:
13.27
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.
4cyv HEMAGGLUTININ

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		4 ALA B  96
THR B  93
TYR B  94
VAL B 100
 None
 0.92A 6cduA-4cyvB:
undetectable
6cduE-4cyvB:
2.0		 6cduA-4cyvB:
19.94
6cduE-4cyvB:
19.94
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.
4da1 PROTEIN PHOSPHATASE
1K, MITOCHONDRIAL

(Homo sapiens) 		PF00481
(PP2C) 		4 ALA A 341
THR A 340
GLN A 329
VAL A 326
 None
 0.97A 6cduA-4da1A:
undetectable
6cduE-4da1A:
undetectable		 6cduA-4da1A:
21.36
6cduE-4da1A:
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.
4gr6 ATRBCX2

(Arabidopsis
thaliana) 		PF02341
(RcbX) 		4 ALA A  27
THR A  24
TYR A  25
VAL A  31
 None
 0.95A 6cduA-4gr6A:
undetectable
6cduE-4gr6A:
undetectable		 6cduA-4gr6A:
18.30
6cduE-4gr6A:
18.30
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.
4gyb COPPER OXIDASE

(Streptomyces
lividans) 		PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 ALA A 213
THR A 214
GLN A 272
VAL A 219
 None
 0.96A 6cduA-4gybA:
undetectable
6cduE-4gybA:
undetectable		 6cduA-4gybA:
19.11
6cduE-4gybA:
19.11
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.
4h19 MANDELATE RACEMASE

(Agrobacterium
fabrum) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 ALA A 355
TYR A 129
VAL A 112
TRP A 115
 None
 0.81A 6cduA-4h19A:
undetectable
6cduE-4h19A:
undetectable		 6cduA-4h19A:
20.26
6cduE-4h19A:
20.26
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.
4izo PHOSPHORIBOSYLAMINOI
MIDAZOLE
CARBOXYLASE, ATPASE
SUBUNIT

(Burkholderia
thailandensis) 		PF02222
(ATP-grasp) 		4 ALA A 353
THR A 352
GLN A 346
VAL A 347
 None
 0.78A 6cduA-4izoA:
undetectable
6cduE-4izoA:
undetectable		 6cduA-4izoA:
21.35
6cduE-4izoA:
21.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jx6 PYRUVATE CARBOXYLASE

(Rhizobium etli) 		PF00682
(HMGL-like)
PF02436
(PYC_OADA) 		4 ALA A 481
THR A 478
TYR A 479
VAL A 485
 None
 0.94A 6cduA-4jx6A:
undetectable
6cduE-4jx6A:
undetectable		 6cduA-4jx6A:
18.56
6cduE-4jx6A:
18.56
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.
4kg7 PEPTIDASE S8 AND
S53, SUBTILISIN,
KEXIN, SEDOLISIN

(Mycolicibacterium
smegmatis) 		PF00082
(Peptidase_S8) 		4 ALA A 235
THR A 340
TYR A 342
PRO A 160
 None
 0.94A 6cduA-4kg7A:
undetectable
6cduE-4kg7A:
undetectable		 6cduA-4kg7A:
20.67
6cduE-4kg7A:
20.67
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.
4lg3 UNCHARACTERIZED
PROTEIN

(Desulfovibrio
piger) 		PF16175
(DUF4875) 		4 ALA A 124
THR A 125
TYR A 126
VAL A  88
 None
None
SO4  A 301 (-4.5A)
None
 0.92A 6cduA-4lg3A:
undetectable
6cduE-4lg3A:
undetectable		 6cduA-4lg3A:
22.71
6cduE-4lg3A:
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.
4m1r CELLULASE 5

(soil metagenome) 		PF00150
(Cellulase) 		4 ALA A 146
THR A 147
VAL A 164
PRO A 215
 None
 0.83A 6cduA-4m1rA:
undetectable
6cduE-4m1rA:
undetectable		 6cduA-4m1rA:
21.84
6cduE-4m1rA:
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.
4nes UDP-N-ACETYLGLUCOSAM
INE 2-EPIMERASE

(Methanocaldococcus
jannaschii) 		PF02350
(Epimerase_2) 		4 ALA A 101
THR A  98
VAL A 105
PRO A  87
 None
 0.87A 6cduA-4nesA:
undetectable
6cduE-4nesA:
undetectable		 6cduA-4nesA:
21.65
6cduE-4nesA:
21.65
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.
4pz0 SUGAR ABC
TRANSPORTER,
SUGAR-BINDING
PROTEIN

(Bacillus
anthracis) 		PF13407
(Peripla_BP_4) 		4 ALA A 285
THR A 282
TYR A 283
VAL A 289
 None
 0.86A 6cduA-4pz0A:
undetectable
6cduE-4pz0A:
undetectable		 6cduA-4pz0A:
22.86
6cduE-4pz0A:
22.86
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.
4q1j POLYKETIDE
BIOSYNTHESIS
ENOYL-COA ISOMERASE
PKSI

(Bacillus
subtilis) 		PF00378
(ECH_1) 		4 ALA A 129
THR A 128
TYR A 127
VAL A 111
 None
 0.91A 6cduA-4q1jA:
undetectable
6cduE-4q1jA:
undetectable		 6cduA-4q1jA:
21.16
6cduE-4q1jA:
21.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rma EZRIN

(Homo sapiens) 		PF00373
(FERM_M)
PF09379
(FERM_N)
PF09380
(FERM_C) 		4 ALA A 122
THR A 121
GLN A 160
VAL A 157
 None
 0.94A 6cduA-4rmaA:
undetectable
6cduE-4rmaA:
undetectable		 6cduA-4rmaA:
17.54
6cduE-4rmaA:
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.
4v23 MATRIX PROTEIN

(Respiratory
syncytial virus) 		PF03393
(Pneumo_matrix) 		4 ALA A  16
THR A  15
GLN A  19
VAL A  18
 None
 0.92A 6cduA-4v23A:
undetectable
6cduE-4v23A:
undetectable		 6cduA-4v23A:
20.61
6cduE-4v23A:
20.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4w8i PROBABLE
SPHINGOSINE-1-PHOSPH
ATE LYASE

(Legionella
pneumophila) 		PF00282
(Pyridoxal_deC) 		4 ALA A 413
THR A 414
TYR A 417
VAL A 174
 None
 0.86A 6cduA-4w8iA:
undetectable
6cduE-4w8iA:
undetectable		 6cduA-4w8iA:
17.24
6cduE-4w8iA:
17.24
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.
4xg0 UNCHARACTERIZED
PROTEIN

(Bordetella
bronchiseptica) 		PF07005
(DUF1537)
PF17042
(DUF1357_C) 		4 ALA A 119
THR A 126
GLN A 199
VAL A 198
 None
 0.93A 6cduA-4xg0A:
undetectable
6cduE-4xg0A:
undetectable		 6cduA-4xg0A:
19.09
6cduE-4xg0A:
19.09
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.
4y4r BIFUNCTIONAL
LYSINE-SPECIFIC
DEMETHYLASE AND
HISTIDYL-HYDROXYLASE
NO66

(Homo sapiens) 		PF08007
(Cupin_4) 		4 ALA A 611
THR A 612
TYR A 615
VAL A 596
 None
 0.94A 6cduA-4y4rA:
undetectable
6cduE-4y4rA:
undetectable		 6cduA-4y4rA:
21.37
6cduE-4y4rA:
21.37
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.
4yvd PLEIOTROPIC
REGULATOR 1

(Homo sapiens) 		PF00400
(WD40) 		4 ALA A 312
THR A 311
VAL A 304
TRP A 315
 None
 0.94A 6cduA-4yvdA:
undetectable
6cduE-4yvdA:
undetectable		 6cduA-4yvdA:
22.41
6cduE-4yvdA:
22.41
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.
4z02 BROMODOMAIN-CONTAINI
NG PROTEIN 1

(Homo sapiens) 		PF00855
(PWWP) 		4 ALA A 935
TYR A 943
VAL A 989
PRO A 965
 None
4K8  A1101 (-3.7A)
None
None
 0.91A 6cduA-4z02A:
undetectable
6cduE-4z02A:
undetectable		 6cduA-4z02A:
15.81
6cduE-4z02A:
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.
5abm RETINAL
DEHYDROGENASE 1

(Ovis aries) 		PF00171
(Aldedh) 		4 ALA A 228
THR A 227
TYR A 224
VAL A 221
 None
 0.97A 6cduA-5abmA:
undetectable
6cduE-5abmA:
undetectable		 6cduA-5abmA:
20.80
6cduE-5abmA:
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.
5b3j NMDA GLUTAMATE
RECEPTOR SUBUNIT

(Xenopus laevis) 		PF01094
(ANF_receptor) 		4 ALA A 111
THR A 110
TYR A 109
VAL A 118
 None
 0.84A 6cduA-5b3jA:
undetectable
6cduE-5b3jA:
undetectable		 6cduA-5b3jA:
21.73
6cduE-5b3jA:
21.73
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.
5d0n PYRUVATE, PHOSPHATE
DIKINASE REGULATORY
PROTEIN,
CHLOROPLASTIC

(Zea mays) 		PF03618
(Kinase-PPPase) 		4 ALA A 287
TYR A 311
VAL A 290
PRO A 390
 None
 0.83A 6cduA-5d0nA:
undetectable
6cduE-5d0nA:
undetectable		 6cduA-5d0nA:
21.59
6cduE-5d0nA:
21.59
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.
5d67 EF-HAND
CALCIUM-BINDING
DOMAIN-CONTAINING
PROTEIN 6

(Homo sapiens) 		PF08976
(EF-hand_11) 		4 ALA A1021
THR A1023
TYR A1026
PRO A1073
 None
 0.91A 6cduA-5d67A:
undetectable
6cduE-5d67A:
undetectable		 6cduA-5d67A:
15.74
6cduE-5d67A:
15.74
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.
5eue PUTATIVE
SPHINGOSINE-1-PHOSPH
ATE LYASE

(Symbiobacterium
thermophilum) 		PF00282
(Pyridoxal_deC) 		4 ALA A 362
THR A 361
VAL A 143
TRP A 363
 None
 0.81A 6cduA-5eueA:
undetectable
6cduE-5eueA:
undetectable		 6cduA-5eueA:
18.87
6cduE-5eueA:
18.87
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.
5ex6 CYTOCHROME P450

(Streptomyces
toyocaensis) 		no annotation 4 ALA C 363
THR C 362
TYR C 361
VAL C 123
 None
 0.84A 6cduA-5ex6C:
1.5
6cduE-5ex6C:
1.5		 6cduA-5ex6C:
22.03
6cduE-5ex6C:
22.03
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.
5h1k GEM-ASSOCIATED
PROTEIN 5

(Homo sapiens) 		PF00400
(WD40)
PF12894
(ANAPC4_WD40) 		4 ALA A 601
TYR A 610
GLN A 665
PRO A 720
 None
 0.91A 6cduA-5h1kA:
undetectable
6cduE-5h1kA:
undetectable		 6cduA-5h1kA:
18.12
6cduE-5h1kA:
18.12
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.
5hm9 MAMO PROTEASE DOMAIN

(Magnetospirillum
magneticum) 		PF13365
(Trypsin_2) 		4 ALA A 107
THR A  69
GLN A  96
VAL A  97
 None
 0.97A 6cduA-5hm9A:
undetectable
6cduE-5hm9A:
undetectable		 6cduA-5hm9A:
20.00
6cduE-5hm9A:
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.
5irm UNCHARACTERIZED
PROTEIN

(Oryctolagus
cuniculus) 		PF05729
(NACHT)
PF13516
(LRR_6) 		4 ALA A 297
THR A 298
GLN A 213
VAL A 210
 None
 0.87A 6cduA-5irmA:
undetectable
6cduE-5irmA:
undetectable		 6cduA-5irmA:
15.02
6cduE-5irmA:
15.02
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.
5jbk BETA-GLUCOSIDASE

(Trichoderma
harzianum) 		PF00232
(Glyco_hydro_1) 		4 ALA A 252
THR A 251
TYR A 254
GLN A 270
 None
 0.95A 6cduA-5jbkA:
undetectable
6cduE-5jbkA:
undetectable		 6cduA-5jbkA:
19.92
6cduE-5jbkA:
19.92
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.
5k9o HEMAGGLUTININ

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		4 ALA F 425
THR F 422
TYR F 423
VAL F 429
 None
 0.86A 6cduA-5k9oF:
2.4
6cduE-5k9oF:
undetectable		 6cduA-5k9oF:
19.38
6cduE-5k9oF:
19.38
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.
5mkm TWO-DOMAIN LACCASE

(Streptomyces
griseoflavus) 		no annotation 4 ALA A 214
THR A 215
GLN A 273
VAL A 220
 None
 0.93A 6cduA-5mkmA:
undetectable
6cduE-5mkmA:
undetectable		 6cduA-5mkmA:
undetectable
6cduE-5mkmA:
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.
5nuv AUTOPHAGY-RELATED
PROTEIN 16-1

(Homo sapiens) 		PF00400
(WD40) 		4 ALA A 601
VAL A 593
TRP A 604
PRO A 311
 None
 0.94A 6cduA-5nuvA:
undetectable
6cduE-5nuvA:
undetectable		 6cduA-5nuvA:
21.15
6cduE-5nuvA:
21.15
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5o8f GAMMA-AMINOBUTYRIC
ACID RECEPTOR
SUBUNIT
BETA-3,GAMMA-AMINOBU
TYRIC ACID RECEPTOR
SUBUNIT
ALPHA-5,GAMMA-AMINOB
UTYRIC ACID RECEPTOR
SUBUNIT ALPHA-5

(Homo sapiens) 		no annotation 4 GLN A 245
VAL A 246
TRP A 249
PRO A 403
 None
 0.36A 6cduA-5o8fA:
28.6
6cduE-5o8fA:
3.8		 6cduA-5o8fA:
48.09
6cduE-5o8fA:
48.09
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.
5o9w THEBAINE
6-O-DEMETHYLASE

(Papaver
somniferum) 		no annotation 4 THR A 310
GLN A  89
VAL A 276
PRO A 269
 None
 0.97A 6cduA-5o9wA:
undetectable
6cduE-5o9wA:
undetectable		 6cduA-5o9wA:
undetectable
6cduE-5o9wA:
undetectable
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5osb PROTON-GATED ION
CHANNEL,GAMMA-AMINOB
UTYRIC ACID RECEPTOR
SUBUNIT
ALPHA-1,GAMMA-AMINOB
UTYRIC ACID RECEPTOR
SUBUNIT ALPHA-1

(Mus musculus;
Gloeobacter
violaceus) 		no annotation 4 GLN A 241
VAL A 242
TRP A 245
PRO A 400
 A8Z  A 502 (-2.8A)
A8Z  A 502 (-2.9A)
A8Z  A 502 ( 2.8A)
A8Z  A 502 (-3.1A)
 0.40A 6cduA-5osbA:
26.8
6cduE-5osbA:
26.9		 6cduA-5osbA:
49.40
6cduE-5osbA:
49.40
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.
5swi SUGAR HYDROLASE

(Streptococcus
pneumoniae) 		no annotation 4 ALA B 577
THR B 576
TYR B 575
VAL B 660
 None
 0.92A 6cduA-5swiB:
1.7
6cduE-5swiB:
2.2		 6cduA-5swiB:
17.31
6cduE-5swiB:
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.
5uc0 UNCHARACTERIZED
PROTEIN COG5400

(Brucella
abortus) 		PF06577
(DUF1134) 		4 ALA A  43
THR A  42
TYR A  41
VAL A  47
 None
 0.83A 6cduA-5uc0A:
undetectable
6cduE-5uc0A:
undetectable		 6cduA-5uc0A:
18.94
6cduE-5uc0A:
18.94
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.
5uqy ENVELOPE
GLYCOPROTEIN GP2

(Marburg
marburgvirus) 		no annotation 4 ALA B 546
THR B 545
TYR B 544
TRP B 519
 None
 0.85A 6cduA-5uqyB:
undetectable
6cduE-5uqyB:
undetectable		 6cduA-5uqyB:
19.47
6cduE-5uqyB:
19.47
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.
5v4p NADPH DEHYDROGENASE
3

(Saccharomyces
cerevisiae) 		no annotation 4 ALA A 183
GLN A  93
VAL A  94
TRP A  97
 None
 0.87A 6cduA-5v4pA:
undetectable
6cduE-5v4pA:
undetectable		 6cduA-5v4pA:
undetectable
6cduE-5v4pA:
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.
5xjj MULTI DRUG EFFLUX
TRANSPORTER

(Camelina sativa) 		PF01554
(MatE) 		4 ALA A 183
THR A 182
TYR A 181
VAL A  40
 None
 0.84A 6cduA-5xjjA:
3.8
6cduE-5xjjA:
3.7		 6cduA-5xjjA:
21.73
6cduE-5xjjA:
21.73
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.
5xmm MHC CLASS I ANTIGEN
ALPHA CHAIN

(Felis catus) 		no annotation 4 ALA A  12
THR A  11
TYR A  10
PRO A  44
 None
 0.95A 6cduA-5xmmA:
2.9
6cduE-5xmmA:
undetectable		 6cduA-5xmmA:
undetectable
6cduE-5xmmA:
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.
5yh1 -

(-) 		no annotation 4 ALA A 370
THR A 369
TYR A 368
VAL A 435
 None
 0.96A 6cduA-5yh1A:
undetectable
6cduE-5yh1A:
undetectable		 6cduA-5yh1A:
undetectable
6cduE-5yh1A:
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.
5zl9 CHITINASE AB

(Serratia
marcescens) 		no annotation 4 ALA A  77
THR A  76
GLN A 111
VAL A 112
 None
 0.97A 6cduA-5zl9A:
undetectable
6cduE-5zl9A:
undetectable		 6cduA-5zl9A:
undetectable
6cduE-5zl9A:
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.
6bp2 ENVELOPE
GLYCOPROTEIN GP2

(Marburg
marburgvirus) 		no annotation 4 ALA B 546
THR B 545
TYR B 544
TRP B 519
 None
 0.82A 6cduA-6bp2B:
undetectable
6cduE-6bp2B:
undetectable		 6cduA-6bp2B:
undetectable
6cduE-6bp2B:
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.
6cfw MONOVALENT CATION/H+
ANTIPORTER SUBUNIT D

(Pyrococcus
furiosus) 		no annotation 4 ALA H 436
THR H 435
TYR H 438
VAL H 300
 None
 0.92A 6cduA-6cfwH:
undetectable
6cduE-6cfwH:
2.6		 6cduA-6cfwH:
undetectable
6cduE-6cfwH:
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.
6eq8 PERIPLASMIC
ALPHA-GALACTOSIDE-BI
NDING PROTEIN

(Agrobacterium
tumefaciens) 		no annotation 4 THR D 489
TYR D 487
GLN D 368
VAL D 531
 None
BQZ  D 708 (-4.5A)
None
None
 0.54A 6cduA-6eq8D:
undetectable
6cduE-6eq8D:
undetectable		 6cduA-6eq8D:
undetectable
6cduE-6eq8D:
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.
6ez8 HUNTINGTIN

(Homo sapiens) 		no annotation 4 ALA A2251
THR A2252
GLN A2177
VAL A2176
 None
 0.91A 6cduA-6ez8A:
undetectable
6cduE-6ez8A:
undetectable		 6cduA-6ez8A:
undetectable
6cduE-6ez8A:
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.
6fsh OXYB PROTEIN

(Actinoplanes
teichomyceticus) 		no annotation 4 ALA A 363
THR A 362
TYR A 361
VAL A 123
 None
 0.79A 6cduA-6fshA:
undetectable
6cduE-6fshA:
undetectable		 6cduA-6fshA:
undetectable
6cduE-6fshA:
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.
6fsw RIBOSOME MATURATION
PROTEIN SDO1-LIKE
PROTEIN

(Archaeoglobus
fulgidus) 		no annotation 4 ALA A  30
TYR A  28
GLN A  88
VAL A  87
 None
 0.93A 6cduA-6fswA:
undetectable
6cduE-6fswA:
undetectable		 6cduA-6fswA:
undetectable
6cduE-6fswA:
undetectable