SIMILAR PATTERNS OF AMINO ACIDS FOR 6CDU_H_EY4H500_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 GLN A 129
ALA A 217
THR A 216
TYR A 215
 None
 0.46A 6cduH-1aq0A:
0.0
6cduI-1aq0A:
undetectable		 6cduH-1aq0A:
22.25
6cduI-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 GLN A 147
ALA A 133
THR A 132
TYR A 131
 None
 0.92A 6cduH-1awbA:
3.0
6cduI-1awbA:
0.0		 6cduH-1awbA:
22.71
6cduI-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 GLN A 213
VAL A 214
ALA A  40
THR A  31
 None
 0.93A 6cduH-1b8hA:
undetectable
6cduI-1b8hA:
undetectable		 6cduH-1b8hA:
21.39
6cduI-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 GLN B 156
VAL B  17
ALA B 221
TYR B 184
 None
 0.94A 6cduH-1ekbB:
0.0
6cduI-1ekbB:
0.0		 6cduH-1ekbB:
19.24
6cduI-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.
1jsd HAEMAGGLUTININ (HA2
CHAIN)

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		4 VAL B 100
ALA B  96
THR B  93
TYR B  94
 None
 0.94A 6cduH-1jsdB:
2.2
6cduI-1jsdB:
2.2		 6cduH-1jsdB:
18.18
6cduI-1jsdB:
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.
1jsm HAEMAGGLUTININ (HA2
CHAIN)

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		4 VAL B 100
ALA B  96
THR B  93
TYR B  94
 None
 0.92A 6cduH-1jsmB:
2.3
6cduI-1jsmB:
2.6		 6cduH-1jsmB:
20.07
6cduI-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.
1k25 LOW-AFFINITY
PENICILLIN-BINDING
PROTEIN 2X

(Streptococcus
pneumoniae) 		PF00905
(Transpeptidase)
PF03717
(PBP_dimer)
PF03793
(PASTA) 		4 GLN A 728
VAL A 727
ALA A 707
THR A 706
 None
 0.95A 6cduH-1k25A:
0.0
6cduI-1k25A:
undetectable		 6cduH-1k25A:
18.31
6cduI-1k25A:
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.
1o94 TRIMETHYLAMINE
DEHYDROGENASE

(Methylophilus
methylotrophus) 		PF00724
(Oxidored_FMN)
PF07992
(Pyr_redox_2) 		4 VAL A 166
PRO A  28
ALA A 155
TYR A 151
 None
FMN  A1730 (-4.8A)
None
None
 0.92A 6cduH-1o94A:
undetectable
6cduI-1o94A:
0.0		 6cduH-1o94A:
17.78
6cduI-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 PRO A 471
ALA A 454
THR A 453
TYR A 452
 None
 0.94A 6cduH-1ofeA:
0.0
6cduI-1ofeA:
0.0		 6cduH-1ofeA:
11.64
6cduI-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 GLN A 296
ALA A 101
THR A 102
TYR A 103
 GLN  A 296 ( 0.6A)
ALA  A 101 ( 0.0A)
THR  A 102 ( 0.8A)
TYR  A 103 ( 1.3A)
 0.67A 6cduH-1omoA:
undetectable
6cduI-1omoA:
undetectable		 6cduH-1omoA:
22.70
6cduI-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 GLN A  20
VAL A  48
ALA A  51
TYR A  75
 None
 0.89A 6cduH-1v2xA:
undetectable
6cduI-1v2xA:
undetectable		 6cduH-1v2xA:
19.08
6cduI-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 PRO A  30
ALA A  86
THR A  85
TYR A  84
 None
 0.82A 6cduH-1vbfA:
undetectable
6cduI-1vbfA:
undetectable		 6cduH-1vbfA:
21.47
6cduI-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.
1w8o BACTERIAL SIALIDASE

(Micromonospora
viridifaciens) 		PF00754
(F5_F8_type_C)
PF10633
(NPCBM_assoc)
PF13088
(BNR_2) 		4 GLN A 115
VAL A 117
ALA A 175
THR A 176
 None
 0.89A 6cduH-1w8oA:
undetectable
6cduI-1w8oA:
undetectable		 6cduH-1w8oA:
21.89
6cduI-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 GLN A 104
VAL A 106
ALA A 133
THR A 164
 None
 0.90A 6cduH-1yzvA:
undetectable
6cduI-1yzvA:
undetectable		 6cduH-1yzvA:
21.36
6cduI-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 VAL A 254
ALA A 185
THR A 184
TYR A 183
 None
 0.82A 6cduH-1zq1A:
undetectable
6cduI-1zq1A:
undetectable		 6cduH-1zq1A:
22.05
6cduI-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.
2cde INKT-TCR

(Homo sapiens) 		PF07686
(V-set)
PF09291
(DUF1968) 		4 PRO A   8
ALA A  64
THR A  63
TYR A  62
 None
 0.92A 6cduH-2cdeA:
undetectable
6cduI-2cdeA:
undetectable		 6cduH-2cdeA:
20.31
6cduI-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 VAL A  63
TRP A  65
ALA A  34
THR A  35
 None
 0.80A 6cduH-2dtcA:
undetectable
6cduI-2dtcA:
undetectable		 6cduH-2dtcA:
17.24
6cduI-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.
2eek TRYPSIN-1

(Gadus morhua) 		PF00089
(Trypsin) 		4 GLN A 156
VAL A  17
ALA A 221
TYR A 184
 None
 0.96A 6cduH-2eekA:
undetectable
6cduI-2eekA:
undetectable		 6cduH-2eekA:
18.45
6cduI-2eekA:
18.45
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.
2g0b FEEM

(uncultured
bacterium) 		no annotation 5 GLN A 183
VAL A 177
TRP A 180
ALA A 129
THR A 127
 None
 1.48A 6cduH-2g0bA:
undetectable
6cduI-2g0bA:
undetectable		 6cduH-2g0bA:
20.61
6cduI-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 VAL A 132
ALA A 122
THR A 123
TYR A 124
 None
 0.91A 6cduH-2pyyA:
undetectable
6cduI-2pyyA:
undetectable		 6cduH-2pyyA:
22.48
6cduI-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 PRO A 478
ALA A 188
THR A 187
TYR A 186
 None
None
None
GOL  A 601 ( 4.5A)
 0.76A 6cduH-2q9gA:
1.5
6cduI-2q9gA:
undetectable		 6cduH-2q9gA:
23.11
6cduI-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 VAL A 485
ALA A 481
THR A 478
TYR A 479
 None
 0.92A 6cduH-2qf7A:
undetectable
6cduI-2qf7A:
undetectable		 6cduH-2qf7A:
13.75
6cduI-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 GLN A 110
VAL A 109
TRP A  95
THR A  77
TYR A  97
 None
 1.36A 6cduH-2rezA:
undetectable
6cduI-2rezA:
undetectable		 6cduH-2rezA:
19.75
6cduI-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 PRO A 105
ALA A 203
THR A 200
TYR A 201
 None
 0.94A 6cduH-2rjbA:
undetectable
6cduI-2rjbA:
undetectable		 6cduH-2rjbA:
21.55
6cduI-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 GLN A 342
ALA A 180
THR A 179
TYR A 178
 None
 0.70A 6cduH-2v55A:
undetectable
6cduI-2v55A:
undetectable		 6cduH-2v55A:
20.82
6cduI-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 GLN A 356
VAL A 359
ALA A 380
TYR A 384
 None
 0.95A 6cduH-2vn7A:
1.8
6cduI-2vn7A:
1.6		 6cduH-2vn7A:
20.17
6cduI-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.
2wrg HEMAGGLUTININ HA2
CHAIN

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		4 VAL I 600
ALA I 596
THR I 593
TYR I 594
 None
 0.92A 6cduH-2wrgI:
undetectable
6cduI-2wrgI:
2.1		 6cduH-2wrgI:
19.44
6cduI-2wrgI:
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.
2wvg PYRUVATE
DECARBOXYLASE

(Zymomonas
mobilis) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		4 VAL A  14
ALA A  10
THR A   7
TYR A   8
 None
 0.86A 6cduH-2wvgA:
undetectable
6cduI-2wvgA:
undetectable		 6cduH-2wvgA:
18.36
6cduI-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 VAL I  26
ALA I  22
THR I  19
TYR I  20
 None
 0.93A 6cduH-2wvwI:
undetectable
6cduI-2wvwI:
undetectable		 6cduH-2wvwI:
18.38
6cduI-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 VAL A 376
ALA A 372
THR A 369
TYR A 370
 None
 0.95A 6cduH-2ww9A:
1.9
6cduI-2ww9A:
1.8		 6cduH-2ww9A:
20.85
6cduI-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 VAL A 386
ALA A 382
THR A 381
TYR A 380
 None
 0.86A 6cduH-2y2wA:
undetectable
6cduI-2y2wA:
undetectable		 6cduH-2y2wA:
19.38
6cduI-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 GLN C 728
VAL C 727
ALA C 707
THR C 706
 None
 0.88A 6cduH-2zc4C:
undetectable
6cduI-2zc4C:
undetectable		 6cduH-2zc4C:
17.85
6cduI-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 VAL Y 329
PRO Y 333
THR Y 323
TYR Y 324
 None
 0.94A 6cduH-2zqpY:
undetectable
6cduI-2zqpY:
undetectable		 6cduH-2zqpY:
19.30
6cduI-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 GLN A 712
ALA A 100
THR A  99
TYR A  98
 None
 0.67A 6cduH-3ayfA:
5.2
6cduI-3ayfA:
5.3		 6cduH-3ayfA:
18.31
6cduI-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.
3dz1 DIHYDRODIPICOLINATE
SYNTHASE

(Rhodopseudomonas
palustris) 		PF00701
(DHDPS) 		4 VAL A  79
PRO A 134
ALA A  65
THR A  66
 None
 0.91A 6cduH-3dz1A:
undetectable
6cduI-3dz1A:
undetectable		 6cduH-3dz1A:
20.45
6cduI-3dz1A:
20.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3egw RESPIRATORY NITRATE
REDUCTASE 1 ALPHA
CHAIN

(Escherichia
coli) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF14710
(Nitr_red_alph_N) 		5 GLN A 942
PRO A 943
ALA A 894
THR A 895
TYR A 896
 None
 1.35A 6cduH-3egwA:
undetectable
6cduI-3egwA:
undetectable		 6cduH-3egwA:
13.25
6cduI-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 GLN A 512
VAL A 541
PRO A 537
ALA A 409
THR A 407
 None
 1.43A 6cduH-3fw6A:
undetectable
6cduI-3fw6A:
undetectable		 6cduH-3fw6A:
22.84
6cduI-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 VAL A 169
TRP A 167
ALA A 150
THR A 149
 None
 0.92A 6cduH-3g5lA:
undetectable
6cduI-3g5lA:
undetectable		 6cduH-3g5lA:
18.98
6cduI-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 GLN A  56
VAL A 243
ALA A 276
THR A 277
 None
 0.93A 6cduH-3go7A:
undetectable
6cduI-3go7A:
undetectable		 6cduH-3go7A:
21.45
6cduI-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 PRO A 213
ALA A 281
THR A 280
TYR A 279
 None
 0.69A 6cduH-3i1iA:
undetectable
6cduI-3i1iA:
undetectable		 6cduH-3i1iA:
22.60
6cduI-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 GLN A 282
VAL A 283
ALA A 260
TYR A 262
 None
 0.92A 6cduH-3l2kA:
undetectable
6cduI-3l2kA:
undetectable		 6cduH-3l2kA:
23.25
6cduI-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.
3ng0 GLUTAMINE SYNTHETASE

(Synechocystis
sp. PCC 6803) 		PF00120
(Gln-synt_C)
PF03951
(Gln-synt_N) 		4 GLN A   6
VAL A   8
ALA A  77
THR A  76
 None
 0.72A 6cduH-3ng0A:
undetectable
6cduI-3ng0A:
undetectable		 6cduH-3ng0A:
21.15
6cduI-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 VAL A 322
ALA A 318
THR A 315
TYR A 316
 None
 0.83A 6cduH-3owaA:
3.7
6cduI-3owaA:
3.4		 6cduH-3owaA:
20.07
6cduI-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 PRO A 204
ALA B 554
THR B 555
TYR B 558
 None
 0.90A 6cduH-3pcoA:
undetectable
6cduI-3pcoA:
undetectable		 6cduH-3pcoA:
21.61
6cduI-3pcoA:
21.61
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.
3q41 GLUTAMATE [NMDA]
RECEPTOR SUBUNIT
ZETA-1

(Rattus
norvegicus) 		PF01094
(ANF_receptor) 		4 VAL A 118
ALA A 111
THR A 110
TYR A 109
 None
 0.88A 6cduH-3q41A:
undetectable
6cduI-3q41A:
undetectable		 6cduH-3q41A:
20.71
6cduI-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 VAL A 295
PRO A 308
ALA A 321
THR A 320
 None
 0.83A 6cduH-3sqlA:
undetectable
6cduI-3sqlA:
undetectable		 6cduH-3sqlA:
22.57
6cduI-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.
3wuf ENDO-1,4-BETA-XYLANA
SE A

(Streptomyces
sp.) 		PF00331
(Glyco_hydro_10) 		4 PRO A 128
ALA A 101
THR A 100
TYR A  99
 None
None
ZN  A 402 (-3.8A)
None
 0.74A 6cduH-3wufA:
undetectable
6cduI-3wufA:
undetectable		 6cduH-3wufA:
25.00
6cduI-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.
4cj0 ENDOGLUCANASE D
E12 AFFITIN

(Ruminiclostridium
thermocellum;
synthetic
construct) 		PF00759
(Glyco_hydro_9)
PF02927
(CelD_N)
PF02294
(7kD_DNA_binding) 		4 GLN B  35
VAL B  34
PRO A 539
ALA B  54
 None
 0.83A 6cduH-4cj0B:
undetectable
6cduI-4cj0B:
undetectable		 6cduH-4cj0B:
13.27
6cduI-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 VAL B 100
ALA B  96
THR B  93
TYR B  94
 None
 0.92A 6cduH-4cyvB:
undetectable
6cduI-4cyvB:
undetectable		 6cduH-4cyvB:
19.94
6cduI-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.
4dgj ENTEROPEPTIDASE
CATALYTIC LIGHT
CHAIN

(Homo sapiens) 		PF00089
(Trypsin) 		4 GLN A 145
VAL A   2
ALA A 212
TYR A 175
 None
 0.94A 6cduH-4dgjA:
undetectable
6cduI-4dgjA:
undetectable		 6cduH-4dgjA:
21.30
6cduI-4dgjA:
21.30
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.
4gr2 ATRBCX1

(Arabidopsis
thaliana) 		PF02341
(RcbX) 		4 VAL A  31
ALA A  27
THR A  24
TYR A  25
 None
 0.94A 6cduH-4gr2A:
undetectable
6cduI-4gr2A:
undetectable		 6cduH-4gr2A:
16.56
6cduI-4gr2A:
16.56
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.
4gr6 ATRBCX2

(Arabidopsis
thaliana) 		PF02341
(RcbX) 		4 VAL A  31
ALA A  27
THR A  24
TYR A  25
 None
 0.91A 6cduH-4gr6A:
undetectable
6cduI-4gr6A:
undetectable		 6cduH-4gr6A:
18.30
6cduI-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.
4h19 MANDELATE RACEMASE

(Agrobacterium
fabrum) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 VAL A 112
TRP A 115
ALA A 355
TYR A 129
 None
 0.76A 6cduH-4h19A:
undetectable
6cduI-4h19A:
undetectable		 6cduH-4h19A:
20.26
6cduI-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 GLN A 346
VAL A 347
ALA A 353
THR A 352
 None
 0.78A 6cduH-4izoA:
undetectable
6cduI-4izoA:
undetectable		 6cduH-4izoA:
21.35
6cduI-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 VAL A 485
ALA A 481
THR A 478
TYR A 479
 None
 0.91A 6cduH-4jx6A:
undetectable
6cduI-4jx6A:
undetectable		 6cduH-4jx6A:
18.56
6cduI-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 PRO A 160
ALA A 235
THR A 340
TYR A 342
 None
 0.92A 6cduH-4kg7A:
undetectable
6cduI-4kg7A:
undetectable		 6cduH-4kg7A:
20.67
6cduI-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 VAL A  88
ALA A 124
THR A 125
TYR A 126
 None
None
None
SO4  A 301 (-4.5A)
 0.93A 6cduH-4lg3A:
undetectable
6cduI-4lg3A:
undetectable		 6cduH-4lg3A:
22.71
6cduI-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 VAL A 164
PRO A 215
ALA A 146
THR A 147
 None
 0.86A 6cduH-4m1rA:
undetectable
6cduI-4m1rA:
undetectable		 6cduH-4m1rA:
21.84
6cduI-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 VAL A 105
PRO A  87
ALA A 101
THR A  98
 None
 0.88A 6cduH-4nesA:
undetectable
6cduI-4nesA:
undetectable		 6cduH-4nesA:
21.65
6cduI-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 VAL A 289
ALA A 285
THR A 282
TYR A 283
 None
 0.85A 6cduH-4pz0A:
undetectable
6cduI-4pz0A:
undetectable		 6cduH-4pz0A:
22.86
6cduI-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 VAL A 111
ALA A 129
THR A 128
TYR A 127
 None
 0.94A 6cduH-4q1jA:
undetectable
6cduI-4q1jA:
undetectable		 6cduH-4q1jA:
21.16
6cduI-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 GLN A 160
VAL A 157
ALA A 122
THR A 121
 None
 0.93A 6cduH-4rmaA:
undetectable
6cduI-4rmaA:
undetectable		 6cduH-4rmaA:
17.54
6cduI-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 GLN A  19
VAL A  18
ALA A  16
THR A  15
 None
 0.94A 6cduH-4v23A:
undetectable
6cduI-4v23A:
undetectable		 6cduH-4v23A:
20.61
6cduI-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 VAL A 174
ALA A 413
THR A 414
TYR A 417
 None
 0.86A 6cduH-4w8iA:
undetectable
6cduI-4w8iA:
undetectable		 6cduH-4w8iA:
17.24
6cduI-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 GLN A 199
VAL A 198
ALA A 119
THR A 126
 None
 0.94A 6cduH-4xg0A:
undetectable
6cduI-4xg0A:
undetectable		 6cduH-4xg0A:
19.09
6cduI-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 VAL A 596
ALA A 611
THR A 612
TYR A 615
 None
 0.94A 6cduH-4y4rA:
undetectable
6cduI-4y4rA:
undetectable		 6cduH-4y4rA:
21.37
6cduI-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.
4z02 BROMODOMAIN-CONTAINI
NG PROTEIN 1

(Homo sapiens) 		PF00855
(PWWP) 		4 VAL A 989
PRO A 965
ALA A 935
TYR A 943
 None
None
None
4K8  A1101 (-3.7A)
 0.90A 6cduH-4z02A:
undetectable
6cduI-4z02A:
undetectable		 6cduH-4z02A:
15.81
6cduI-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.
4z19 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3

(Yersinia pestis) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		4 GLN A  93
VAL A  94
ALA A  59
TYR A  11
 None
 0.94A 6cduH-4z19A:
undetectable
6cduI-4z19A:
undetectable		 6cduH-4z19A:
23.66
6cduI-4z19A:
23.66
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.
5a3y THERMOLYSIN

(Bacillus
thermoproteolyticus) 		PF01447
(Peptidase_M4)
PF02868
(Peptidase_M4_C) 		4 GLN A 308
VAL A 306
ALA A 292
THR A 293
 None
 0.94A 6cduH-5a3yA:
undetectable
6cduI-5a3yA:
undetectable		 6cduH-5a3yA:
21.50
6cduI-5a3yA:
21.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5b3j NMDA GLUTAMATE
RECEPTOR SUBUNIT

(Xenopus laevis) 		PF01094
(ANF_receptor) 		4 VAL A 118
ALA A 111
THR A 110
TYR A 109
 None
 0.86A 6cduH-5b3jA:
undetectable
6cduI-5b3jA:
undetectable		 6cduH-5b3jA:
21.73
6cduI-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 VAL A 290
PRO A 390
ALA A 287
TYR A 311
 None
 0.83A 6cduH-5d0nA:
undetectable
6cduI-5d0nA:
undetectable		 6cduH-5d0nA:
21.59
6cduI-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 PRO A1073
ALA A1021
THR A1023
TYR A1026
 None
 0.91A 6cduH-5d67A:
undetectable
6cduI-5d67A:
undetectable		 6cduH-5d67A:
15.74
6cduI-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 VAL A 143
TRP A 363
ALA A 362
THR A 361
 None
 0.83A 6cduH-5eueA:
undetectable
6cduI-5eueA:
undetectable		 6cduH-5eueA:
18.87
6cduI-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 VAL C 123
ALA C 363
THR C 362
TYR C 361
 None
 0.84A 6cduH-5ex6C:
undetectable
6cduI-5ex6C:
undetectable		 6cduH-5ex6C:
22.03
6cduI-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.
5fxn THERMOLYSIN

(Bacillus
thermoproteolyticus) 		PF01447
(Peptidase_M4)
PF02868
(Peptidase_M4_C) 		4 GLN A 308
VAL A 306
ALA A 292
THR A 293
 None
 0.94A 6cduH-5fxnA:
undetectable
6cduI-5fxnA:
undetectable		 6cduH-5fxnA:
22.38
6cduI-5fxnA:
22.38
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.
5ghf AMINOTRANSFERASE
CLASS-III

(Ochrobactrum
anthropi) 		PF00202
(Aminotran_3) 		5 VAL A 284
PRO A 280
ALA A 121
THR A 124
TYR A 113
 None
 1.47A 6cduH-5ghfA:
undetectable
6cduI-5ghfA:
undetectable		 6cduH-5ghfA:
23.28
6cduI-5ghfA:
23.28
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.
5h1k GEM-ASSOCIATED
PROTEIN 5

(Homo sapiens) 		PF00400
(WD40)
PF12894
(ANAPC4_WD40) 		4 GLN A 665
PRO A 720
ALA A 601
TYR A 610
 None
 0.89A 6cduH-5h1kA:
undetectable
6cduI-5h1kA:
undetectable		 6cduH-5h1kA:
18.12
6cduI-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 GLN A  96
VAL A  97
ALA A 107
THR A  69
 None
 0.96A 6cduH-5hm9A:
undetectable
6cduI-5hm9A:
undetectable		 6cduH-5hm9A:
20.00
6cduI-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 GLN A 213
VAL A 210
ALA A 297
THR A 298
 None
 0.90A 6cduH-5irmA:
undetectable
6cduI-5irmA:
undetectable		 6cduH-5irmA:
15.02
6cduI-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 GLN A 270
ALA A 252
THR A 251
TYR A 254
 None
 0.93A 6cduH-5jbkA:
undetectable
6cduI-5jbkA:
undetectable		 6cduH-5jbkA:
19.92
6cduI-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.
5k5m RNA DEPENDENT RNA
POLYMERASE

(Dengue virus) 		PF00972
(Flavi_NS5) 		4 GLN A 622
PRO A 669
ALA A 680
THR A 679
 None
 0.94A 6cduH-5k5mA:
undetectable
6cduI-5k5mA:
undetectable		 6cduH-5k5mA:
19.72
6cduI-5k5mA:
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.
5k9o HEMAGGLUTININ

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		4 VAL F 429
ALA F 425
THR F 422
TYR F 423
 None
 0.84A 6cduH-5k9oF:
2.4
6cduI-5k9oF:
2.4		 6cduH-5k9oF:
19.38
6cduI-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 GLN A 273
VAL A 220
ALA A 214
THR A 215
 None
 0.94A 6cduH-5mkmA:
undetectable
6cduI-5mkmA:
undetectable		 6cduH-5mkmA:
undetectable
6cduI-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 VAL A 593
TRP A 604
PRO A 311
ALA A 601
 None
 0.96A 6cduH-5nuvA:
undetectable
6cduI-5nuvA:
undetectable		 6cduH-5nuvA:
21.15
6cduI-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
 0.31A 6cduH-5o8fA:
4.7
6cduI-5o8fA:
21.0		 6cduH-5o8fA:
48.09
6cduI-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 GLN A  89
VAL A 276
PRO A 269
THR A 310
 None
 0.94A 6cduH-5o9wA:
undetectable
6cduI-5o9wA:
undetectable		 6cduH-5o9wA:
undetectable
6cduI-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)
 0.37A 6cduH-5osbA:
26.9
6cduI-5osbA:
20.5		 6cduH-5osbA:
49.40
6cduI-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 VAL B 660
ALA B 577
THR B 576
TYR B 575
 None
 0.86A 6cduH-5swiB:
2.2
6cduI-5swiB:
2.1		 6cduH-5swiB:
17.31
6cduI-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 VAL A  47
ALA A  43
THR A  42
TYR A  41
 None
 0.86A 6cduH-5uc0A:
undetectable
6cduI-5uc0A:
undetectable		 6cduH-5uc0A:
18.94
6cduI-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 TRP B 519
ALA B 546
THR B 545
TYR B 544
 None
 0.87A 6cduH-5uqyB:
undetectable
6cduI-5uqyB:
undetectable		 6cduH-5uqyB:
19.47
6cduI-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 GLN A  93
VAL A  94
TRP A  97
ALA A 183
 None
 0.89A 6cduH-5v4pA:
undetectable
6cduI-5v4pA:
undetectable		 6cduH-5v4pA:
undetectable
6cduI-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.
5vaw MALTOSE-BINDING
PERIPLASMIC
PROTEIN,TYPE IV
PILIN PILA

(Acinetobacter
baumannii;
Escherichia
coli) 		no annotation 4 VAL A1033
ALA A1029
THR A1026
TYR A1027
 None
None
None
GLU  A1203 (-4.0A)
 0.95A 6cduH-5vawA:
undetectable
6cduI-5vawA:
undetectable		 6cduH-5vawA:
undetectable
6cduI-5vawA:
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 VAL A  40
ALA A 183
THR A 182
TYR A 181
 None
 0.85A 6cduH-5xjjA:
1.9
6cduI-5xjjA:
2.0		 6cduH-5xjjA:
21.73
6cduI-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 PRO A  44
ALA A  12
THR A  11
TYR A  10
 None
 0.95A 6cduH-5xmmA:
undetectable
6cduI-5xmmA:
3.0		 6cduH-5xmmA:
undetectable
6cduI-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.
6bp2 ENVELOPE
GLYCOPROTEIN GP2

(Marburg
marburgvirus) 		no annotation 4 TRP B 519
ALA B 546
THR B 545
TYR B 544
 None
 0.85A 6cduH-6bp2B:
undetectable
6cduI-6bp2B:
undetectable		 6cduH-6bp2B:
undetectable
6cduI-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 VAL H 300
ALA H 436
THR H 435
TYR H 438
 None
 0.96A 6cduH-6cfwH:
2.6
6cduI-6cfwH:
2.9		 6cduH-6cfwH:
undetectable
6cduI-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 GLN D 368
VAL D 531
THR D 489
TYR D 487
 None
None
None
BQZ  D 708 (-4.5A)
 0.59A 6cduH-6eq8D:
undetectable
6cduI-6eq8D:
undetectable		 6cduH-6eq8D:
undetectable
6cduI-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 GLN A2177
VAL A2176
ALA A2251
THR A2252
 None
 0.86A 6cduH-6ez8A:
undetectable
6cduI-6ez8A:
undetectable		 6cduH-6ez8A:
undetectable
6cduI-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 VAL A 123
ALA A 363
THR A 362
TYR A 361
 None
 0.81A 6cduH-6fshA:
undetectable
6cduI-6fshA:
undetectable		 6cduH-6fshA:
undetectable
6cduI-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 GLN A  88
VAL A  87
ALA A  30
TYR A  28
 None
 0.94A 6cduH-6fswA:
1.2
6cduI-6fswA:
undetectable		 6cduH-6fswA:
undetectable
6cduI-6fswA:
undetectable