SIMILAR PATTERNS OF AMINO ACIDS FOR 1D8C_A_SORA4000_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.
1bht HEPATOCYTE GROWTH
FACTOR

(Homo sapiens) 		PF00024
(PAN_1)
PF00051
(Kringle) 		3 GLN A 150
HIS A 158
PRO A 194
 None
 0.92A 1d8cA-1bhtA:
undetectable		 1d8cA-1bhtA:
12.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1cnt CILIARY NEUROTROPHIC
FACTOR

(Homo sapiens) 		PF01110
(CNTF) 		3 GLN 1  95
HIS 1 106
PRO 1 100
 None
 0.83A 1d8cA-1cnt1:
undetectable		 1d8cA-1cnt1:
15.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1d8c MALATE SYNTHASE G

(Escherichia
coli) 		PF01274
(Malate_synthase) 		3 GLN A  61
HIS A 462
PRO A 704
 None
SOR  A4000 (-3.8A)
SOR  A4000 (-3.1A)
 0.00A 1d8cA-1d8cA:
67.1		 1d8cA-1d8cA:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ehi D-ALANINE:D-LACTATE
LIGASE

(Leuconostoc
mesenteroides) 		PF01820
(Dala_Dala_lig_N)
PF07478
(Dala_Dala_lig_C) 		3 GLN A 112
HIS A 130
PRO A 126
 None
 0.98A 1d8cA-1ehiA:
undetectable		 1d8cA-1ehiA:
20.36
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.
1f26 NITRIC OXIDE
REDUCTASE

(Fusarium
oxysporum) 		PF00067
(p450) 		3 GLN A 340
HIS A  48
PRO A 342
 None
 0.90A 1d8cA-1f26A:
undetectable		 1d8cA-1f26A:
19.54
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.
1g7c ELONGATION FACTOR
1-ALPHA

(Saccharomyces
cerevisiae) 		PF00009
(GTP_EFTU)
PF03143
(GTP_EFTU_D3)
PF03144
(GTP_EFTU_D2) 		3 GLN A 132
HIS A 136
PRO A  93
 None
 0.94A 1d8cA-1g7cA:
undetectable		 1d8cA-1g7cA:
20.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1jfn APOLIPOPROTEIN A,
KIV-T6

(Homo sapiens) 		PF00051
(Kringle) 		3 GLN A  47
HIS A  55
PRO A  90
 None
 0.78A 1d8cA-1jfnA:
undetectable		 1d8cA-1jfnA:
10.24
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.
1ko0 DIAMINOPIMELATE
DECARBOXYLASE

(Escherichia
coli) 		PF00278
(Orn_DAP_Arg_deC)
PF02784
(Orn_Arg_deC_N) 		3 GLN A 116
HIS A 137
PRO A 118
 None
 0.83A 1d8cA-1ko0A:
4.8		 1d8cA-1ko0A:
20.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1kqj A/G-SPECIFIC ADENINE
GLYCOSYLASE

(Escherichia
coli) 		PF00633
(HHH)
PF00730
(HhH-GPD) 		3 GLN A  94
HIS A  90
PRO A  69
 None
None
SO4  A 301 (-4.2A)
 0.96A 1d8cA-1kqjA:
undetectable		 1d8cA-1kqjA:
16.39
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.
1l6j MATRIX
METALLOPROTEINASE-9

(Homo sapiens) 		PF00040
(fn2)
PF00413
(Peptidase_M10)
PF01471
(PG_binding_1) 		3 GLN A  77
HIS A 411
PRO A 102
 None
ZN  A 500 (-3.4A)
None
 0.88A 1d8cA-1l6jA:
undetectable		 1d8cA-1l6jA:
20.16
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.
1naa CELLOBIOSE
DEHYDROGENASE

(Phanerochaete
chrysosporium) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		3 GLN A 515
HIS A 727
PRO A 729
 None
 0.96A 1d8cA-1naaA:
undetectable		 1d8cA-1naaA:
20.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1np7 DNA PHOTOLYASE

(Synechocystis
sp. PCC 6803) 		PF00875
(DNA_photolyase)
PF03441
(FAD_binding_7) 		3 GLN A 419
HIS A 444
PRO A 423
 None
 0.90A 1d8cA-1np7A:
undetectable		 1d8cA-1np7A:
21.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ohe CDC14B2 PHOSPHATASE

(Homo sapiens) 		PF00782
(DSPc)
PF14671
(DSPn) 		3 GLN A 242
HIS A 231
PRO A 230
 None
 0.96A 1d8cA-1oheA:
undetectable		 1d8cA-1oheA:
20.16
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.
1pkr PLASMINOGEN

(Homo sapiens) 		PF00051
(Kringle) 		3 GLN A  23
HIS A  31
PRO A  68
 None
 0.88A 1d8cA-1pkrA:
undetectable		 1d8cA-1pkrA:
7.12
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.
1pmi PHOSPHOMANNOSE
ISOMERASE

(Candida
albicans) 		PF01238
(PMI_typeI) 		3 GLN A 111
HIS A 285
PRO A 284
 ZN  A 445 (-3.2A)
ZN  A 445 (-3.3A)
None
 0.79A 1d8cA-1pmiA:
undetectable		 1d8cA-1pmiA:
22.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1sny SNIFFER CG10964-PA

(Drosophila
melanogaster) 		PF00106
(adh_short) 		3 GLN A  27
HIS A   1
PRO A  29
 None
 0.82A 1d8cA-1snyA:
undetectable		 1d8cA-1snyA:
16.50
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.
1tpy METHOXY MYCOLIC ACID
SYNTHASE 2

(Mycobacterium
tuberculosis) 		PF02353
(CMAS) 		3 GLN A 204
HIS A 144
PRO A 206
 None
 0.58A 1d8cA-1tpyA:
undetectable		 1d8cA-1tpyA:
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.
1umb 2-OXO ACID
DEHYDROGENASE ALPHA
SUBUNIT

(Thermus
thermophilus) 		PF00676
(E1_dh) 		3 GLN A 127
HIS A 131
PRO A 129
 None
 0.77A 1d8cA-1umbA:
2.7		 1d8cA-1umbA:
19.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1v7v CHITOBIOSE
PHOSPHORYLASE

(Vibrio
proteolyticus) 		PF06165
(Glyco_transf_36)
PF17167
(Glyco_hydro_36) 		3 GLN A 377
HIS A 465
PRO A 453
 None
 0.92A 1d8cA-1v7vA:
undetectable		 1d8cA-1v7vA:
22.27
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.
1z8l GLUTAMATE
CARBOXYPEPTIDASE II

(Homo sapiens) 		PF02225
(PA)
PF04253
(TFR_dimer)
PF04389
(Peptidase_M28) 		3 GLN A 389
HIS A  82
PRO A  81
 None
 0.95A 1d8cA-1z8lA:
2.7		 1d8cA-1z8lA:
22.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2a1u ELECTRON TRANSFER
FLAVOPROTEIN
BETA-SUBUNIT

(Homo sapiens) 		PF01012
(ETF) 		3 GLN B  72
HIS B  88
PRO B  68
 None
 0.88A 1d8cA-2a1uB:
undetectable		 1d8cA-2a1uB:
17.27
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.
2b8m HYPOTHETICAL PROTEIN
MJ0764

(Methanocaldococcus
jannaschii) 		PF00190
(Cupin_1) 		3 GLN A  64
HIS A  67
PRO A  66
 None
EDO  A 122 (-3.9A)
None
 0.77A 1d8cA-2b8mA:
undetectable		 1d8cA-2b8mA:
10.56
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.
2bfe 2-OXOISOVALERATE
DEHYDROGENASE ALPHA
SUBUNIT

(Homo sapiens) 		PF00676
(E1_dh) 		3 GLN A 145
HIS A 149
PRO A 147
 None
CL  A 504 (-4.4A)
None
 0.94A 1d8cA-2bfeA:
2.4		 1d8cA-2bfeA:
21.28
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.
2db6 SH3 AND CYSTEINE
RICH DOMAIN 3

(Homo sapiens) 		PF00130
(C1_1) 		3 GLN A  66
HIS A  18
PRO A  17
 None
ZN  A 201 (-3.2A)
None
 0.80A 1d8cA-2db6A:
undetectable		 1d8cA-2db6A:
8.16
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.
2dpy FLAGELLUM-SPECIFIC
ATP SYNTHASE

(Salmonella
enterica) 		PF00006
(ATP-synt_ab) 		3 GLN A 433
HIS A 362
PRO A 364
 None
 0.99A 1d8cA-2dpyA:
undetectable		 1d8cA-2dpyA:
21.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2e0i 432AA LONG
HYPOTHETICAL
DEOXYRIBODIPYRIMIDIN
E PHOTOLYASE

(Sulfurisphaera
tokodaii) 		PF00875
(DNA_photolyase)
PF03441
(FAD_binding_7) 		3 GLN A 371
HIS A 397
PRO A 376
 None
 0.71A 1d8cA-2e0iA:
undetectable		 1d8cA-2e0iA:
20.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2el7 TRYPTOPHANYL-TRNA
SYNTHETASE

(Thermus
thermophilus) 		PF00579
(tRNA-synt_1b) 		3 GLN A  84
HIS A  90
PRO A  88
 None
 0.98A 1d8cA-2el7A:
undetectable		 1d8cA-2el7A:
20.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2feb APOLIPOPROTEIN(A)

(Homo sapiens) 		PF00051
(Kringle) 		3 GLN A  40
HIS A  48
PRO A  83
 None
 0.77A 1d8cA-2febA:
undetectable		 1d8cA-2febA:
8.89
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2gq3 MALATE SYNTHASE G

(Mycobacterium
tuberculosis) 		PF01274
(Malate_synthase) 		3 GLN A  61
HIS A 469
PRO A 706
 None
 0.10A 1d8cA-2gq3A:
52.7		 1d8cA-2gq3A:
57.84
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.
2obm ESCN

(Escherichia
coli) 		PF00006
(ATP-synt_ab) 		3 GLN A 425
HIS A 354
PRO A 356
 None
None
ADP  A 600 ( 4.2A)
 0.98A 1d8cA-2obmA:
undetectable		 1d8cA-2obmA:
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.
2pk4 HUMAN PLASMINOGEN
KRINGLE 4

(Homo sapiens) 		PF00051
(Kringle) 		3 GLN A  23
HIS A  31
PRO A  68
 None
 0.86A 1d8cA-2pk4A:
undetectable		 1d8cA-2pk4A:
8.02
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.
2spt PROTHROMBIN

(Bos taurus) 		PF00051
(Kringle)
PF00594
(Gla) 		3 GLN A  88
HIS A  96
PRO A 132
 None
 0.98A 1d8cA-2sptA:
undetectable		 1d8cA-2sptA:
12.92
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.
2uzx HEPATOCYTE GROWTH
FACTOR RECEPTOR

(Homo sapiens) 		PF01403
(Sema)
PF01437
(PSI)
PF01833
(TIG) 		3 GLN B 464
HIS B 476
PRO B 475
 None
 0.90A 1d8cA-2uzxB:
undetectable		 1d8cA-2uzxB:
21.18
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.
2zw4 BLEOMYCIN
ACETYLTRANSFERASE

(Streptomyces
verticillus) 		PF13302
(Acetyltransf_3) 		3 GLN A 157
HIS A 166
PRO A 165
 None
 0.97A 1d8cA-2zw4A:
undetectable		 1d8cA-2zw4A:
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.
2zxx DNA REPLICATION
FACTOR CDT1

(Mus musculus) 		PF08839
(CDT1) 		3 GLN C 191
HIS C 187
PRO C 200
 None
 0.93A 1d8cA-2zxxC:
undetectable		 1d8cA-2zxxC:
15.25
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.
3act CELLOBIOSE
PHOSPHORYLASE

(Cellulomonas
gilvus) 		PF06165
(Glyco_transf_36)
PF17167
(Glyco_hydro_36) 		3 GLN A 395
HIS A 463
PRO A 449
 None
 0.84A 1d8cA-3actA:
undetectable		 1d8cA-3actA:
22.99
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.
3ddr HASR PROTEIN

(Serratia
marcescens) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		3 GLN A 155
HIS A 138
PRO A 158
 None
 0.92A 1d8cA-3ddrA:
undetectable		 1d8cA-3ddrA:
22.61
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.
3dt8 BRAIN
PLATELET-ACTIVATING
FACTOR
ACETYLHYDROLASE IB
SUBUNIT ALPHA

(Bos taurus) 		PF13472
(Lipase_GDSL_2) 		3 GLN A  78
HIS A  79
PRO A  13
 None
 0.90A 1d8cA-3dt8A:
undetectable		 1d8cA-3dt8A:
15.35
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.
3fay RAS
GTPASE-ACTIVATING-LI
KE PROTEIN IQGAP1

(Homo sapiens) 		PF00616
(RasGAP) 		3 GLN A1313
HIS A1325
PRO A1318
 None
 0.88A 1d8cA-3fayA:
undetectable		 1d8cA-3fayA:
20.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fgw PUTATIVE
PHOSPHOLIPASE B-LIKE
2

(Mus musculus) 		PF04916
(Phospholip_B) 		3 GLN A 526
HIS A 529
PRO A 524
 None
 0.84A 1d8cA-3fgwA:
undetectable		 1d8cA-3fgwA:
21.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3h1w MANNOSE-6-PHOSPHATE
ISOMERASE

(Salmonella
enterica) 		PF01238
(PMI_typeI) 		3 GLN A  97
HIS A 255
PRO A 254
 Y1  A 398 ( 4.9A)
ZN  A 397 (-3.2A)
None
 0.95A 1d8cA-3h1wA:
undetectable		 1d8cA-3h1wA:
22.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3h41 NLP/P60 FAMILY
PROTEIN

(Bacillus cereus) 		PF00877
(NLPC_P60) 		3 GLN A 109
HIS A 243
PRO A 254
 None
 0.65A 1d8cA-3h41A:
undetectable		 1d8cA-3h41A:
18.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hy8 PYRIDOXINE-5'-PHOSPH
ATE OXIDASE

(Homo sapiens) 		PF01243
(Putative_PNPOx)
PF10590
(PNP_phzG_C) 		3 GLN A 166
HIS A 159
PRO A 201
 None
 0.94A 1d8cA-3hy8A:
undetectable		 1d8cA-3hy8A:
16.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3i1i HOMOSERINE
O-ACETYLTRANSFERASE

(Bacillus
anthracis) 		PF00561
(Abhydrolase_1) 		3 GLN A 160
HIS A 287
PRO A 179
 None
 0.93A 1d8cA-3i1iA:
undetectable		 1d8cA-3i1iA:
21.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3i2v ADENYLYLTRANSFERASE
AND
SULFURTRANSFERASE
MOCS3

(Homo sapiens) 		PF00581
(Rhodanese) 		3 GLN A  25
HIS A  38
PRO A  24
 None
 0.96A 1d8cA-3i2vA:
undetectable		 1d8cA-3i2vA:
12.08
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.
3jbh MYOSIN 2 HEAVY CHAIN
STRIATED MUSCLE

(Aphonopelma) 		PF00063
(Myosin_head)
PF01576
(Myosin_tail_1)
PF02736
(Myosin_N) 		3 GLN A 167
HIS A 670
PRO A 669
 None
 0.85A 1d8cA-3jbhA:
undetectable		 1d8cA-3jbhA:
16.54
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.
3jc7 DNA REPLICATION
COMPLEX GINS PROTEIN
SLD5

(Saccharomyces
cerevisiae) 		PF05916
(Sld5)
PF16922
(SLD5_C) 		3 GLN D  82
HIS D  81
PRO D  80
 None
 0.77A 1d8cA-3jc7D:
undetectable		 1d8cA-3jc7D:
18.71
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.
3ljp CHOLINE OXIDASE

(Arthrobacter
globiformis) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		3 GLN A 308
HIS A 506
PRO A 467
 None
 0.95A 1d8cA-3ljpA:
undetectable		 1d8cA-3ljpA:
22.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qde CELLOBIOSE
PHOSPHORYLASE

(Ruminiclostridium
thermocellum) 		PF06165
(Glyco_transf_36)
PF17167
(Glyco_hydro_36) 		3 GLN A 388
HIS A 456
PRO A 442
 None
 0.90A 1d8cA-3qdeA:
undetectable		 1d8cA-3qdeA:
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.
3r0q PROBABLE PROTEIN
ARGININE
N-METHYLTRANSFERASE
4.2

(Arabidopsis
thaliana) 		no annotation 3 GLN C 305
HIS C  67
PRO C 303
 None
 0.78A 1d8cA-3r0qC:
undetectable		 1d8cA-3r0qC:
20.41
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.
3rjt LIPOLYTIC PROTEIN
G-D-S-L FAMILY

(Alicyclobacillus
acidocaldarius) 		PF13472
(Lipase_GDSL_2) 		3 GLN A  96
HIS A 106
PRO A 100
 None
 0.99A 1d8cA-3rjtA:
undetectable		 1d8cA-3rjtA:
15.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3s4d LACTOSE
PHOSPHORYLASE

(Cellulomonas
uda) 		PF06165
(Glyco_transf_36)
PF17167
(Glyco_hydro_36) 		3 GLN A  40
HIS A  39
PRO A  23
 None
 0.86A 1d8cA-3s4dA:
undetectable		 1d8cA-3s4dA:
22.81
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.
3s4d LACTOSE
PHOSPHORYLASE

(Cellulomonas
uda) 		PF06165
(Glyco_transf_36)
PF17167
(Glyco_hydro_36) 		3 GLN A 395
HIS A 463
PRO A 449
 None
 0.85A 1d8cA-3s4dA:
undetectable		 1d8cA-3s4dA:
22.81
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.
3te7 RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE]

(Homo sapiens) 		PF02525
(Flavodoxin_2) 		3 GLN A  12
HIS A  11
PRO A  14
 None
FAD  A 232 (-4.0A)
None
 0.94A 1d8cA-3te7A:
undetectable		 1d8cA-3te7A:
14.71
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.
3vr0 PUTATIVE
UNCHARACTERIZED
PROTEIN

(Pyrococcus
furiosus) 		PF09754
(PAC2) 		3 GLN A 107
HIS A 116
PRO A 110
 AU  A 303 (-4.4A)
AU  A 303 (-3.5A)
None
 0.98A 1d8cA-3vr0A:
undetectable		 1d8cA-3vr0A:
17.66
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.
3zdj ENCA BETA-LACTAMASE

(synthetic
construct) 		PF13354
(Beta-lactamase2) 		3 GLN A  28
HIS A 289
PRO A  27
 None
 0.78A 1d8cA-3zdjA:
undetectable		 1d8cA-3zdjA:
16.09
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.
4bq4 B-AGARASE

(Saccharophagus
degradans) 		PF02449
(Glyco_hydro_42) 		3 GLN A 238
HIS A 162
PRO A 236
 None
 0.98A 1d8cA-4bq4A:
2.8		 1d8cA-4bq4A:
21.98
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.
4bvv APOLIPOPROTEIN(A)

(Homo sapiens) 		PF00051
(Kringle) 		3 GLN A  23
HIS A  31
PRO A  68
 None
 0.94A 1d8cA-4bvvA:
undetectable		 1d8cA-4bvvA:
7.71
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.
4bvw APOLIPOPROTEIN(A)

(Homo sapiens) 		PF00051
(Kringle) 		3 GLN A  23
HIS A  31
PRO A  66
 None
 0.98A 1d8cA-4bvwA:
undetectable		 1d8cA-4bvwA:
9.40
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.
4dq1 THYMIDYLATE SYNTHASE

(Staphylococcus
aureus) 		PF00303
(Thymidylat_synt) 		3 GLN A 173
HIS A 183
PRO A 178
 None
 0.90A 1d8cA-4dq1A:
undetectable		 1d8cA-4dq1A:
18.59
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.
4duu PLASMINOGEN

(Homo sapiens) 		PF00024
(PAN_1)
PF00051
(Kringle)
PF00089
(Trypsin) 		3 GLN A 484
HIS A 492
PRO A 529
 None
 0.89A 1d8cA-4duuA:
undetectable		 1d8cA-4duuA:
20.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4ex4 MALATE SYNTHASE G

(Mycobacterium
leprae) 		PF01274
(Malate_synthase) 		3 GLN A  61
HIS A 474
PRO A 711
 None
 0.16A 1d8cA-4ex4A:
55.4		 1d8cA-4ex4A:
56.62
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.
4glp MONOCYTE
DIFFERENTIATION
ANTIGEN CD14

(Homo sapiens) 		PF13516
(LRR_6) 		3 GLN A 225
HIS A 252
PRO A 251
 None
 0.95A 1d8cA-4glpA:
undetectable		 1d8cA-4glpA:
19.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4h41 PUTATIVE
ALPHA-L-FUCOSIDASE

(Bacteroides
thetaiotaomicron) 		PF14488
(DUF4434)
PF17134
(DUF5109) 		3 GLN A  75
HIS A 341
PRO A  73
 None
 0.60A 1d8cA-4h41A:
3.6		 1d8cA-4h41A:
18.17
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.
4iua HEPATOCYTE GROWTH
FACTOR

(Mus musculus) 		PF00024
(PAN_1)
PF00051
(Kringle) 		3 GLN A 151
HIS A 159
PRO A 195
 None
 0.89A 1d8cA-4iuaA:
undetectable		 1d8cA-4iuaA:
14.64
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.
4jj6 ACETYL XYLAN
ESTERASE

(Geobacillus
stearothermophilus) 		PF13472
(Lipase_GDSL_2) 		3 GLN A  97
HIS A 107
PRO A 101
 None
 0.88A 1d8cA-4jj6A:
undetectable		 1d8cA-4jj6A:
14.84
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.
4jq9 DIHYDROLIPOYL
DEHYDROGENASE

(Escherichia
coli) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		3 GLN A 151
HIS A 157
PRO A 153
 None
 0.97A 1d8cA-4jq9A:
undetectable		 1d8cA-4jq9A:
22.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4k3j HEPATOCYTE GROWTH
FACTOR BETA CHAIN

(Homo sapiens) 		PF01403
(Sema)
PF01437
(PSI) 		3 GLN B 464
HIS B 476
PRO B 475
 None
 0.95A 1d8cA-4k3jB:
undetectable		 1d8cA-4k3jB:
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.
4k5r OXYGENASE

(Streptomyces
argillaceus) 		PF01494
(FAD_binding_3) 		3 GLN A 303
HIS A 297
PRO A 299
 None
None
FAD  A 601 (-4.5A)
 0.94A 1d8cA-4k5rA:
undetectable		 1d8cA-4k5rA:
22.46
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.
4mbz MAJOR CAPSID PROTEIN
VP1

(African green
monkey
polyomavirus) 		PF00718
(Polyoma_coat) 		3 GLN A 130
HIS A 271
PRO A 144
 SIA  A 406 (-4.3A)
SIA  A 406 (-4.2A)
None
 0.90A 1d8cA-4mbzA:
undetectable		 1d8cA-4mbzA:
17.61
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.
4mvf CALCIUM-DEPENDENT
PROTEIN KINASE 2

(Plasmodium
falciparum) 		PF00069
(Pkinase)
PF13499
(EF-hand_7) 		3 GLN A  96
HIS A 366
PRO A 450
 None
 0.90A 1d8cA-4mvfA:
undetectable		 1d8cA-4mvfA:
23.45
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.
4p7w L-PROLINE
CIS-4-HYDROXYLASE

(Mesorhizobium
japonicum) 		PF05118
(Asp_Arg_Hydrox)
PF05373
(Pro_3_hydrox_C) 		3 GLN A  48
HIS A  60
PRO A  63
 None
 0.59A 1d8cA-4p7wA:
undetectable		 1d8cA-4p7wA:
16.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4pot VP1

(Human
polyomavirus 9) 		PF00718
(Polyoma_coat) 		3 GLN A 133
HIS A 274
PRO A 147
 NGC  A 407 (-4.3A)
NGC  A 407 (-3.7A)
None
 0.87A 1d8cA-4potA:
undetectable		 1d8cA-4potA:
17.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4v19 MITORIBOSOMAL
PROTEIN UL29M,
MRPL47

(Sus scrofa) 		PF06984
(MRP-L47) 		3 GLN 2 237
HIS 2 242
PRO 2 241
 None
 0.90A 1d8cA-4v192:
2.1		 1d8cA-4v192:
16.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4w1w ADENOSYLMETHIONINE-8
-AMINO-7-OXONONANOAT
E AMINOTRANSFERASE

(Mycobacterium
tuberculosis) 		PF00202
(Aminotran_3) 		3 GLN A 224
HIS A 232
PRO A 221
 None
 0.88A 1d8cA-4w1wA:
undetectable		 1d8cA-4w1wA:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zlg PUTATIVE B-GLYCAN
PHOSPHORYLASE

(Saccharophagus
degradans) 		PF06165
(Glyco_transf_36)
PF17167
(Glyco_hydro_36) 		3 GLN A 377
HIS A 445
PRO A 432
 None
 0.91A 1d8cA-4zlgA:
undetectable		 1d8cA-4zlgA:
22.56
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.
5a0z CHOLINE
TRIMETHYLAMINE LYASE

(Klebsiella
pneumoniae) 		PF01228
(Gly_radical)
PF02901
(PFL-like) 		3 GLN A 721
HIS A 719
PRO A 723
 None
 0.96A 1d8cA-5a0zA:
undetectable		 1d8cA-5a0zA:
23.48
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.
5a1k ADSEVERIN

(Homo sapiens) 		PF00626
(Gelsolin) 		3 GLN A  34
HIS A  37
PRO A  33
 None
 0.95A 1d8cA-5a1kA:
undetectable		 1d8cA-5a1kA:
19.03
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.
5bn4 V-TYPE ATP SYNTHASE
ALPHA CHAIN

(Nanoarchaeum
equitans) 		PF00006
(ATP-synt_ab)
PF02874
(ATP-synt_ab_N)
PF16886
(ATP-synt_ab_Xtn) 		3 GLN A 490
HIS A 413
PRO A 415
 None
None
ANP  A 601 ( 4.4A)
 0.94A 1d8cA-5bn4A:
undetectable		 1d8cA-5bn4A:
23.37
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.
5exr DNA POLYMERASE ALPHA
SUBUNIT B

(Homo sapiens) 		PF04042
(DNA_pol_E_B)
PF08418
(Pol_alpha_B_N) 		3 GLN D 437
HIS D 431
PRO D 439
 None
 0.60A 1d8cA-5exrD:
2.0		 1d8cA-5exrD:
21.67
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.
5f2v GTP
PYROPHOSPHOKINASE
YJBM

(Bacillus
subtilis) 		no annotation 3 GLN V  81
HIS V  37
PRO V  39
 None
 0.92A 1d8cA-5f2vV:
undetectable		 1d8cA-5f2vV:
14.80
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.
5gan PRE-MRNA-PROCESSING
FACTOR 31

(Saccharomyces
cerevisiae) 		PF01798
(Nop)
PF09785
(Prp31_C) 		3 GLN F 292
HIS F 299
PRO F 295
 None
 0.97A 1d8cA-5ganF:
undetectable		 1d8cA-5ganF:
21.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hpg PLASMINOGEN

(Homo sapiens) 		PF00051
(Kringle) 		3 GLN A  23
HIS A  31
PRO A  68
 None
 0.92A 1d8cA-5hpgA:
undetectable		 1d8cA-5hpgA:
8.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jd3 LAE5

(uncultured
bacterium) 		PF13472
(Lipase_GDSL_2) 		3 GLN A  98
HIS A 108
PRO A 102
 None
 0.91A 1d8cA-5jd3A:
undetectable		 1d8cA-5jd3A:
15.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5lsr CCMP

(Synechococcus
elongatus) 		no annotation 3 GLN A 146
HIS A 206
PRO A 106
 None
 0.70A 1d8cA-5lsrA:
undetectable		 1d8cA-5lsrA:
15.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mz8 ALDEHYDE
DEHYDROGENASE 21

(Physcomitrella
patens) 		PF00171
(Aldedh) 		3 GLN A 306
HIS A 304
PRO A 400
 None
 0.84A 1d8cA-5mz8A:
undetectable		 1d8cA-5mz8A:
22.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5nz7 CELLODEXTRIN
PHOSPHORYLASE

(Ruminiclostridium
thermocellum) 		PF06165
(Glyco_transf_36)
PF17167
(Glyco_hydro_36) 		3 GLN A 490
HIS A 140
PRO A 886
 None
CL  A1001 (-4.5A)
CL  A1001 (-4.4A)
 0.98A 1d8cA-5nz7A:
undetectable		 1d8cA-5nz7A:
21.72
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.
5oar BETA-HEXOSAMINIDASE
BETA-HEXOSAMINIDASE

(Aspergillus
oryzae;
Aspergillus
oryzae) 		no annotation
no annotation 		3 GLN B 596
HIS B 588
PRO A  81
 None
 0.77A 1d8cA-5oarB:
5.4		 1d8cA-5oarB:
undetectable
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5oas MALATE SYNTHASE G

(Pseudomonas
aeruginosa) 		no annotation 3 GLN A  61
HIS A 467
PRO A 704
 None
GOL  A 804 (-3.6A)
GOL  A 804 (-4.6A)
 0.09A 1d8cA-5oasA:
52.9		 1d8cA-5oasA:
58.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5tr1 CHLORIDE CHANNEL
PROTEIN

(Bos taurus) 		PF00654
(Voltage_CLC) 		3 GLN A 513
HIS A 480
PRO A 517
 None
 0.74A 1d8cA-5tr1A:
undetectable		 1d8cA-5tr1A:
20.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5vkq NO MECHANORECEPTOR
POTENTIAL C ISOFORM
L

(Drosophila
melanogaster) 		PF00023
(Ank)
PF00520
(Ion_trans)
PF12796
(Ank_2)
PF13637
(Ank_4) 		3 GLN A 761
HIS A 765
PRO A 763
 None
 0.76A 1d8cA-5vkqA:
undetectable		 1d8cA-5vkqA:
18.72
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.
5x6o SERINE/THREONINE-PRO
TEIN KINASE MEC1

(Saccharomyces
cerevisiae) 		no annotation 3 GLN C 555
HIS C 601
PRO C 557
 None
 0.77A 1d8cA-5x6oC:
2.0		 1d8cA-5x6oC:
undetectable
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6axe MALATE SYNTHASE G

(Mycobacterium
marinum) 		PF01274
(Malate_synthase) 		3 GLN A  61
HIS A 473
PRO A 710
 None
 0.12A 1d8cA-6axeA:
52.6		 1d8cA-6axeA:
57.47
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.
6brd RIFAMPIN
MONOOXYGENASE

(Streptomyces
venezuelae) 		no annotation 3 GLN A 288
HIS A 282
PRO A 284
 None
None
FAD  A 501 (-4.8A)
 0.83A 1d8cA-6brdA:
undetectable		 1d8cA-6brdA:
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.
6c7s PUTATIVE RIFAMPIN
MONOOXYGENASE

(Nocardia
farcinica) 		no annotation 3 GLN A 287
HIS A 281
PRO A 283
 None
None
RFH  A 502 ( 4.2A)
 0.90A 1d8cA-6c7sA:
undetectable		 1d8cA-6c7sA:
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.
6coy CHLORIDE CHANNEL
PROTEIN 1

(Homo sapiens) 		no annotation 3 GLN A 571
HIS A 538
PRO A 575
 None
 0.64A 1d8cA-6coyA:
undetectable		 1d8cA-6coyA:
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.
6exn PRE-MRNA-SPLICING
FACTOR CWC2

(Saccharomyces
cerevisiae) 		no annotation 3 GLN M  12
HIS M  91
PRO M  85
 None
ZN  M1000 (-2.9A)
None
 0.95A 1d8cA-6exnM:
undetectable		 1d8cA-6exnM:
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.
6f8z ALPHA-1,2-MANNOSIDAS
E, PUTATIVE

(Bacteroides
thetaiotaomicron) 		no annotation 3 GLN A 640
HIS A 598
PRO A 596
 None
 0.87A 1d8cA-6f8zA:
undetectable		 1d8cA-6f8zA:
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.
6f91 PUTATIVE
ALPHA-1,2-MANNOSIDAS
E

(Bacteroides
thetaiotaomicron) 		no annotation 3 GLN A 636
HIS A 594
PRO A 592
 None
 0.86A 1d8cA-6f91A:
undetectable		 1d8cA-6f91A:
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.
6h25 -

(-) 		no annotation 3 GLN B 120
HIS B  56
PRO B  55
 None
 0.87A 1d8cA-6h25B:
undetectable		 1d8cA-6h25B:
undetectable