SIMILAR PATTERNS OF AMINO ACIDS FOR 3V4T_E_ACTE503

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.
1cg4 PROTEIN
(ADENYLOSUCCINATE
SYNTHETASE)

(Escherichia
coli) 		PF00709
(Adenylsucc_synt) 		3 GLN A 224
THR A 300
ASN A  38
 IMO  A 440 (-3.6A)
None
IMO  A 440 (-4.0A)
 0.72A 3v4tE-1cg4A:
0.0		 3v4tE-1cg4A:
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.
1cpy SERINE
CARBOXYPEPTIDASE

(Saccharomyces
cerevisiae) 		PF00450
(Peptidase_S10) 		3 GLN A 184
THR A 350
ASN A 346
 None
 0.87A 3v4tE-1cpyA:
0.0		 3v4tE-1cpyA:
21.75
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.
1gq1 CYTOCHROME CD1
NITRITE REDUCTASE

(Paracoccus
pantotrophus) 		PF02239
(Cytochrom_D1)
PF13442
(Cytochrome_CBB3) 		3 GLN A 385
THR A 382
ASN A 364
 None
 0.89A 3v4tE-1gq1A:
0.0		 3v4tE-1gq1A:
23.33
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.
1imh NUCLEAR FACTOR OF
ACTIVATED T CELLS 5

(Homo sapiens) 		PF00554
(RHD_DNA_bind)
PF16179
(RHD_dimer) 		3 GLN C 425
THR C 452
ASN C 393
 None
 0.68A 3v4tE-1imhC:
undetectable		 3v4tE-1imhC:
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.
1iz6 INITIATION FACTOR 5A

(Pyrococcus
horikoshii) 		PF01287
(eIF-5a)
PF08207
(EFP_N) 		3 GLN A  77
THR A  75
ASN A 118
 None
 0.57A 3v4tE-1iz6A:
0.0		 3v4tE-1iz6A:
17.10
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.
1qhl PROTEIN (CELL
DIVISION PROTEIN
MUKB)

(Escherichia
coli) 		PF04310
(MukB) 		3 GLN A  98
THR A  92
ASN A  94
 None
 0.90A 3v4tE-1qhlA:
0.0		 3v4tE-1qhlA:
20.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1s4f RNA-DEPENDENT RNA
POLYMERASE

(Pestivirus A) 		PF00998
(RdRP_3) 		3 GLN A 352
THR A 354
ASN A 178
 None
 0.78A 3v4tE-1s4fA:
0.3		 3v4tE-1s4fA:
23.91
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.
1v9t CYCLOPHILIN B

(Escherichia
coli) 		PF00160
(Pro_isomerase) 		3 GLN A 150
THR A 143
ASN A 151
 None
 0.81A 3v4tE-1v9tA:
0.0		 3v4tE-1v9tA:
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.
1vcz RNASE NGR3

(Nicotiana
glutinosa) 		PF00445
(Ribonuclease_T2) 		3 GLN A  52
THR A  99
ASN A  53
 None
 0.68A 3v4tE-1vczA:
0.0		 3v4tE-1vczA:
18.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wms RAS-RELATED PROTEIN
RAB-9A

(Homo sapiens) 		PF00071
(Ras) 		3 GLN A  59
THR A  57
ASN A  46
 None
 0.85A 3v4tE-1wmsA:
undetectable		 3v4tE-1wmsA:
16.75
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.
1wqa PHOSPHO-SUGAR MUTASE

(Pyrococcus
horikoshii) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		3 GLN A 207
THR A  50
ASN A 183
 GLN  A 207 ( 0.6A)
THR  A  50 ( 0.8A)
ASN  A 183 ( 0.6A)
 0.90A 3v4tE-1wqaA:
undetectable		 3v4tE-1wqaA:
24.90
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.
1x3x CYTOCHROME B5

(Ascaris suum) 		PF00173
(Cyt-b5) 		3 GLN A  17
THR A  32
ASN A  18
 None
 0.60A 3v4tE-1x3xA:
undetectable		 3v4tE-1x3xA:
11.03
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.
1xup GLYCEROL KINASE

(Enterococcus
casseliflavus) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		3 GLN O 248
THR O 190
ASN O 186
 None
 0.83A 3v4tE-1xupO:
undetectable		 3v4tE-1xupO:
21.24
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.
1z3v CELLULASE

(Phanerochaete
chrysosporium) 		PF00840
(Glyco_hydro_7) 		3 GLN A 329
THR A 323
ASN A 325
 None
 0.89A 3v4tE-1z3vA:
undetectable		 3v4tE-1z3vA:
22.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2afh NITROGENASE
MOLYBDENUM-IRON
PROTEIN

(Azotobacter
vinelandii) 		PF00148
(Oxidored_nitro)
PF11844
(DUF3364) 		3 GLN B 136
THR B 141
ASN B 137
 None
 0.78A 3v4tE-2afhB:
undetectable		 3v4tE-2afhB:
22.94
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.
2ayn UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE 14

(Homo sapiens) 		PF00443
(UCH) 		3 GLN A 300
THR A 298
ASN A 307
 None
 0.90A 3v4tE-2aynA:
undetectable		 3v4tE-2aynA:
20.94
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.
2b5i CYTOKINE RECEPTOR
COMMON GAMMA CHAIN

(Homo sapiens) 		PF00041
(fn3)
PF09240
(IL6Ra-bind) 		3 GLN C  94
THR C  51
ASN C  49
 NAG  C 233 ( 4.8A)
None
NAG  C 233 (-1.8A)
 0.83A 3v4tE-2b5iC:
undetectable		 3v4tE-2b5iC:
16.75
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.
2bbk METHYLAMINE
DEHYDROGENASE (HEAVY
SUBUNIT)

(Paracoccus
denitrificans) 		PF06433
(Me-amine-dh_H) 		3 GLN H  48
THR H  46
ASN H  37
 None
 0.89A 3v4tE-2bbkH:
undetectable		 3v4tE-2bbkH:
24.03
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.
2cjq RNA-DIRECTED RNA
POLYMERASE

(Pestivirus A) 		PF00998
(RdRP_3) 		3 GLN A 352
THR A 354
ASN A 178
 None
 0.83A 3v4tE-2cjqA:
undetectable		 3v4tE-2cjqA:
22.18
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.
2erj CYTOKINE RECEPTOR
COMMON GAMMA CHAIN

(Homo sapiens) 		PF00041
(fn3)
PF09240
(IL6Ra-bind) 		3 GLN C  94
THR C  51
ASN C  49
 NAG  C 300 (-4.2A)
None
NAG  C 300 (-1.8A)
 0.79A 3v4tE-2erjC:
undetectable		 3v4tE-2erjC:
17.48
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.
2fn5 NEURABIN-1

(Rattus
norvegicus) 		PF00595
(PDZ) 		3 GLN A  73
THR A  78
ASN A  74
 None
 0.85A 3v4tE-2fn5A:
undetectable		 3v4tE-2fn5A:
15.05
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.
2g8s GLUCOSE/SORBOSONE
DEHYDROGENASES

(Escherichia
coli) 		PF07995
(GSDH) 		3 GLN A 118
THR A 152
ASN A 147
 None
 0.88A 3v4tE-2g8sA:
undetectable		 3v4tE-2g8sA:
23.86
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.
2gkp HYPOTHETICAL PROTEIN
NMB0488

(Neisseria
meningitidis) 		PF07262
(CdiI) 		3 GLN A  57
THR A  24
ASN A  61
 None
 0.85A 3v4tE-2gkpA:
undetectable		 3v4tE-2gkpA:
15.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ifg HIGH AFFINITY NERVE
GROWTH FACTOR
RECEPTOR

(Homo sapiens) 		PF13855
(LRR_8)
PF16920
(TPKR_C2) 		3 GLN A 279
THR A 264
ASN A 262
 NAG  A 383 ( 4.8A)
None
NAG  A 383 (-2.0A)
 0.89A 3v4tE-2ifgA:
undetectable		 3v4tE-2ifgA:
23.80
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.
2j0j FOCAL ADHESION
KINASE 1

(Gallus gallus) 		PF00373
(FERM_M)
PF07714
(Pkinase_Tyr) 		3 GLN A 136
THR A 143
ASN A  79
 None
 0.89A 3v4tE-2j0jA:
undetectable		 3v4tE-2j0jA:
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.
2m6r FLAVODOXIN

(Escherichia
coli) 		PF00258
(Flavodoxin_1) 		3 GLN A 106
THR A  59
ASN A 102
 None
 0.57A 3v4tE-2m6rA:
undetectable		 3v4tE-2m6rA:
20.94
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.
2mvf UNCHARACTERIZED
PROTEIN

(Chaetomium
thermophilum) 		PF01201
(Ribosomal_S8e) 		3 GLN A 194
THR A 192
ASN A 183
 None
 0.72A 3v4tE-2mvfA:
undetectable		 3v4tE-2mvfA:
12.68
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.
2n1k FIBRONECTIN

(Homo sapiens) 		PF00041
(fn3) 		3 GLN A  94
THR A  78
ASN A  76
 None
 0.89A 3v4tE-2n1kA:
undetectable		 3v4tE-2n1kA:
13.11
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.
2uzc PDZ AND LIM DOMAIN 5

(Homo sapiens) 		PF00595
(PDZ) 		3 GLN A  82
THR A  80
ASN A   3
 None
 0.83A 3v4tE-2uzcA:
undetectable		 3v4tE-2uzcA:
15.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2v79 DNA REPLICATION
PROTEIN DNAD

(Bacillus
subtilis) 		no annotation 3 GLN A  58
THR A  53
ASN A  55
 NA  A1116 (-3.2A)
None
None
 0.73A 3v4tE-2v79A:
undetectable		 3v4tE-2v79A:
15.27
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.
2vk4 PYRUVATE
DECARBOXYLASE

(Kluyveromyces
lactis) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		3 GLN A 373
THR A 523
ASN A 519
 None
 0.71A 3v4tE-2vk4A:
undetectable		 3v4tE-2vk4A:
21.82
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.
2w3j CARBOHYDRATE BINDING
MODULE

(uncultured
bacterium) 		PF16990
(CBM_35) 		3 GLN A  56
THR A  54
ASN A  96
 None
 0.87A 3v4tE-2w3jA:
undetectable		 3v4tE-2w3jA:
16.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2x2i ALPHA-1,4-GLUCAN
LYASE ISOZYME 1

(Gracilariopsis
lemaneiformis) 		PF01055
(Glyco_hydro_31) 		3 GLN A  74
THR A  72
ASN A  62
 None
 0.80A 3v4tE-2x2iA:
0.6		 3v4tE-2x2iA:
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.
2x3c TOXIC EXTRACELLULAR
ENDOPEPTIDASE

(Aeromonas
salmonicida) 		PF14521
(Aspzincin_M35) 		3 GLN A 106
THR A 104
ASN A  41
 SO4  A1344 (-3.3A)
None
None
 0.68A 3v4tE-2x3cA:
undetectable		 3v4tE-2x3cA:
23.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xes PROTEIN PAT1 HOMOLOG
1

(Homo sapiens) 		PF09770
(PAT1) 		3 GLN A 713
THR A 715
ASN A 712
 None
 0.89A 3v4tE-2xesA:
undetectable		 3v4tE-2xesA:
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.
2zx0 CSL3

(Oncorhynchus
keta) 		PF02140
(Gal_Lectin) 		3 GLN A  43
THR A  45
ASN A  42
 None
 0.79A 3v4tE-2zx0A:
undetectable		 3v4tE-2zx0A:
17.62
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.
2zxq ENDO-ALPHA-N-ACETYLG
ALACTOSAMINIDASE

(Bifidobacterium
longum) 		PF12905
(Glyco_hydro_101)
PF17451
(Glyco_hyd_101C) 		3 GLN A 593
THR A 439
ASN A 437
 None
 0.90A 3v4tE-2zxqA:
0.8		 3v4tE-2zxqA:
15.67
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.
3ahi XYLULOSE
5-PHOSPHATE/FRUCTOSE
6-PHOSPHATE
PHOSPHOKETOLASE

(Bifidobacterium
breve) 		PF03894
(XFP)
PF09363
(XFP_C)
PF09364
(XFP_N) 		3 GLN A 546
THR A 740
ASN A 549
 None
 0.81A 3v4tE-3ahiA:
1.6		 3v4tE-3ahiA:
20.28
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.
3bpt 3-HYDROXYISOBUTYRYL-
COA HYDROLASE

(Homo sapiens) 		PF16113
(ECH_2) 		3 GLN A  67
THR A  61
ASN A  63
 None
 0.81A 3v4tE-3bptA:
0.4		 3v4tE-3bptA:
22.80
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.
3bvh FIBRINOGEN GAMMA
CHAIN

(Homo sapiens) 		PF00147
(Fibrinogen_C)
PF08702
(Fib_alpha) 		3 GLN C 210
THR C 314
ASN C 207
 None
 0.88A 3v4tE-3bvhC:
undetectable		 3v4tE-3bvhC:
20.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3e2v 3'-5'-EXONUCLEASE

(Saccharomyces
cerevisiae) 		PF01026
(TatD_DNase) 		3 GLN A 388
THR A 326
ASN A 385
 GOL  A 426 ( 4.9A)
None
GOL  A 426 (-3.4A)
 0.66A 3v4tE-3e2vA:
undetectable		 3v4tE-3e2vA:
21.81
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.
3fib FIBRINOGEN GAMMA
CHAIN RESIDUES

(Homo sapiens) 		PF00147
(Fibrinogen_C) 		3 GLN A 210
THR A 314
ASN A 207
 None
 0.88A 3v4tE-3fibA:
undetectable		 3v4tE-3fibA:
19.76
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.
3g06 SSPH2 (LEUCINE-RICH
REPEAT PROTEIN)

(Salmonella
enterica) 		PF14496
(NEL) 		3 GLN A 604
THR A 615
ASN A 599
 None
 0.89A 3v4tE-3g06A:
undetectable		 3v4tE-3g06A:
22.07
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.
3gbd SUCROSE ISOMERASE
SMUA FROM
PROTAMINOBACTER
RUBRUM

(Serratia
plymuthica) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		3 GLN A 422
THR A 427
ASN A 423
 None
 0.64A 3v4tE-3gbdA:
undetectable		 3v4tE-3gbdA:
21.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3goh ALCOHOL
DEHYDROGENASE,
ZINC-CONTAINING

(Shewanella
oneidensis) 		PF08240
(ADH_N) 		3 GLN A  36
THR A 311
ASN A 313
 None
 0.90A 3v4tE-3gohA:
undetectable		 3v4tE-3gohA:
23.26
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.
3h2t BASEPLATE STRUCTURAL
PROTEIN GP6

(Escherichia
virus T4) 		no annotation 3 GLN A 361
THR A 634
ASN A 456
 None
 0.86A 3v4tE-3h2tA:
undetectable		 3v4tE-3h2tA:
21.43
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.
3i0m DNA REPAIR AND
TELOMERE MAINTENANCE
PROTEIN NBS1

(Schizosaccharomyces
pombe) 		PF00498
(FHA) 		3 GLN A 156
THR A 162
ASN A 154
 None
 0.90A 3v4tE-3i0mA:
undetectable		 3v4tE-3i0mA:
21.56
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.
3o82 PEPTIDE ARYLATION
ENZYME

(Acinetobacter
baumannii) 		PF00501
(AMP-binding) 		3 GLN A 355
THR A 425
ASN A 429
 None
 0.86A 3v4tE-3o82A:
undetectable		 3v4tE-3o82A:
24.91
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.
3ros NAD-DEPENDENT
ALDEHYDE
DEHYDROGENASE

(Lactobacillus
acidophilus) 		PF00171
(Aldedh) 		3 GLN A 120
THR A 122
ASN A 448
 None
 0.89A 3v4tE-3rosA:
1.0		 3v4tE-3rosA:
24.16
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3swd UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE

(Escherichia
coli) 		PF00275
(EPSP_synthase) 		3 GLN A   7
THR A  10
ASN A 412
 None
 0.73A 3v4tE-3swdA:
68.5		 3v4tE-3swdA:
93.30
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.
3syj ADHESION AND
PENETRATION PROTEIN
AUTOTRANSPORTER

(Haemophilus
influenzae) 		PF02395
(Peptidase_S6)
PF03212
(Pertactin) 		3 GLN A  52
THR A  66
ASN A  53
 None
 0.82A 3v4tE-3syjA:
undetectable		 3v4tE-3syjA:
19.52
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.
3tsy FUSION PROTEIN
4-COUMARATE--COA
LIGASE 1,
RESVERATROL SYNTHASE

(Arabidopsis
thaliana;
Vitis vinifera) 		PF00195
(Chal_sti_synt_N)
PF00501
(AMP-binding)
PF02797
(Chal_sti_synt_C)
PF13193
(AMP-binding_C) 		3 GLN A 112
THR A 139
ASN A 113
 None
 0.84A 3v4tE-3tsyA:
undetectable		 3v4tE-3tsyA:
19.31
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.
3ttf TRANSCRIPTIONAL
REGULATORY PROTEIN

(Escherichia
coli) 		PF01300
(Sua5_yciO_yrdC)
PF07503
(zf-HYPF) 		3 GLN A 307
THR A 108
ASN A 304
 None
 0.91A 3v4tE-3ttfA:
undetectable		 3v4tE-3ttfA:
19.48
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.
3wp9 ICE-BINDING PROTEIN

(Colwellia sp.
SLW05) 		PF11999
(DUF3494) 		3 GLN A 210
THR A 195
ASN A 192
 None
 0.81A 3v4tE-3wp9A:
undetectable		 3v4tE-3wp9A:
20.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4b1l LEVANASE

(Bacillus
subtilis) 		PF06439
(DUF1080) 		3 GLN A 671
THR A 674
ASN A 672
 None
 0.84A 3v4tE-4b1lA:
undetectable		 3v4tE-4b1lA:
18.60
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.
4b1m LEVANASE

(Bacillus
subtilis) 		PF06439
(DUF1080) 		3 GLN A 671
THR A 674
ASN A 672
 None
 0.82A 3v4tE-4b1mA:
undetectable		 3v4tE-4b1mA:
16.44
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.
4bfi OX-2 MEMBRANE
GLYCOPROTEIN

(Mus musculus) 		PF00047
(ig) 		3 GLN B  35
THR B  47
ASN B  44
 None
 0.90A 3v4tE-4bfiB:
undetectable		 3v4tE-4bfiB:
19.76
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.
4fmz INTERNALIN

(Listeria
monocytogenes) 		PF12354
(Internalin_N)
PF12799
(LRR_4)
PF13855
(LRR_8) 		3 GLN A 140
THR A 143
ASN A 141
 None
 0.90A 3v4tE-4fmzA:
undetectable		 3v4tE-4fmzA:
21.87
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.
4ief GINGIPAIN R2
PRO-DOMAIN

(Porphyromonas
gingivalis) 		PF08126
(Propeptide_C25) 		3 GLN A  55
THR A  72
ASN A  53
 None
 0.87A 3v4tE-4iefA:
undetectable		 3v4tE-4iefA:
20.96
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.
4l3n S PROTEIN

(Middle East
respiratory
syndrome-related
coronavirus) 		PF09408
(Spike_rec_bind) 		3 GLN A 576
THR A 477
ASN A 475
 None
 0.90A 3v4tE-4l3nA:
undetectable		 3v4tE-4l3nA:
18.96
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.
4lla LEUKOCYTE
IMMUNOGLOBULIN-LIKE
RECEPTOR SUBFAMILY B
MEMBER 2

(Homo sapiens) 		PF13895
(Ig_2) 		3 GLN A  26
THR A  64
ASN A  62
 None
 0.85A 3v4tE-4llaA:
undetectable		 3v4tE-4llaA:
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.
4mt1 DRUG EFFLUX PROTEIN

(Neisseria
gonorrhoeae) 		PF00873
(ACR_tran) 		3 GLN A 574
THR A 584
ASN A 618
 None
 0.91A 3v4tE-4mt1A:
undetectable		 3v4tE-4mt1A:
18.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4n5u RECEPTOR-TYPE
TYROSINE-PROTEIN
PHOSPHATASE F

(Homo sapiens) 		PF00041
(fn3) 		3 GLN A 603
THR A 688
ASN A 636
 None
 0.72A 3v4tE-4n5uA:
undetectable		 3v4tE-4n5uA:
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.
4noi DNA-DIRECTED RNA
POLYMERASE SUBUNIT
ALPHA

(Campylobacter
jejuni) 		PF01000
(RNA_pol_A_bac)
PF01193
(RNA_pol_L) 		3 GLN A 214
THR A 208
ASN A 210
 None
 0.89A 3v4tE-4noiA:
undetectable		 3v4tE-4noiA:
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.
4og1 ENOYL-COA
HYDRATASE/ISOMERASE

(Novosphingobium
aromaticivorans) 		PF00378
(ECH_1) 		3 GLN A  97
THR A  89
ASN A  94
 None
 0.86A 3v4tE-4og1A:
1.7		 3v4tE-4og1A:
23.46
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.
4oht SUCCINATE-SEMIALDEHY
DE DEHYDROGENASE

(Streptococcus
pyogenes) 		PF00171
(Aldedh) 		3 GLN A 120
THR A 122
ASN A 448
 None
 0.86A 3v4tE-4ohtA:
0.3		 3v4tE-4ohtA:
24.85
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.
4pbx RECEPTOR-TYPE
TYROSINE-PROTEIN
PHOSPHATASE S

(Homo sapiens) 		PF00041
(fn3)
PF07679
(I-set) 		3 GLN A 411
THR A 492
ASN A 441
 None
 0.91A 3v4tE-4pbxA:
undetectable		 3v4tE-4pbxA:
23.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qtf L,D-TRANSPEPTIDASE
LDTB

(Mycobacterium
tuberculosis) 		PF03734
(YkuD) 		3 GLN A 140
THR A 138
ASN A 127
 None
 0.88A 3v4tE-4qtfA:
undetectable		 3v4tE-4qtfA:
22.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4r9i SERPIN-18

(Bombyx mori) 		PF00079
(Serpin) 		3 GLN A  98
THR A  21
ASN A  95
 None
 0.87A 3v4tE-4r9iA:
undetectable		 3v4tE-4r9iA:
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.
4uq9 CARBOHYDRATE BINDING
FAMILY 6

(Ruminiclostridium
thermocellum) 		PF17189
(Glyco_hydro_30C) 		3 GLN A 374
THR A 372
ASN A 338
 None
 0.75A 3v4tE-4uq9A:
undetectable		 3v4tE-4uq9A:
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.
4uqg DNA POLYMERASE

(Geobacillus
stearothermophilus) 		PF00476
(DNA_pol_A) 		3 GLN A 704
THR A 698
ASN A 700
 None
 0.89A 3v4tE-4uqgA:
undetectable		 3v4tE-4uqgA:
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.
4yfe RECEPTOR-TYPE
TYROSINE-PROTEIN
PHOSPHATASE DELTA

(Mus musculus) 		PF00041
(fn3) 		3 GLN A 422
THR A 503
ASN A 452
 None
 0.78A 3v4tE-4yfeA:
undetectable		 3v4tE-4yfeA:
19.95
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.
4yfg RECEPTOR-TYPE
TYROSINE-PROTEIN
PHOSPHATASE DELTA

(Mus musculus) 		no annotation 3 GLN B 412
THR B 493
ASN B 442
 None
 0.73A 3v4tE-4yfgB:
undetectable		 3v4tE-4yfgB:
22.39
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.
5aee ALPHA-GLUCOSIDASE
YIHQ

(Escherichia
coli) 		PF01055
(Glyco_hydro_31) 		3 GLN A 160
THR A 164
ASN A 158
 None
 0.88A 3v4tE-5aeeA:
undetectable		 3v4tE-5aeeA:
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.
5ejb FUSION GLYCOPROTEIN
F0

(Hendra
henipavirus) 		no annotation 3 GLN B 265
THR B 263
ASN B 224
 None
 0.86A 3v4tE-5ejbB:
undetectable		 3v4tE-5ejbB:
20.72
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.
5eno MULTIDRUG EFFLUX
PUMP SUBUNIT
ACRB,MULTIDRUG
EFFLUX PUMP SUBUNIT
ACRB

(Escherichia
coli) 		PF00873
(ACR_tran) 		3 GLN A 577
THR A 587
ASN A 623
 None
 0.74A 3v4tE-5enoA:
undetectable		 3v4tE-5enoA:
23.35
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.
5feb SODIUM CHANNEL
SUBUNIT BETA-2

(Homo sapiens) 		PF07686
(V-set) 		3 GLN A  82
THR A  68
ASN A  66
 None
 0.69A 3v4tE-5febA:
undetectable		 3v4tE-5febA:
14.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fq6 SUSC/RAGA FAMILY
TONB-LINKED OUTER
MEMBRANE PROTEIN

(Bacteroides
thetaiotaomicron) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		3 GLN B 446
THR B 444
ASN B 495
 None
 0.80A 3v4tE-5fq6B:
undetectable		 3v4tE-5fq6B:
17.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5g56 CARBOHYDRATE BINDING
FAMILY 6

(Ruminiclostridium
thermocellum) 		PF00150
(Cellulase)
PF03422
(CBM_6) 		3 GLN A 487
THR A 485
ASN A 444
 None
 0.80A 3v4tE-5g56A:
0.1		 3v4tE-5g56A:
19.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5g5g PUTATIVE XANTHINE
DEHYDROGENASE YAGS
FAD-BINDING SUBUNIT

(Escherichia
coli) 		PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2) 		3 GLN C 583
THR C 585
ASN C 442
 None
 0.75A 3v4tE-5g5gC:
undetectable		 3v4tE-5g5gC:
21.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5h3b UNCHARACTERIZED
PROTEIN HI_1552

(Haemophilus
influenzae) 		PF04301
(DUF452) 		3 GLN A 185
THR A  89
ASN A 182
 None
 0.83A 3v4tE-5h3bA:
undetectable		 3v4tE-5h3bA:
20.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hdh TOLL-LIKE RECEPTOR 8

(Homo sapiens) 		PF13855
(LRR_8) 		3 GLN A 284
THR A 287
ASN A 285
 NAG  A 901 ( 2.9A)
None
NAG  A 901 (-1.6A)
 0.82A 3v4tE-5hdhA:
undetectable		 3v4tE-5hdhA:
19.18
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.
5i2t PERIODIC TRYPTOPHAN
PROTEIN 2

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		3 GLN A 432
THR A 391
ASN A 434
 None
 0.88A 3v4tE-5i2tA:
undetectable		 3v4tE-5i2tA:
19.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5iq6 RNA DEPENDENT RNA
POLYMERASE

(Dengue virus) 		PF00972
(Flavi_NS5) 		3 GLN A 861
THR A 865
ASN A 862
 None
 0.88A 3v4tE-5iq6A:
undetectable		 3v4tE-5iq6A:
23.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5lj6 MACROLIDE EXPORT
ATP-BINDING/PERMEASE
PROTEIN MACB

(Aggregatibacter
actinomycetemcomitans) 		no annotation 3 GLN A 394
THR A 454
ASN A 396
 None
 0.63A 3v4tE-5lj6A:
undetectable		 3v4tE-5lj6A:
20.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5m5e CYTOKINE RECEPTOR
COMMON SUBUNIT GAMMA

(Homo sapiens) 		PF00041
(fn3)
PF09240
(IL6Ra-bind) 		3 GLN C  94
THR C  51
ASN C  49
 NAG  C 303 (-4.0A)
None
NAG  C 303 (-1.9A)
 0.89A 3v4tE-5m5eC:
undetectable		 3v4tE-5m5eC:
19.76
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.
5mqo NON-REDUCING END
BETA-L-ARABINOFURANO
SIDASE

(Bacteroides
thetaiotaomicron) 		PF07944
(Glyco_hydro_127) 		3 GLN A 505
THR A  47
ASN A 489
 None
 0.88A 3v4tE-5mqoA:
undetectable		 3v4tE-5mqoA:
22.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5oup PERFORIN-LIKE
PROTEIN 1

(Toxoplasma
gondii) 		no annotation 3 GLN A 641
THR A 647
ASN A 642
 None
 0.70A 3v4tE-5oupA:
undetectable		 3v4tE-5oupA:
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.
5szr PROTEIN PCDHGB2

(Mus musculus) 		PF00028
(Cadherin) 		3 GLN A 503
THR A 501
ASN A 515
 NAG  A 705 (-4.5A)
None
NAG  A 705 (-1.7A)
 0.74A 3v4tE-5szrA:
undetectable		 3v4tE-5szrA:
23.99
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.
5tf0 GLYCOSYL HYDROLASE
FAMILY 3 N-TERMINAL
DOMAIN PROTEIN

(Bacteroides
intestinalis) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		3 GLN A 612
THR A 563
ASN A 609
 None
 0.85A 3v4tE-5tf0A:
undetectable		 3v4tE-5tf0A:
20.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5v5x MCG133388, ISOFORM
CRA_Y

(Mus musculus) 		no annotation 3 GLN A 501
THR A 499
ASN A 513
 None
None
NAG  A 716 (-1.8A)
 0.76A 3v4tE-5v5xA:
undetectable		 3v4tE-5v5xA:
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.
5x59 S PROTEIN

(Middle East
respiratory
syndrome-related
coronavirus) 		PF01601
(Corona_S2)
PF09408
(Spike_rec_bind) 		3 GLN A 576
THR A 477
ASN A 475
 None
 0.91A 3v4tE-5x59A:
undetectable		 3v4tE-5x59A:
14.68
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.
5xgr SPIKE PROTEIN S1

(Pipistrellus
bat coronavirus
HKU5) 		PF09408
(Spike_rec_bind) 		3 GLN A 186
THR A  97
ASN A  95
 None
 0.83A 3v4tE-5xgrA:
undetectable		 3v4tE-5xgrA:
18.07
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.
5xi8 BETA-BARREL
ASSEMBLY-ENHANCING
PROTEASE

(Escherichia
coli) 		no annotation 3 GLN A 388
THR A 350
ASN A 384
 None
 0.81A 3v4tE-5xi8A:
undetectable		 3v4tE-5xi8A:
19.66
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.
5xxo PERIPLASMIC
BETA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron) 		no annotation 3 GLN A 610
THR A 561
ASN A 607
 None
 0.89A 3v4tE-5xxoA:
undetectable		 3v4tE-5xxoA:
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.
5y4k DMSP LYASE DDDY

(Acinetobacter
bereziniae) 		no annotation 3 GLN A 326
THR A  75
ASN A 327
 None
 0.87A 3v4tE-5y4kA:
undetectable		 3v4tE-5y4kA:
21.12
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.
5y6r GENOME POLYPROTEIN

(Pestivirus C) 		no annotation 3 GLN A 352
THR A 354
ASN A 178
 None
 0.79A 3v4tE-5y6rA:
undetectable		 3v4tE-5y6rA:
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.
5zln TOLL-LIKE RECEPTOR 9

(Mus musculus) 		no annotation 3 GLN A 331
THR A 334
ASN A 332
 NAG  A 908 (-3.6A)
None
NAG  A 908 (-1.9A)
 0.86A 3v4tE-5zlnA:
undetectable		 3v4tE-5zlnA:
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.
6cg0 V(D)J
RECOMBINATION-ACTIVA
TING PROTEIN 2

(Mus musculus) 		no annotation 3 GLN D   4
THR D   7
ASN D  53
 None
 0.87A 3v4tE-6cg0D:
undetectable		 3v4tE-6cg0D:
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.
6cim V(D)J
RECOMBINATION-ACTIVA
TING PROTEIN 2

(Mus musculus) 		no annotation 3 GLN B   4
THR B   7
ASN B  53
 None
 0.86A 3v4tE-6cimB:
undetectable		 3v4tE-6cimB:
undetectable