SIMILAR PATTERNS OF AMINO ACIDS FOR 4A6E_A_SAMA1349_1

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.
1cbg CYANOGENIC
BETA-GLUCOSIDASE

(Trifolium
repens) 		PF00232
(Glyco_hydro_1) 		3 TYR A 383
ASP A 276
ASP A 269
 None
 0.49A 4a6eA-1cbgA:
undetectable		 4a6eA-1cbgA:
21.31
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.
1cli PROTEIN
(PHOSPHORIBOSYL-AMIN
OIMIDAZOLE
SYNTHETASE)

(Escherichia
coli) 		PF00586
(AIRS)
PF02769
(AIRS_C) 		3 TYR A 194
ASP A  86
ASP A  65
 None
 0.88A 4a6eA-1cliA:
undetectable		 4a6eA-1cliA:
22.68
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.
1p4t OUTER MEMBRANE
PROTEIN NSPA

(Neisseria
meningitidis) 		PF02462
(Opacity) 		3 TYR A  62
ASP A  99
ASP A  58
 None
 0.88A 4a6eA-1p4tA:
undetectable		 4a6eA-1p4tA:
17.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ps9 2,4-DIENOYL-COA
REDUCTASE

(Escherichia
coli) 		PF00724
(Oxidored_FMN)
PF07992
(Pyr_redox_2) 		3 TYR A   2
ASP A 291
ASP A 316
 None
 0.88A 4a6eA-1ps9A:
2.8		 4a6eA-1ps9A:
20.39
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.
1qgu PROTEIN (NITROGENASE
MOLYBDENUM IRON
PROTEIN)

(Klebsiella
pneumoniae) 		PF00148
(Oxidored_nitro) 		3 TYR A 352
ASP A 400
ASP A 384
 None
 0.70A 4a6eA-1qguA:
undetectable		 4a6eA-1qguA:
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.
1qq0 CARBONIC ANHYDRASE

(Methanosarcina
thermophila) 		PF00132
(Hexapep)
PF14602
(Hexapep_2) 		3 TYR A 108
ASP A 129
ASP A 163
 None
 0.79A 4a6eA-1qq0A:
undetectable		 4a6eA-1qq0A:
18.53
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.
1r62 NITROGEN REGULATION
PROTEIN NR(II)

(Escherichia
coli) 		PF02518
(HATPase_c) 		3 TYR A 344
ASP A 284
ASP A 225
 None
 0.62A 4a6eA-1r62A:
undetectable		 4a6eA-1r62A:
18.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1uan HYPOTHETICAL PROTEIN
TT1542

(Thermus
thermophilus) 		PF02585
(PIG-L) 		3 TYR A 173
ASP A  36
ASP A  74
 None
 0.88A 4a6eA-1uanA:
2.6		 4a6eA-1uanA:
21.08
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.
1vkd CONSERVED
HYPOTHETICAL PROTEIN
TM1225

(Thermotoga
maritima) 		PF04041
(Glyco_hydro_130) 		3 TYR A 117
ASP A 114
ASP A 136
 None
 0.74A 4a6eA-1vkdA:
undetectable		 4a6eA-1vkdA:
19.80
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.
1wj5 HYPOTHETICAL PROTEIN
(RIKEN CDNA
0610009H20)

(Mus musculus) 		PF09170
(STN1_2) 		3 TYR A 105
ASP A  97
ASP A 101
 None
 0.80A 4a6eA-1wj5A:
3.3		 4a6eA-1wj5A:
19.14
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.
1xmb IAA-AMINO ACID
HYDROLASE HOMOLOG 2

(Arabidopsis
thaliana) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		3 TYR A 401
ASP A 140
ASP A 114
 None
 0.88A 4a6eA-1xmbA:
undetectable		 4a6eA-1xmbA:
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.
1xmx HYPOTHETICAL PROTEIN
VC1899

(Vibrio cholerae) 		PF09002
(DUF1887) 		3 TYR A 145
ASP A  11
ASP A 328
 None
 0.58A 4a6eA-1xmxA:
2.8		 4a6eA-1xmxA:
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.
1yby TRANSLATION
ELONGATION FACTOR P

(Ruminiclostridium
thermocellum) 		PF01132
(EFP)
PF08207
(EFP_N)
PF09285
(Elong-fact-P_C) 		3 TYR A  81
ASP A  78
ASP A  96
 None
 0.84A 4a6eA-1ybyA:
undetectable		 4a6eA-1ybyA:
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.
2ar1 HYPOTHETICAL PROTEIN

(Leishmania
major) 		PF01878
(EVE) 		3 TYR A  42
ASP A  94
ASP A  81
 None
 0.81A 4a6eA-2ar1A:
undetectable		 4a6eA-2ar1A:
19.89
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.
2b67 COG0778:
NITROREDUCTASE

(Streptococcus
pneumoniae) 		PF00881
(Nitroreductase) 		3 TYR A 181
ASP A  25
ASP A 145
 None
 0.72A 4a6eA-2b67A:
undetectable		 4a6eA-2b67A:
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.
2bra NEDD9 INTERACTING
PROTEIN WITH
CALPONIN HOMOLOGY
AND LIM DOMAINS

(Mus musculus) 		PF01494
(FAD_binding_3) 		3 TYR A 144
ASP A 289
ASP A 153
 None
 0.83A 4a6eA-2braA:
undetectable		 4a6eA-2braA:
23.27
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.
2cug MKIAA0962 PROTEIN

(Mus musculus) 		PF00226
(DnaJ) 		3 TYR A  78
ASP A  18
ASP A  16
 None
 0.85A 4a6eA-2cugA:
undetectable		 4a6eA-2cugA:
14.51
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.
2edz PDZ
DOMAIN-CONTAINING
PROTEIN 1

(Mus musculus) 		PF00595
(PDZ) 		3 TYR A  99
ASP A  71
ASP A 108
 None
 0.59A 4a6eA-2edzA:
undetectable		 4a6eA-2edzA:
16.72
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.
2hcz BETA-EXPANSIN 1A

(Zea mays) 		PF01357
(Pollen_allerg_1)
PF03330
(DPBB_1) 		3 TYR X  74
ASP X 173
ASP X 170
 None
 0.73A 4a6eA-2hczX:
undetectable		 4a6eA-2hczX:
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.
2jf7 STRICTOSIDINE-O-BETA
-D-GLUCOSIDASE

(Rauvolfia
serpentina) 		PF00232
(Glyco_hydro_1) 		3 TYR A 402
ASP A 295
ASP A 288
 None
 0.60A 4a6eA-2jf7A:
undetectable		 4a6eA-2jf7A:
20.98
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.
2l8a ENDOGLUCANASE

(Bacillus
subtilis) 		PF00942
(CBM_3) 		3 TYR A 393
ASP A 469
ASP A 431
 None
 0.83A 4a6eA-2l8aA:
undetectable		 4a6eA-2l8aA:
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.
2nef NEGATIVE FACTOR
(F-PROTEIN)

(Human
immunodeficiency
virus 1) 		PF00469
(F-protein) 		3 TYR A 127
ASP A 111
ASP A 123
 None
 0.73A 4a6eA-2nefA:
undetectable		 4a6eA-2nefA:
16.08
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.
2oaj PROTEIN SNI1

(Saccharomyces
cerevisiae) 		PF08596
(Lgl_C) 		3 TYR A 131
ASP A 171
ASP A 167
 None
 0.88A 4a6eA-2oajA:
undetectable		 4a6eA-2oajA:
16.03
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.
2p91 ENOYL-[ACYL-CARRIER-
PROTEIN] REDUCTASE
[NADH]

(Aquifex
aeolicus) 		PF13561
(adh_short_C2) 		3 TYR A 136
ASP A  83
ASP A  79
 None
 0.87A 4a6eA-2p91A:
5.2		 4a6eA-2p91A:
24.51
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.
2pge MENC

(Desulfotalea
psychrophila) 		PF13378
(MR_MLE_C) 		3 TYR A 300
ASP A 108
ASP A 102
 None
 0.81A 4a6eA-2pgeA:
undetectable		 4a6eA-2pgeA:
23.68
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.
2psy KALLIKREIN-5

(Homo sapiens) 		PF00089
(Trypsin) 		3 TYR A 228
ASP A 189
ASP A 185
 None
 0.88A 4a6eA-2psyA:
undetectable		 4a6eA-2psyA:
21.51
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.
2qvp UNCHARACTERIZED
PROTEIN

(Shewanella
amazonensis) 		PF04952
(AstE_AspA) 		3 TYR A 177
ASP A 211
ASP A 225
 None
 0.88A 4a6eA-2qvpA:
undetectable		 4a6eA-2qvpA:
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.
2r26 CITRATE SYNTHASE

(Thermoplasma
acidophilum) 		PF00285
(Citrate_synt) 		3 TYR A  56
ASP A 122
ASP A 118
 None
 0.74A 4a6eA-2r26A:
undetectable		 4a6eA-2r26A:
21.01
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.
2yw9 ENOYL-[ACYL CARRIER
PROTEIN] REDUCTASE

(Thermus
thermophilus) 		PF13561
(adh_short_C2) 		3 TYR A 123
ASP A  70
ASP A  66
 None
 0.80A 4a6eA-2yw9A:
5.5		 4a6eA-2yw9A:
22.53
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.
3bvm ENTEROTOXIN TYPE C-3

(Staphylococcus
aureus) 		PF01123
(Stap_Strp_toxin)
PF02876
(Stap_Strp_tox_C) 		3 TYR A  90
ASP A  55
ASP A  62
 None
 0.86A 4a6eA-3bvmA:
undetectable		 4a6eA-3bvmA:
20.90
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.
3cf4 ACETYL-COA
DECARBOXYLASE/SYNTHA
SE ALPHA SUBUNIT

(Methanosarcina
barkeri) 		PF03063
(Prismane) 		3 TYR A 378
ASP A 320
ASP A 282
 None
 0.85A 4a6eA-3cf4A:
2.6		 4a6eA-3cf4A:
17.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cgd PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE,
CLASS I

(Bacillus
anthracis) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		3 TYR A 278
ASP A 316
ASP A  23
 None
 0.72A 4a6eA-3cgdA:
3.7		 4a6eA-3cgdA:
21.83
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.
3d46 PUTATIVE GALACTONATE
DEHYDRATASE

(Salmonella
enterica) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 TYR A 235
ASP A 206
ASP A 226
 None
None
MG  A 501 ( 2.5A)
 0.78A 4a6eA-3d46A:
undetectable		 4a6eA-3d46A:
21.48
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.
3ek2 ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(NADH)

(Burkholderia
pseudomallei) 		PF13561
(adh_short_C2) 		3 TYR A 122
ASP A  68
ASP A  64
 None
 0.86A 4a6eA-3ek2A:
5.1		 4a6eA-3ek2A:
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.
3ezy DEHYDROGENASE

(Thermotoga
maritima) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		3 TYR A 279
ASP A 152
ASP A 236
 None
 0.70A 4a6eA-3ezyA:
3.8		 4a6eA-3ezyA:
22.53
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.
3hsk ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE

(Candida
albicans) 		PF01118
(Semialdhyde_dh)
PF02774
(Semialdhyde_dhC) 		3 TYR A 111
ASP A  92
ASP A  88
 None
 0.85A 4a6eA-3hskA:
undetectable		 4a6eA-3hskA:
22.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3i04 CARBON MONOXIDE
DEHYDROGENASE/ACETYL
-COA SYNTHASE
SUBUNIT BETA

(Moorella
thermoacetica) 		PF03063
(Prismane) 		3 TYR A 242
ASP A 558
ASP A 552
 None
 0.75A 4a6eA-3i04A:
undetectable		 4a6eA-3i04A:
17.99
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.
3iuu PUTATIVE
METALLOPEPTIDASE

(Chelativorans
sp. BNC1) 		PF07171
(MlrC_C)
PF07364
(DUF1485) 		3 TYR A 332
ASP A  27
ASP A 391
 None
 0.68A 4a6eA-3iuuA:
2.9		 4a6eA-3iuuA:
23.05
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.
3iz3 VIRAL STRUCTURAL
PROTEIN 5

(Cypovirus 1) 		no annotation 3 TYR D 112
ASP D 108
ASP D  70
 None
 0.78A 4a6eA-3iz3D:
undetectable		 4a6eA-3iz3D:
21.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kzw CYTOSOL
AMINOPEPTIDASE

(Staphylococcus
aureus) 		PF00883
(Peptidase_M17)
PF02789
(Peptidase_M17_N) 		3 TYR A 354
ASP A 211
ASP A 214
 None
 0.79A 4a6eA-3kzwA:
undetectable		 4a6eA-3kzwA:
19.81
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.
3nbm PTS SYSTEM,
LACTOSE-SPECIFIC
IIBC COMPONENTS

(Streptococcus
pneumoniae) 		PF02302
(PTS_IIB) 		3 TYR A 493
ASP A 522
ASP A 498
 None
 0.79A 4a6eA-3nbmA:
undetectable		 4a6eA-3nbmA:
15.38
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.
3nva CTP SYNTHASE

(Sulfolobus
solfataricus) 		PF00117
(GATase)
PF06418
(CTP_synth_N) 		3 TYR A  76
ASP A  70
ASP A 307
 None
 0.84A 4a6eA-3nvaA:
undetectable		 4a6eA-3nvaA:
19.71
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.
3o8o 6-PHOSPHOFRUCTOKINAS
E SUBUNIT ALPHA
6-PHOSPHOFRUCTOKINAS
E SUBUNIT BETA

(Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae) 		PF00365
(PFK)
PF00365
(PFK) 		3 TYR A 381
ASP B 365
ASP B 372
 None
 0.88A 4a6eA-3o8oA:
undetectable		 4a6eA-3o8oA:
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.
3otm CARBONIC ANHYDRASE

(Methanosarcina
thermophila) 		PF00132
(Hexapep)
PF14602
(Hexapep_2) 		3 TYR A 108
ASP A 129
ASP A 163
 None
 0.81A 4a6eA-3otmA:
undetectable		 4a6eA-3otmA:
18.70
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.
3pei CYTOSOL
AMINOPEPTIDASE

(Francisella
tularensis) 		PF00883
(Peptidase_M17)
PF02789
(Peptidase_M17_N) 		3 TYR A 345
ASP A 202
ASP A 205
 None
 0.86A 4a6eA-3peiA:
undetectable		 4a6eA-3peiA:
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.
3ptk BETA-GLUCOSIDASE
OS4BGLU12

(Oryza sativa) 		PF00232
(Glyco_hydro_1) 		3 TYR A 379
ASP A 272
ASP A 265
 None
 0.49A 4a6eA-3ptkA:
undetectable		 4a6eA-3ptkA:
22.14
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.
3sqi KLLA0E03807P

(Kluyveromyces
lactis) 		PF16787
(NDC10_II) 		3 TYR A  53
ASP A  59
ASP A  63
 None
 0.86A 4a6eA-3sqiA:
undetectable		 4a6eA-3sqiA:
21.58
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.
3t79 KLLA0E03807P

(Kluyveromyces
lactis) 		PF16787
(NDC10_II) 		3 TYR A  53
ASP A  59
ASP A  63
 None
 0.87A 4a6eA-3t79A:
undetectable		 4a6eA-3t79A:
21.49
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.
3t8l ADENINE DEAMINASE 2

(Agrobacterium
fabrum) 		PF01979
(Amidohydro_1)
PF13382
(Adenine_deam_C) 		3 TYR A 105
ASP A  90
ASP A 120
 None
 0.87A 4a6eA-3t8lA:
undetectable		 4a6eA-3t8lA:
22.29
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.
3v9f TWO-COMPONENT SYSTEM
SENSOR HISTIDINE
KINASE/RESPONSE
REGULATOR, HYBRID
(ONE-COMPONENT
SYSTEM)

(Bacteroides
thetaiotaomicron) 		PF07494
(Reg_prop)
PF07495
(Y_Y_Y) 		3 TYR A 448
ASP A 432
ASP A 388
 None
 0.79A 4a6eA-3v9fA:
undetectable		 4a6eA-3v9fA:
16.88
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.
3vbo GENOME POLYPROTEIN,
CAPSID PROTEIN VP2

(Enterovirus A) 		PF00073
(Rhv) 		3 TYR B 217
ASP B 153
ASP B 225
 None
 0.78A 4a6eA-3vboB:
undetectable		 4a6eA-3vboB:
21.49
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.
3vuu ERYTHROCYTE MEMBRANE
PROTEIN, PUTATIVE

(Plasmodium
falciparum) 		PF05424
(Duffy_binding) 		3 TYR A 237
ASP A 219
ASP A 229
 None
 0.63A 4a6eA-3vuuA:
undetectable		 4a6eA-3vuuA:
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.
3vuv ERYTHROCYTE MEMBRANE
PROTEIN, PUTATIVE

(Plasmodium
falciparum) 		PF05424
(Duffy_binding) 		3 TYR A 237
ASP A 219
ASP A 229
 None
 0.68A 4a6eA-3vuvA:
undetectable		 4a6eA-3vuvA:
21.78
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.
3wq4 BETA-PRIMEVEROSIDASE

(Camellia
sinensis) 		PF00232
(Glyco_hydro_1) 		3 TYR A 402
ASP A 295
ASP A 288
 None
 0.77A 4a6eA-3wq4A:
undetectable		 4a6eA-3wq4A:
21.48
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4a6e HYDROXYINDOLE
O-METHYLTRANSFERASE

(Homo sapiens) 		PF00891
(Methyltransf_2)
PF16864
(Dimerisation2) 		3 TYR A 147
ASP A 210
ASP A 236
 SAM  A1349 (-4.7A)
SAM  A1349 (-2.9A)
SAM  A1349 (-3.5A)
 0.01A 4a6eA-4a6eA:
55.0		 4a6eA-4a6eA:
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.
4b28 METALLOPEPTIDASE,
FAMILY M24, PUTATIVE

(Roseobacter
denitrificans) 		PF00557
(Peptidase_M24) 		3 TYR A 366
ASP A 307
ASP A 422
 None
FE  A1446 ( 2.2A)
None
 0.77A 4a6eA-4b28A:
undetectable		 4a6eA-4b28A:
22.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4b9g CS6 FIMBRIAL SUBUNIT
B, CS6 FIMBRIAL
SUBUNIT A

(Escherichia
coli) 		PF16831
(CssAB) 		3 TYR A 130
ASP A  31
ASP A  29
 None
 0.74A 4a6eA-4b9gA:
undetectable		 4a6eA-4b9gA:
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.
4c1s GLYCOSIDE HYDROLASE
FAMILY 76
MANNOSIDASE

(Bacteroides
thetaiotaomicron) 		PF03663
(Glyco_hydro_76) 		3 TYR A 407
ASP A 348
ASP A 341
 None
 0.79A 4a6eA-4c1sA:
undetectable		 4a6eA-4c1sA:
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.
4d8m PESTICIDAL CRYSTAL
PROTEIN CRY5BA

(Bacillus
thuringiensis) 		PF03944
(Endotoxin_C)
PF03945
(Endotoxin_N) 		3 TYR A 264
ASP A 198
ASP A 191
 None
 0.79A 4a6eA-4d8mA:
undetectable		 4a6eA-4d8mA:
20.73
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.
4da5 CHOLINE KINASE ALPHA

(Homo sapiens) 		PF01633
(Choline_kinase) 		3 TYR A 280
ASP A 446
ASP A 439
 None
 0.82A 4a6eA-4da5A:
undetectable		 4a6eA-4da5A:
20.78
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.
4eca L-ASPARAGINE
AMIDOHYDROLASE

(Escherichia
coli) 		PF00710
(Asparaginase) 		3 TYR A  25
ASP A  90
ASP A  60
 AEI  A  12 (-4.0A)
AEI  A  12 (-2.7A)
None
 0.88A 4a6eA-4ecaA:
undetectable		 4a6eA-4ecaA:
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.
4epu ANGIOPOIETIN-1

(Homo sapiens) 		PF00147
(Fibrinogen_C) 		3 TYR A 404
ASP A 424
ASP A 450
 None
 0.69A 4a6eA-4epuA:
undetectable		 4a6eA-4epuA:
21.29
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.
4hoo LYSINE-SPECIFIC
DEMETHYLASE 4D

(Homo sapiens) 		PF02373
(JmjC)
PF02375
(JmjN) 		3 TYR A 279
ASP A 197
ASP A 195
 None
 0.84A 4a6eA-4hooA:
undetectable		 4a6eA-4hooA:
19.42
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.
4mrm GAMMA-AMINOBUTYRIC
ACID TYPE B RECEPTOR
SUBUNIT 2

(Homo sapiens) 		PF01094
(ANF_receptor) 		3 TYR B 277
ASP B 247
ASP B 228
 None
 0.85A 4a6eA-4mrmB:
undetectable		 4a6eA-4mrmB:
21.17
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.
4nh0 CELL
DIVISIONFTSK/SPOIIIE

(Thermomonospora
curvata) 		PF01580
(FtsK_SpoIIIE) 		3 TYR A 928
ASP A 931
ASP A 935
 None
 0.77A 4a6eA-4nh0A:
undetectable		 4a6eA-4nh0A:
16.62
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.
4nov XYLOSIDASE/ARABINOFU
RANOSIDASE XSA43E

(Butyrivibrio
proteoclasticus) 		PF04616
(Glyco_hydro_43) 		3 TYR A  35
ASP A  32
ASP A  62
 None
 0.44A 4a6eA-4novA:
undetectable		 4a6eA-4novA:
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.
4o2w E3 UBIQUITIN-PROTEIN
LIGASE HERC1

(Homo sapiens) 		PF00415
(RCC1) 		3 TYR A4111
ASP A4108
ASP A4120
 None
 0.87A 4a6eA-4o2wA:
undetectable		 4a6eA-4o2wA:
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.
4ofs PROBABLE LIPOAMIDE
ACYLTRANSFERASE

(Thermoplasma
acidophilum) 		PF00198
(2-oxoacid_dh) 		3 TYR A  88
ASP A 194
ASP A 199
 None
 0.84A 4a6eA-4ofsA:
undetectable		 4a6eA-4ofsA:
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.
4ox3 PUTATIVE
CARBOXYPEPTIDASE
YODJ

(Bacillus
subtilis) 		PF02557
(VanY) 		3 TYR A 179
ASP A 162
ASP A 155
 None
 0.71A 4a6eA-4ox3A:
undetectable		 4a6eA-4ox3A:
20.79
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.
4psw HISTONE
ACETYLTRANSFERASE
TYPE B CATALYTIC
SUBUNIT

(Saccharomyces
cerevisiae) 		PF00583
(Acetyltransf_1)
PF10394
(Hat1_N) 		3 TYR A  49
ASP A  82
ASP A  78
 None
 0.84A 4a6eA-4pswA:
2.0		 4a6eA-4pswA:
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.
4qtb MITOGEN-ACTIVATED
PROTEIN KINASE 3

(Homo sapiens) 		PF00069
(Pkinase) 		3 TYR A 333
ASP A 141
ASP A 300
 None
EDO  A 407 (-4.3A)
None
 0.84A 4a6eA-4qtbA:
undetectable		 4a6eA-4qtbA:
20.51
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.
4ru0 PUTATIVE
BRANCHED-CHAIN AMINO
ACID ABC
TRANSPORTER,
PERIPLASMIC
BRANCHED-CHAIN AMINO
ACID-BINDING PROTEIN

(Pseudomonas
protegens) 		PF13458
(Peripla_BP_6) 		3 TYR A 323
ASP A 272
ASP A 264
 None
 0.74A 4a6eA-4ru0A:
undetectable		 4a6eA-4ru0A:
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.
4rzz PEPTIDASE M24

(Ruegeria
lacuscaerulensis) 		PF00557
(Peptidase_M24) 		3 TYR A 366
ASP A 307
ASP A 422
 PO4  A 503 (-4.5A)
FE  A 502 (-2.3A)
None
 0.74A 4a6eA-4rzzA:
undetectable		 4a6eA-4rzzA:
21.54
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.
4tqg PUTATIVE
DTDP-D-GLUCOSE 4
6-DEHYDRATASE

(Megavirus
chiliensis) 		PF02719
(Polysacc_synt_2) 		3 TYR A 316
ASP A 210
ASP A 281
 None
 0.88A 4a6eA-4tqgA:
5.0		 4a6eA-4tqgA:
21.48
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.
4up7 LYSINE--TRNA LIGASE

(Entamoeba
histolytica) 		PF00152
(tRNA-synt_2)
PF01336
(tRNA_anti-codon) 		3 TYR A 231
ASP A 516
ASP A 521
 None
 0.77A 4a6eA-4up7A:
undetectable		 4a6eA-4up7A:
19.07
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.
4v20 CELLOBIOHYDROLASE

(Aspergillus
fumigatus) 		PF00840
(Glyco_hydro_7) 		3 TYR A 247
ASP A 173
ASP A 257
 None
 0.80A 4a6eA-4v20A:
undetectable		 4a6eA-4v20A:
20.92
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.
4wn9 NITROGENASE
MOLYBDENUM-IRON
PROTEIN ALPHA CHAIN

(Clostridium
pasteurianum) 		PF00148
(Oxidored_nitro) 		3 TYR A 342
ASP A 442
ASP A 374
 None
 0.70A 4a6eA-4wn9A:
undetectable		 4a6eA-4wn9A:
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.
4wu0 SIMILAR TO YTER
(BACILUS SUBTILIS)

(Clostridium
acetobutylicum) 		PF07470
(Glyco_hydro_88) 		3 TYR A  95
ASP A  55
ASP A  48
 None
 0.83A 4a6eA-4wu0A:
undetectable		 4a6eA-4wu0A:
20.84
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.
4wzb NITROGENASE
MOLYBDENUM-IRON
PROTEIN ALPHA CHAIN

(Azotobacter
vinelandii) 		PF00148
(Oxidored_nitro) 		3 TYR A 354
ASP A 402
ASP A 386
 None
 0.71A 4a6eA-4wzbA:
2.2		 4a6eA-4wzbA:
21.26
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.
4xgc ORIGIN RECOGNITION
COMPLEX SUBUNIT 1

(Drosophila
melanogaster) 		PF00004
(AAA)
PF09079
(Cdc6_C) 		3 TYR A 595
ASP A 687
ASP A 684
 None
 0.73A 4a6eA-4xgcA:
4.4		 4a6eA-4xgcA:
22.35
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.
4xrl MITOGEN-ACTIVATED
PROTEIN KINASE 1

(Rattus
norvegicus) 		PF00069
(Pkinase) 		3 TYR A 314
ASP A 122
ASP A 281
 None
 0.88A 4a6eA-4xrlA:
undetectable		 4a6eA-4xrlA:
21.88
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.
4yvs CAPSID PROTEIN VP0

(Enterovirus A) 		PF00073
(Rhv) 		3 TYR C 148
ASP C  84
ASP C 156
 None
 0.81A 4a6eA-4yvsC:
undetectable		 4a6eA-4yvsC:
21.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zju ENOYL-[ACYL-CARRIER-
PROTEIN] REDUCTASE
[NADH]

(Acinetobacter
baumannii) 		PF13561
(adh_short_C2) 		3 TYR A 124
ASP A  70
ASP A  66
 None
None
NAD  A 300 (-3.7A)
 0.83A 4a6eA-4zjuA:
5.0		 4a6eA-4zjuA:
21.01
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.
5awp ISOMALTODEXTRANASE

(Arthrobacter
globiformis) 		no annotation 3 TYR A  36
ASP A 310
ASP A 258
 None
 0.65A 4a6eA-5awpA:
undetectable		 4a6eA-5awpA:
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.
5fq6 PUTATIVE LIPOPROTEIN

(Bacteroides
thetaiotaomicron) 		PF12771
(SusD-like_2) 		3 TYR A 388
ASP A 195
ASP A 478
 None
 0.82A 4a6eA-5fq6A:
undetectable		 4a6eA-5fq6A:
22.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5inw PUTATIVE
ANGIOTENSINOGEN

(Lampetra
fluviatilis) 		PF00079
(Serpin) 		3 TYR A 374
ASP A 390
ASP A 236
 None
 0.76A 4a6eA-5inwA:
undetectable		 4a6eA-5inwA:
22.36
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.
5j6b ALDEHYDE
DEHYDROGENASE

(Burkholderia
thailandensis) 		PF00171
(Aldedh) 		3 TYR A   8
ASP A  39
ASP A  44
 None
 0.73A 4a6eA-5j6bA:
3.6		 4a6eA-5j6bA:
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.
5jry NAD-DEPENDENT
ALDEHYDE
DEHYDROGENASE

(Burkholderia
multivorans) 		PF00171
(Aldedh) 		3 TYR A   8
ASP A  39
ASP A  44
 None
 0.74A 4a6eA-5jryA:
3.5		 4a6eA-5jryA:
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.
5kj2 HISTONE
ACETYLTRANSFERASE
P300

(Homo sapiens) 		PF08214
(HAT_KAT11) 		3 TYR A1397
ASP A1628
ASP A1625
 None
 0.64A 4a6eA-5kj2A:
undetectable		 4a6eA-5kj2A:
20.88
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.
5koj NITROGENASE PROTEIN
ALPHA CHAIN

(Gluconacetobacter
diazotrophicus) 		PF00148
(Oxidored_nitro) 		3 TYR A 370
ASP A 418
ASP A 402
 None
 0.68A 4a6eA-5kojA:
undetectable		 4a6eA-5kojA:
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.
5lx8 SUSD HOMOLOG

(Bacteroides
thetaiotaomicron) 		PF07980
(SusD_RagB)
PF14322
(SusD-like_3) 		3 TYR A 254
ASP A 201
ASP A 194
 None
 0.76A 4a6eA-5lx8A:
undetectable		 4a6eA-5lx8A:
19.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mdn DNA POLYMERASE

(Pyrobaculum
calidifontis) 		PF00136
(DNA_pol_B)
PF03104
(DNA_pol_B_exo1) 		3 TYR A 558
ASP A 562
ASP A 590
 None
 0.81A 4a6eA-5mdnA:
undetectable		 4a6eA-5mdnA:
18.53
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.
5nd5 TRANSKETOLASE

(Chlamydomonas
reinhardtii) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		3 TYR A 335
ASP A 343
ASP A  53
 None
 0.88A 4a6eA-5nd5A:
3.5		 4a6eA-5nd5A:
18.42
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.
5u1s SEPARIN

(Saccharomyces
cerevisiae) 		PF03568
(Peptidase_C50) 		3 TYR A1361
ASP A1350
ASP A1343
 None
 0.85A 4a6eA-5u1sA:
undetectable		 4a6eA-5u1sA:
11.78
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.
5u7g CREB-BINDING PROTEIN

(Mus musculus) 		PF00439
(Bromodomain)
PF00569
(ZZ)
PF06001
(DUF902)
PF08214
(HAT_KAT11) 		3 TYR A1434
ASP A1666
ASP A1663
 None
 0.58A 4a6eA-5u7gA:
undetectable		 4a6eA-5u7gA:
19.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5u7x NOD FACTOR BINDING
LECTIN-NUCLEOTIDE
PHOSPHOHYDROLASE

(Vigna
unguiculata) 		PF01150
(GDA1_CD39) 		3 TYR F 361
ASP F 366
ASP F 261
 None
 0.85A 4a6eA-5u7xF:
undetectable		 4a6eA-5u7xF:
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.
5vk4 PHOSPHORIBOSYLFORMYL
GLYCINAMIDINE
CYCLO-LIGASE

(Neisseria
gonorrhoeae) 		PF00586
(AIRS)
PF02769
(AIRS_C) 		3 TYR A 192
ASP A  84
ASP A  63
 None
None
MG  A 402 ( 3.6A)
 0.82A 4a6eA-5vk4A:
undetectable		 4a6eA-5vk4A:
24.40
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.
5xnc -

(-) 		no annotation 3 TYR A 295
ASP A 126
ASP A 344
 None
N4P  A 402 ( 3.6A)
None
 0.88A 4a6eA-5xncA:
8.8		 4a6eA-5xncA:
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.
5xyn SUPPRESSOR OF HU
SENSITIVITY INVOLVED
IN RECOMBINATION
PROTEIN 1

(Saccharomyces
cerevisiae) 		no annotation 3 TYR C  94
ASP C  98
ASP C  31
 None
 0.86A 4a6eA-5xynC:
undetectable		 4a6eA-5xynC:
19.33
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.
5ze3 LYSYL OXIDASE
HOMOLOG 2

(Homo sapiens) 		no annotation 3 TYR A 744
ASP A 707
ASP A 737
 None
 0.54A 4a6eA-5ze3A:
undetectable		 4a6eA-5ze3A:
undetectable