SIMILAR PATTERNS OF AMINO ACIDS FOR 3QOW_A_SAMA417_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.
1dpp DIPEPTIDE BINDING
PROTEIN

(Escherichia
coli) 		PF00496
(SBP_bac_5) 		3 THR A 182
ASP A  89
GLU A 161
 None
 0.71A 3qowA-1dppA:
undetectable		 3qowA-1dppA:
20.40
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.
1e6v METHYL-COENZYME M
REDUCTASE I ALPHA
SUBUNIT

(Methanopyrus
kandleri) 		PF02249
(MCR_alpha)
PF02745
(MCR_alpha_N) 		3 THR A 295
ASP A 524
GLU A 519
 None
 0.78A 3qowA-1e6vA:
undetectable		 3qowA-1e6vA:
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.
1jji CARBOXYLESTERASE

(Archaeoglobus
fulgidus) 		PF07859
(Abhydrolase_3) 		3 THR A 251
ASP A 259
GLU A 202
 None
 0.78A 3qowA-1jjiA:
2.1		 3qowA-1jjiA:
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.
1kpi CYCLOPROPANE-FATTY-A
CYL-PHOSPHOLIPID
SYNTHASE 2

(Mycobacterium
tuberculosis) 		PF02353
(CMAS) 		3 THR A 102
ASP A  25
GLU A  18
 SAH  A 900 (-4.0A)
None
None
 0.83A 3qowA-1kpiA:
10.6		 3qowA-1kpiA:
22.12
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.
1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT

(Escherichia
coli) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4) 		3 THR A 893
ASP A 259
GLU A 235
 MGD  A1019 (-3.6A)
MGD  A1019 (-3.0A)
None
 0.76A 3qowA-1kqfA:
undetectable		 3qowA-1kqfA:
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.
1ltl DNA REPLICATION
INITIATOR
(CDC21/CDC54)

(Methanothermobacter
thermautotrophicus) 		PF14551
(MCM_N)
PF17207
(MCM_OB) 		3 THR A 208
ASP A 205
GLU A 120
 None
 0.73A 3qowA-1ltlA:
undetectable		 3qowA-1ltlA:
22.17
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.
1o0s NAD-DEPENDENT MALIC
ENZYME

(Ascaris suum) 		PF00390
(malic)
PF03949
(Malic_M) 		3 THR A 572
ASP A 116
GLU A  76
 None
 0.77A 3qowA-1o0sA:
3.9		 3qowA-1o0sA:
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.
1poi GLUTACONATE COENZYME
A-TRANSFERASE
GLUTACONATE COENZYME
A-TRANSFERASE

(Acidaminococcus
fermentans;
Acidaminococcus
fermentans) 		PF01144
(CoA_trans)
PF01144
(CoA_trans) 		3 THR B 143
ASP A 104
GLU B  54
 None
 0.71A 3qowA-1poiB:
2.1		 3qowA-1poiB:
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.
1urh 3-MERCAPTOPYRUVATE
SULFURTRANSFERASE

(Escherichia
coli) 		PF00581
(Rhodanese) 		3 THR A  73
ASP A  59
GLU A 267
 None
 0.75A 3qowA-1urhA:
undetectable		 3qowA-1urhA:
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.
1we5 PUTATIVE FAMILY 31
GLUCOSIDASE YICI

(Escherichia
coli) 		PF01055
(Glyco_hydro_31)
PF13802
(Gal_mutarotas_2) 		3 THR A 585
ASP A 612
GLU A 702
 None
 0.76A 3qowA-1we5A:
undetectable		 3qowA-1we5A:
19.87
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.
1wy7 HYPOTHETICAL PROTEIN
PH1948

(Pyrococcus
horikoshii) 		PF05175
(MTS) 		3 THR A  30
ASP A  55
GLU A  79
 SAH  A1001 (-4.0A)
SAH  A1001 ( 4.5A)
SAH  A1001 (-2.8A)
 0.81A 3qowA-1wy7A:
9.0		 3qowA-1wy7A:
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.
1yve ACETOHYDROXY ACID
ISOMEROREDUCTASE

(Spinacia
oleracea) 		PF01450
(IlvC)
PF07991
(IlvN) 		3 THR I 520
ASP I 315
GLU I 496
 None
MG  I 602 (-2.7A)
HIO  I 603 (-2.8A)
 0.81A 3qowA-1yveI:
3.3		 3qowA-1yveI:
20.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1z2z PROBABLE TRNA
PSEUDOURIDINE
SYNTHASE D

(Methanosarcina
mazei) 		PF01142
(TruD) 		3 THR A 315
ASP A 311
GLU A 306
 None
 0.83A 3qowA-1z2zA:
undetectable		 3qowA-1z2zA:
22.64
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.
2a24 ENDOTHELIAL PAS
DOMAIN PROTEIN 1

(Homo sapiens) 		PF08447
(PAS_3) 		3 THR A  19
ASP A  15
GLU A  43
 None
 0.67A 3qowA-2a24A:
undetectable		 3qowA-2a24A:
13.96
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.
2d1v TRANSCRIPTIONAL
REGULATORY PROTEIN
YYCF

(Bacillus
subtilis) 		PF00486
(Trans_reg_C) 		3 THR A 221
ASP A 199
GLU A 180
 None
 0.79A 3qowA-2d1vA:
undetectable		 3qowA-2d1vA:
15.57
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.
2d7t ANTI
POLYHYDROXYBUTYRATE
ANTIBODY FV, LIGHT
CHAIN

(Homo sapiens) 		PF07686
(V-set) 		3 THR L  59
ASP L  82
GLU L  39
 None
 0.64A 3qowA-2d7tL:
undetectable		 3qowA-2d7tL:
11.97
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.
2dpn GLYCEROL KINASE

(Thermus
thermophilus) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		3 THR A 261
ASP A 242
GLU A  82
 None
 0.85A 3qowA-2dpnA:
undetectable		 3qowA-2dpnA:
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.
2e8y AMYX PROTEIN

(Bacillus
subtilis) 		PF00128
(Alpha-amylase)
PF02922
(CBM_48) 		3 THR A 598
ASP A 592
GLU A 229
 None
 0.84A 3qowA-2e8yA:
undetectable		 3qowA-2e8yA:
19.73
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.
2etv IRON(III) ABC
TRANSPORTER,
PERIPLASMIC
IRON-BINDING
PROTEIN, PUTATIVE

(Thermotoga
maritima) 		PF01497
(Peripla_BP_2) 		3 THR A 294
ASP A 250
GLU A 209
 None
 0.85A 3qowA-2etvA:
undetectable		 3qowA-2etvA:
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.
2fef HYPOTHETICAL PROTEIN
PA2201

(Pseudomonas
aeruginosa) 		PF08929
(DUF1911) 		3 THR A 143
ASP A 176
GLU A 197
 None
 0.78A 3qowA-2fefA:
undetectable		 3qowA-2fefA:
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.
2gep SULFITE REDUCTASE
HEMOPROTEIN

(Escherichia
coli) 		PF01077
(NIR_SIR)
PF03460
(NIR_SIR_ferr) 		3 THR A 147
ASP A 143
GLU A 179
 None
 0.73A 3qowA-2gepA:
undetectable		 3qowA-2gepA:
22.47
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.
2gxf HYPOTHETICAL PROTEIN
YYBH

(Bacillus
subtilis) 		PF13474
(SnoaL_3) 		3 THR A 103
ASP A 125
GLU A  99
 None
 0.79A 3qowA-2gxfA:
undetectable		 3qowA-2gxfA:
15.62
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.
2h0i THIOL:DISULFIDE
INTERCHANGE PROTEIN
DSBG

(Escherichia
coli) 		PF13098
(Thioredoxin_2) 		3 THR A 145
ASP A 106
GLU A 189
 None
 0.70A 3qowA-2h0iA:
undetectable		 3qowA-2h0iA:
21.03
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.
2i50 UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE 16

(Homo sapiens) 		PF02148
(zf-UBP) 		3 THR A  80
ASP A  33
GLU A  71
 None
 0.75A 3qowA-2i50A:
undetectable		 3qowA-2i50A:
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.
2iuk SEED LIPOXYGENASE

(Glycine max) 		PF00305
(Lipoxygenase)
PF01477
(PLAT) 		3 THR A 394
ASP A 434
GLU A 475
 None
 0.67A 3qowA-2iukA:
undetectable		 3qowA-2iukA:
18.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jmm OUTER MEMBRANE
PROTEIN A

(Escherichia
coli) 		PF01389
(OmpA_membrane) 		3 THR A 121
ASP A  72
GLU A 113
 None
 0.85A 3qowA-2jmmA:
undetectable		 3qowA-2jmmA:
18.68
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.
2og7 ASPARAGINE OXYGENASE

(Streptomyces
coelicolor) 		PF02668
(TauD) 		3 THR A 153
ASP A 241
GLU A 157
 None
AHB  A7002 (-4.3A)
FE2  A5001 (-2.5A)
 0.85A 3qowA-2og7A:
undetectable		 3qowA-2og7A:
22.49
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.
2p5t PUTATIVE
TRANSCRIPTIONAL
REGULATOR PEZA
PEZT

(Streptococcus
pneumoniae;
Streptococcus
pneumoniae) 		no annotation
PF06414
(Zeta_toxin) 		3 THR B  47
ASP A  72
GLU A 130
 None
 0.85A 3qowA-2p5tB:
2.5		 3qowA-2p5tB:
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.
2xly CLOQ

(Streptomyces
roseochromogenus) 		PF11468
(PTase_Orf2) 		3 THR A  51
ASP A 260
GLU A 290
 None
 0.83A 3qowA-2xlyA:
undetectable		 3qowA-2xlyA:
22.79
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.
2xrc HUMAN COMPLEMENT
FACTOR I

(Homo sapiens) 		PF00057
(Ldl_recept_a)
PF00089
(Trypsin)
PF00530
(SRCR) 		3 THR A 268
ASP A 271
GLU A 263
 None
CA  A 600 (-3.3A)
None
 0.85A 3qowA-2xrcA:
undetectable		 3qowA-2xrcA:
20.40
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.
2ywv PHOSPHORIBOSYLAMINOI
MIDAZOLE
SUCCINOCARBOXAMIDE
SYNTHETASE

(Geobacillus
kaustophilus) 		PF01259
(SAICAR_synt) 		3 THR A  34
ASP A 126
GLU A  91
 None
 0.86A 3qowA-2ywvA:
undetectable		 3qowA-2ywvA:
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.
2z1a 5'-NUCLEOTIDASE

(Thermus
thermophilus) 		PF00149
(Metallophos)
PF02872
(5_nucleotid_C) 		3 THR A  88
ASP A  99
GLU A 117
 None
 0.49A 3qowA-2z1aA:
undetectable		 3qowA-2z1aA:
22.40
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.
2z2m PENICILLIN-BINDING
PROTEIN 2X
PENICILLIN-BINDING
PROTEIN 2X

(Streptococcus
pneumoniae;
Streptococcus
pneumoniae) 		PF03717
(PBP_dimer)
PF00905
(Transpeptidase) 		3 THR A 159
ASP B 313
GLU A  89
 None
 0.70A 3qowA-2z2mA:
undetectable		 3qowA-2z2mA:
17.84
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.
2zvw PROLIFERATING CELL
NUCLEAR ANTIGEN 2

(Arabidopsis
thaliana) 		PF00705
(PCNA_N)
PF02747
(PCNA_C) 		3 THR A 186
ASP A 189
GLU A 192
 None
 0.85A 3qowA-2zvwA:
undetectable		 3qowA-2zvwA:
23.92
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.
3a01 HOMEOBOX PROTEIN
ARISTALESS

(Drosophila
melanogaster) 		PF00046
(Homeobox) 		3 THR B 107
ASP B 111
GLU B 117
 None
 0.75A 3qowA-3a01B:
undetectable		 3qowA-3a01B:
11.43
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.
3dni DEOXYRIBONUCLEASE I

(Bos taurus) 		PF03372
(Exo_endo_phos) 		3 THR A 203
ASP A 168
GLU A  39
 CA  A 281 (-3.9A)
None
None
 0.81A 3qowA-3dniA:
undetectable		 3qowA-3dniA:
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.
3e05 PRECORRIN-6Y
C5,15-METHYLTRANSFER
ASE
(DECARBOXYLATING)

(Geobacter
metallireducens) 		no annotation 3 THR A 232
ASP A 254
GLU A 279
 None
 0.69A 3qowA-3e05A:
12.3		 3qowA-3e05A:
18.89
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.
3i04 CARBON MONOXIDE
DEHYDROGENASE/ACETYL
-COA SYNTHASE
SUBUNIT BETA

(Moorella
thermoacetica) 		PF03063
(Prismane) 		3 THR A 189
ASP A 250
GLU A 434
 None
 0.74A 3qowA-3i04A:
undetectable		 3qowA-3i04A:
19.41
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.
3lkd TYPE I
RESTRICTION-MODIFICA
TION SYSTEM
METHYLTRANSFERASE
SUBUNIT

(Streptococcus
thermophilus) 		PF02384
(N6_Mtase)
PF12161
(HsdM_N) 		3 THR A 201
ASP A 227
GLU A 255
 None
 0.58A 3qowA-3lkdA:
9.3		 3qowA-3lkdA:
20.32
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.
3lnq HOMEOBOX PROTEIN
ARISTALESS

(Drosophila
melanogaster) 		PF00046
(Homeobox) 		3 THR A 107
ASP A 111
GLU A 117
 None
 0.79A 3qowA-3lnqA:
undetectable		 3qowA-3lnqA:
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.
3lxu TRIPEPTIDYL-PEPTIDAS
E 2

(Drosophila
melanogaster) 		PF00082
(Peptidase_S8)
PF12580
(TPPII)
PF12583
(TPPII_N) 		3 THR X1273
ASP X 176
GLU X 182
 None
 0.80A 3qowA-3lxuX:
2.9		 3qowA-3lxuX:
15.40
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.
3m8u HEME-BINDING PROTEIN
A

(Glaesserella
parasuis) 		PF00496
(SBP_bac_5) 		3 THR A 206
ASP A 113
GLU A 185
 None
 0.69A 3qowA-3m8uA:
undetectable		 3qowA-3m8uA:
22.62
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.
3mc2 INHIBITOR OF
CARBONIC ANHYDRASE

(Mus musculus) 		PF00405
(Transferrin) 		3 THR A 540
ASP A 630
GLU A 625
 None
 0.73A 3qowA-3mc2A:
undetectable		 3qowA-3mc2A:
19.69
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.
3nbi RECQ-MEDIATED GENOME
INSTABILITY PROTEIN
1

(Homo sapiens) 		PF08585
(RMI1_N) 		3 THR A 140
ASP A  60
GLU A 200
 None
 0.68A 3qowA-3nbiA:
undetectable		 3qowA-3nbiA:
17.97
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.
3nua PHOSPHORIBOSYLAMINOI
MIDAZOLE-SUCCINOCARB
OXAMIDE SYNTHASE

(Clostridium
perfringens) 		PF01259
(SAICAR_synt) 		3 THR A  34
ASP A 126
GLU A  91
 CIT  A 243 (-3.9A)
None
AMP  A 242 (-4.2A)
 0.81A 3qowA-3nuaA:
undetectable		 3qowA-3nuaA:
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.
3q9o EXOTOXIN A

(Vibrio cholerae) 		PF09009
(Exotox-A_cataly)
PF09101
(Exotox-A_bind)
PF09102
(Exotox-A_target) 		3 THR A 247
ASP A 135
GLU A 110
 None
 0.79A 3qowA-3q9oA:
undetectable		 3qowA-3q9oA:
22.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qhy BETA-LACTAMASE

(Bacillus
anthracis) 		PF13354
(Beta-lactamase2) 		3 THR A 182
ASP A 157
GLU A 149
 None
 0.83A 3qowA-3qhyA:
undetectable		 3qowA-3qhyA:
23.02
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.
3rju BETA-LACTAMASE/D-ALA
NINE
CARBOXYPEPTIDASE

(Yersinia pestis) 		PF00144
(Beta-lactamase) 		3 THR A  61
ASP A 162
GLU A 118
 None
 0.69A 3qowA-3rjuA:
undetectable		 3qowA-3rjuA:
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.
3s99 BASIC MEMBRANE
LIPOPROTEIN

(Brucella
abortus) 		PF02608
(Bmp) 		3 THR A  57
ASP A  41
GLU A  61
 None
 0.84A 3qowA-3s99A:
2.3		 3qowA-3s99A:
25.16
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.
3tpa HEME-BINDING PROTEIN
A

(Glaesserella
parasuis) 		PF00496
(SBP_bac_5) 		3 THR A 189
ASP A  96
GLU A 168
 None
 0.74A 3qowA-3tpaA:
undetectable		 3qowA-3tpaA:
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.
3u44 ATP-DEPENDENT
HELICASE/NUCLEASE
SUBUNIT A

(Bacillus
subtilis) 		PF00580
(UvrD-helicase)
PF12705
(PDDEXK_1)
PF13361
(UvrD_C) 		3 THR A 424
ASP A  25
GLU A 429
 None
 0.75A 3qowA-3u44A:
undetectable		 3qowA-3u44A:
16.53
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.
3v9e LACCASE

(Botrytis aclada) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		3 THR A   7
ASP A 157
GLU A 279
 None
 0.85A 3qowA-3v9eA:
undetectable		 3qowA-3v9eA:
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.
3vvl HOMOSERINE
O-ACETYLTRANSFERASE

(Streptomyces
lavendulae) 		PF00561
(Abhydrolase_1) 		3 THR A 216
ASP A 196
GLU A 208
 None
 0.83A 3qowA-3vvlA:
undetectable		 3qowA-3vvlA:
22.32
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.
3zu0 NAD NUCLEOTIDASE

(Haemophilus
influenzae) 		PF00149
(Metallophos)
PF02872
(5_nucleotid_C) 		3 THR A  99
ASP A 110
GLU A 128
 None
 0.52A 3qowA-3zu0A:
undetectable		 3qowA-3zu0A:
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.
4a3u NADH:FLAVIN
OXIDOREDUCTASE/NADH
OXIDASE

(Zymomonas
mobilis) 		PF00724
(Oxidored_FMN) 		3 THR A 335
ASP A 323
GLU A 330
 None
 0.84A 3qowA-4a3uA:
undetectable		 3qowA-4a3uA:
22.32
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.
4ayg GLUCANSUCRASE

(Lactobacillus
reuteri) 		PF01473
(CW_binding_1)
PF02324
(Glyco_hydro_70) 		3 THR A1392
ASP A1052
GLU A1386
 None
 0.76A 3qowA-4aygA:
undetectable		 3qowA-4aygA:
17.64
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.
4c13 UDP-N-ACETYLMURAMOYL
-L-ALANYL-D-GLUTAMAT
E--L-LYSINE LIGASE

(Staphylococcus
aureus) 		PF01225
(Mur_ligase)
PF02875
(Mur_ligase_C)
PF08245
(Mur_ligase_M) 		3 THR A 404
ASP A 475
GLU A 460
 None
None
UML  A 598 (-3.1A)
 0.65A 3qowA-4c13A:
2.4		 3qowA-4c13A:
23.67
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.
4cg4 PYRIN

(Homo sapiens) 		PF00622
(SPRY)
PF13765
(PRY) 		3 THR A 771
ASP A 616
GLU A 784
 None
 0.74A 3qowA-4cg4A:
undetectable		 3qowA-4cg4A:
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.
4d47 LEVANSUCRASE

(Erwinia
amylovora) 		PF02435
(Glyco_hydro_68) 		3 THR A 308
ASP A 317
GLU A  21
 None
 0.85A 3qowA-4d47A:
undetectable		 3qowA-4d47A:
23.16
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.
4d4z DEOXYHYPUSINE
HYDROXYLASE

(Homo sapiens) 		PF13646
(HEAT_2) 		3 THR A  81
ASP A 113
GLU A 117
 None
 0.58A 3qowA-4d4zA:
undetectable		 3qowA-4d4zA:
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.
4dw1 P2X PURINOCEPTOR

(Danio rerio) 		PF00864
(P2X_receptor) 		3 THR A 124
ASP A 145
GLU A 171
 None
 0.72A 3qowA-4dw1A:
undetectable		 3qowA-4dw1A:
19.86
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.
4esw PYRIMIDINE
BIOSYNTHESIS ENZYME
THI13

(Candida
albicans) 		PF09084
(NMT1) 		3 THR A   3
ASP A  58
GLU A 212
 None
 0.86A 3qowA-4eswA:
undetectable		 3qowA-4eswA:
23.57
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.
4f6a BH1408 PROTEIN

(Bacillus
halodurans) 		PF00583
(Acetyltransf_1) 		3 THR A 151
ASP A 128
GLU A 126
 None
 0.79A 3qowA-4f6aA:
undetectable		 3qowA-4f6aA:
15.96
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.
4gs5 ACYL-COA SYNTHETASE
(AMP-FORMING)/AMP-AC
ID LIGASE II-LIKE
PROTEIN

(Dyadobacter
fermentans) 		PF00501
(AMP-binding) 		3 THR A   8
ASP A 100
GLU A  98
 IOD  A 412 ( 4.6A)
None
None
 0.69A 3qowA-4gs5A:
3.1		 3qowA-4gs5A:
22.22
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.
4ina SACCHAROPINE
DEHYDROGENASE

(Wolinella
succinogenes) 		PF03435
(Sacchrp_dh_NADP)
PF16653
(Sacchrp_dh_C) 		3 THR A 346
ASP A 169
GLU A 191
 None
 0.68A 3qowA-4inaA:
2.0		 3qowA-4inaA:
21.68
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.
4ina SACCHAROPINE
DEHYDROGENASE

(Wolinella
succinogenes) 		PF03435
(Sacchrp_dh_NADP)
PF16653
(Sacchrp_dh_C) 		3 THR A 346
ASP A 169
GLU A 233
 None
 0.83A 3qowA-4inaA:
2.0		 3qowA-4inaA:
21.68
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.
4jkm BETA-GLUCURONIDASE

(Clostridium
perfringens) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N) 		3 THR A 330
ASP A 398
GLU A 337
 None
 0.84A 3qowA-4jkmA:
undetectable		 3qowA-4jkmA:
24.23
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.
4k17 LEUCINE-RICH
REPEAT-CONTAINING
PROTEIN 16A

(Mus musculus) 		PF13516
(LRR_6) 		3 THR A  49
ASP A 168
GLU A  72
 None
 0.73A 3qowA-4k17A:
undetectable		 3qowA-4k17A:
20.57
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.
4m2g L-ARGININE
BETA-HYDROXYLASE

(Streptomyces
lavendulae) 		PF02668
(TauD) 		3 THR A 152
ASP A 255
GLU A 156
 None
None
FE  A 401 (-2.4A)
 0.77A 3qowA-4m2gA:
undetectable		 3qowA-4m2gA:
23.43
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.
4nes UDP-N-ACETYLGLUCOSAM
INE 2-EPIMERASE

(Methanocaldococcus
jannaschii) 		PF02350
(Epimerase_2) 		3 THR A 244
ASP A 287
GLU A 129
 None
None
UD1  A 400 (-3.6A)
 0.70A 3qowA-4nesA:
undetectable		 3qowA-4nesA:
24.07
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.
4ns4 ALPHA/BETA HYDROLASE
FOLD PROTEIN

(Psychrobacter
cryohalolentis) 		PF00561
(Abhydrolase_1) 		3 THR A 260
ASP A 140
GLU A 271
 None
 0.82A 3qowA-4ns4A:
undetectable		 3qowA-4ns4A:
20.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4o06 PROBABLE 26S
PROTEASOME
REGULATORY SUBUNIT
P27

(Saccharomyces
cerevisiae) 		PF00595
(PDZ) 		3 THR A 199
ASP A 155
GLU A 193
 None
 0.85A 3qowA-4o06A:
undetectable		 3qowA-4o06A:
13.84
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.
4okm TERPENE SYNTHASE
METAL-BINDING
DOMAIN-CONTAINING
PROTEIN

(Streptomyces
pristinaespiralis) 		no annotation 3 THR A 221
ASP A 181
GLU A  87
 None
None
MG  A 901 (-2.6A)
 0.82A 3qowA-4okmA:
undetectable		 3qowA-4okmA:
23.60
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.
4oy2 TRANSCRIPTION
INITIATION FACTOR
TFIID SUBUNIT 1

(Saccharomyces
cerevisiae) 		PF12157
(DUF3591) 		3 THR A 875
ASP A 817
GLU A 551
 None
 0.75A 3qowA-4oy2A:
undetectable		 3qowA-4oy2A:
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.
4q2c CRISPR-ASSOCIATED
HELICASE CAS3

(Thermobaculum
terrenum) 		PF00271
(Helicase_C) 		3 THR A 739
ASP A 685
GLU A 667
 None
 0.71A 3qowA-4q2cA:
undetectable		 3qowA-4q2cA:
18.24
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.
4qfk ABC TRANSPORTER
PERIPLASMIC
PEPTIDE-BINDING
PROTEIN

(Pseudoalteromonas
sp. SM9913) 		no annotation 3 THR H 210
ASP H 117
GLU H 189
 None
 0.72A 3qowA-4qfkH:
undetectable		 3qowA-4qfkH:
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.
4rf7 ARGININE KINASE

(Anthopleura
japonica) 		PF00217
(ATP-gua_Ptrans)
PF02807
(ATP-gua_PtransN) 		3 THR A 497
ASP A 116
GLU A 238
 None
 0.84A 3qowA-4rf7A:
undetectable		 3qowA-4rf7A:
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.
4rzi 3-KETOACYL-ACYL
CARRIER PROTEIN
REDUCTASE

(Synechocystis
sp. PCC 6803) 		no annotation 3 THR B 197
ASP B 181
GLU B 210
 None
 0.80A 3qowA-4rziB:
2.2		 3qowA-4rziB:
21.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4tvc DEXTRANSUCRASE

(Leuconostoc
mesenteroides) 		PF02324
(Glyco_hydro_70) 		3 THR A2223
ASP A2692
GLU A2181
 None
 0.66A 3qowA-4tvcA:
2.2		 3qowA-4tvcA:
18.15
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.
4v2i ESTERASE/LIPASE

(Thalassospira
sp. GB04J01) 		PF07859
(Abhydrolase_3) 		3 THR A 251
ASP A 259
GLU A 200
 MG  A1317 (-4.0A)
None
None
 0.76A 3qowA-4v2iA:
undetectable		 3qowA-4v2iA:
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.
4wv3 ANTHRANILATE-COA
LIGASE

(Stigmatella
aurantiaca) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		3 THR A 178
ASP A 415
GLU A 295
 None
 0.85A 3qowA-4wv3A:
undetectable		 3qowA-4wv3A:
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.
4xhb SIALIDASE B

(Streptococcus
pneumoniae) 		PF02012
(BNR)
PF02973
(Sialidase)
PF13088
(BNR_2) 		3 THR A 158
ASP A 217
GLU A 219
 None
 0.80A 3qowA-4xhbA:
undetectable		 3qowA-4xhbA:
20.09
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.
4yfm BETA-LACTAMASE

(Mycobacteroides
abscessus) 		PF13354
(Beta-lactamase2) 		3 THR A 181
ASP A 158
GLU A 150
 None
 0.79A 3qowA-4yfmA:
undetectable		 3qowA-4yfmA:
22.19
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.
4ypv EST8

(Parvibaculum) 		PF07859
(Abhydrolase_3) 		3 THR A 249
ASP A 257
GLU A 201
 None
 0.82A 3qowA-4ypvA:
2.0		 3qowA-4ypvA:
23.53
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.
4ywo MERCURIC REDUCTASE

(Metallosphaera
sedula) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		3 THR A 333
ASP A 214
GLU A  62
 None
None
GOL  A 504 ( 4.0A)
 0.81A 3qowA-4ywoA:
2.8		 3qowA-4ywoA:
22.78
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.
5bxy RNA
METHYLTRANSFERASE

(Salinibacter
ruber) 		PF13847
(Methyltransf_31) 		3 THR A   7
ASP A  29
GLU A  53
 SAH  A 201 (-3.5A)
SAH  A 201 (-2.9A)
SAH  A 201 (-2.8A)
 0.34A 3qowA-5bxyA:
15.6		 3qowA-5bxyA:
19.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5d9a POLYMERASE BASIC
PROTEIN 2

(Influenza C
virus) 		PF00604
(Flu_PB2) 		3 THR C 321
ASP C 524
GLU C 515
 None
 0.85A 3qowA-5d9aC:
undetectable		 3qowA-5d9aC:
19.50
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.
5e4r KETOL-ACID
REDUCTOISOMERASE

(Ignisphaera
aggregans) 		PF01450
(IlvC)
PF07991
(IlvN) 		3 THR A 401
ASP A 191
GLU A 378
 None
MG  A 502 (-2.6A)
MG  A 503 (-3.8A)
 0.82A 3qowA-5e4rA:
3.9		 3qowA-5e4rA:
23.55
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.
5epg ALDEHYDE OXIDASE

(Homo sapiens) 		PF00111
(Fer2)
PF00941
(FAD_binding_5)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2)
PF03450
(CO_deh_flav_C) 		3 THR A1177
ASP A 555
GLU A 529
 None
 0.79A 3qowA-5epgA:
undetectable		 3qowA-5epgA:
16.65
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.
5f1p PTMO8

(Streptomyces
platensis) 		PF13561
(adh_short_C2) 		3 THR A  45
ASP A  39
GLU A  62
 None
 0.86A 3qowA-5f1pA:
3.3		 3qowA-5f1pA:
21.68
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.
5f1q PERIPLASMIC
DIPEPTIDE TRANSPORT
PROTEIN

(Yersinia pestis) 		PF00496
(SBP_bac_5) 		3 THR A 210
ASP A 117
GLU A 189
 None
 0.67A 3qowA-5f1qA:
undetectable		 3qowA-5f1qA:
20.43
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.
5fad RIBOSOMAL PROTEIN
L11
METHYLTRANSFERASE,
PUTATIVE

(Sulfolobus
islandicus) 		PF13847
(Methyltransf_31) 		3 THR A  12
ASP A  34
GLU A  59
 SAH  A 201 (-3.4A)
SAH  A 201 (-2.9A)
SAH  A 201 (-2.9A)
 0.25A 3qowA-5fadA:
15.7		 3qowA-5fadA:
17.14
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.
5hr4 MMEI

(Methylophilus
methylotrophus) 		no annotation 3 THR C 316
ASP C 361
GLU C 413
 SFG  C1002 (-4.0A)
SFG  C1002 ( 4.9A)
SFG  C1002 (-2.8A)
 0.72A 3qowA-5hr4C:
9.3		 3qowA-5hr4C:
19.39
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.
5j55 CAROTENOID OXYGENASE

(Novosphingobium
aromaticivorans) 		PF03055
(RPE65) 		3 THR A 253
ASP A 312
GLU A 322
 None
 0.85A 3qowA-5j55A:
undetectable		 3qowA-5j55A:
20.15
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.
5lx8 SUSD HOMOLOG

(Bacteroides
thetaiotaomicron) 		PF07980
(SusD_RagB)
PF14322
(SusD-like_3) 		3 THR A 241
ASP A 237
GLU A 544
 None
 0.66A 3qowA-5lx8A:
undetectable		 3qowA-5lx8A:
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.
5oc1 ARYL-ALCOHOL OXIDASE

(Pleurotus
eryngii) 		no annotation 3 THR A 100
ASP A 118
GLU A 113
 None
 0.80A 3qowA-5oc1A:
undetectable		 3qowA-5oc1A:
22.22
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.
5xs9 TETR FAMILY
TRANSCRIPTIONAL
REGULATOR

(Mycolicibacterium
smegmatis) 		no annotation 3 THR A 171
ASP A  84
GLU A  77
 None
 0.78A 3qowA-5xs9A:
2.0		 3qowA-5xs9A:
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.
5ygf GH18329P

(Drosophila
melanogaster) 		no annotation 3 THR A 433
ASP A 348
GLU A 331
 None
 0.85A 3qowA-5ygfA:
undetectable		 3qowA-5ygfA:
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.
6eom MUTT/NUDIX FAMILY
PROTEIN

(Caldithrix
abyssi) 		no annotation 3 THR A 451
ASP A 416
GLU A 380
 None
 0.85A 3qowA-6eomA:
undetectable		 3qowA-6eomA:
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.
6et8 -

(-) 		no annotation 3 THR A  26
ASP A  63
GLU A  18
 None
 0.60A 3qowA-6et8A:
undetectable		 3qowA-6et8A:
undetectable