SIMILAR PATTERNS OF AMINO ACIDS FOR 5QGU_A_ACTA301_0

List of similar pattern of amino acids derived from ASSAM search

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ah9 INITIATION FACTOR 1

(Escherichia
coli) 		PF01176
(eIF-1a) 		3 VAL A  31
VAL A  23
GLN A   9
 None
 0.64A 5qguA-1ah9A:
0.0		 5qguA-1ah9A:
17.68
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.
1amo NADPH-CYTOCHROME
P450 REDUCTASE

(Rattus
norvegicus) 		PF00175
(NAD_binding_1)
PF00258
(Flavodoxin_1)
PF00667
(FAD_binding_1) 		3 VAL A 629
VAL A 531
GLN A 606
 None
None
NAP  A 752 (-2.9A)
 0.66A 5qguA-1amoA:
0.0		 5qguA-1amoA:
14.73
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.
1b66 6-PYRUVOYL
TETRAHYDROPTERIN
SYNTHASE

(Rattus rattus) 		PF01242
(PTPS) 		3 VAL A  56
VAL A 129
GLN A 118
 None
 0.67A 5qguA-1b66A:
0.0		 5qguA-1b66A:
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.
1b9r PROTEIN
(TERPREDOXIN)

(Pseudomonas sp.) 		PF00111
(Fer2) 		3 VAL A   3
VAL A  15
GLN A  29
 None
 0.67A 5qguA-1b9rA:
0.0		 5qguA-1b9rA:
19.40
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.
1bkb TRANSLATION
INITIATION FACTOR 5A

(Pyrobaculum
aerophilum) 		PF01287
(eIF-5a)
PF08207
(EFP_N) 		3 VAL A 137
VAL A 123
GLN A  82
 None
 0.55A 5qguA-1bkbA:
0.0		 5qguA-1bkbA:
22.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1c2o ACETYLCHOLINESTERASE

(Electrophorus
electricus) 		PF00135
(COesterase) 		3 VAL A 511
VAL A 520
GLN A 499
 None
 0.71A 5qguA-1c2oA:
0.0		 5qguA-1c2oA:
19.10
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.
1c30 CARBAMOYL PHOSPHATE
SYNTHETASE: LARGE
SUBUNIT

(Escherichia
coli) 		PF02142
(MGS)
PF02786
(CPSase_L_D2)
PF02787
(CPSase_L_D3) 		3 VAL A 764
VAL A 828
GLN A 812
 None
 0.69A 5qguA-1c30A:
0.0		 5qguA-1c30A:
11.17
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.
1dcu FRUCTOSE-1,6-BISPHOS
PHATASE

(Pisum sativum) 		PF00316
(FBPase) 		3 VAL A 124
VAL A 113
GLN A 171
 None
 0.54A 5qguA-1dcuA:
0.0		 5qguA-1dcuA:
19.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1dyo ENDO-1,4-BETA-XYLANA
SE Y

(Ruminiclostridium
thermocellum) 		PF02018
(CBM_4_9) 		3 VAL A  46
VAL A  30
GLN A  57
 None
 0.56A 5qguA-1dyoA:
0.0		 5qguA-1dyoA:
20.10
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.
1f76 DIHYDROOROTATE
DEHYDROGENASE
(QUINONE)

(Escherichia
coli) 		PF01180
(DHO_dh) 		3 VAL A 242
VAL A 216
GLN A 185
 None
 0.71A 5qguA-1f76A:
undetectable		 5qguA-1f76A:
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.
1gq1 CYTOCHROME CD1
NITRITE REDUCTASE

(Paracoccus
pantotrophus) 		PF02239
(Cytochrom_D1)
PF13442
(Cytochrome_CBB3) 		3 VAL A 316
VAL A 300
GLN A 267
 None
 0.64A 5qguA-1gq1A:
undetectable		 5qguA-1gq1A:
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.
1hzv NITRITE REDUCTASE

(Pseudomonas
aeruginosa) 		PF02239
(Cytochrom_D1)
PF13442
(Cytochrome_CBB3) 		3 VAL A 298
VAL A 282
GLN A 249
 None
 0.72A 5qguA-1hzvA:
undetectable		 5qguA-1hzvA:
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.
1iah TRANSIENT RECEPTOR
POTENTIAL-RELATED
PROTEIN

(Mus musculus) 		PF02816
(Alpha_kinase) 		3 VAL A1763
VAL A1778
GLN A1676
 None
 0.71A 5qguA-1iahA:
undetectable		 5qguA-1iahA:
19.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ibg IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 VAL H 138
VAL H 193
GLN H 203
 None
 0.61A 5qguA-1ibgH:
undetectable		 5qguA-1ibgH:
17.12
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.
1iq6 (R)-SPECIFIC
ENOYL-COA HYDRATASE

(Aeromonas
caviae) 		PF01575
(MaoC_dehydratas) 		3 VAL A  52
VAL A  87
GLN A 118
 None
 0.68A 5qguA-1iq6A:
undetectable		 5qguA-1iq6A:
23.23
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.
1kig FACTOR XA

(Bos taurus) 		PF00089
(Trypsin) 		3 VAL H 209
VAL H 200
GLN H  30
 None
 0.58A 5qguA-1kigH:
undetectable		 5qguA-1kigH:
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.
1mam IGG2B-KAPPA YST9.1
FAB (HEAVY CHAIN)

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 VAL H 142
VAL H 189
GLN H 197
 None
 0.62A 5qguA-1mamH:
undetectable		 5qguA-1mamH:
19.57
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.
1ph5 TELOMERE-BINDING
PROTEIN ALPHA
SUBUNIT

(Sterkiella nova) 		PF02765
(POT1) 		3 VAL A 375
VAL A 417
GLN A 414
 None
 0.64A 5qguA-1ph5A:
undetectable		 5qguA-1ph5A:
17.86
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.
1pjz THIOPURINE
S-METHYLTRANSFERASE

(Pseudomonas
syringae) 		PF05724
(TPMT) 		3 VAL A 195
VAL A 171
GLN A  11
 None
 0.56A 5qguA-1pjzA:
undetectable		 5qguA-1pjzA:
23.73
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.
1q3o SHANK1

(Rattus
norvegicus) 		PF00595
(PDZ) 		3 VAL A 661
VAL A 658
GLN A 656
 None
 0.52A 5qguA-1q3oA:
undetectable		 5qguA-1q3oA:
23.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1r2j PROTEIN FKBI

(Streptomyces
hygroscopicus) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		3 VAL A 153
VAL A 167
GLN A  93
 None
 0.66A 5qguA-1r2jA:
undetectable		 5qguA-1r2jA:
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.
1rfv PYRIDOXAL KINASE

(Ovis aries) 		PF08543
(Phos_pyr_kin) 		3 VAL A 307
VAL A 306
GLN A 268
 None
 0.68A 5qguA-1rfvA:
undetectable		 5qguA-1rfvA:
20.63
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.
1s4e GALACTOKINASE

(Pyrococcus
furiosus) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C)
PF10509
(GalKase_gal_bdg) 		3 VAL A 350
VAL A 156
GLN A 152
 None
 0.53A 5qguA-1s4eA:
undetectable		 5qguA-1s4eA:
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.
1sky F1-ATPASE

(Bacillus sp.
PS3) 		PF00006
(ATP-synt_ab)
PF00306
(ATP-synt_ab_C)
PF02874
(ATP-synt_ab_N) 		3 VAL B 224
VAL B 108
GLN B 113
 None
 0.69A 5qguA-1skyB:
undetectable		 5qguA-1skyB:
17.51
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.
1u1h 5-METHYLTETRAHYDROPT
EROYLTRIGLUTAMATE--H
OMOCYSTEINE
METHYLTRANSFERASE

(Arabidopsis
thaliana) 		PF01717
(Meth_synt_2)
PF08267
(Meth_synt_1) 		3 VAL A 261
VAL A 238
GLN A 204
 None
 0.65A 5qguA-1u1hA:
undetectable		 5qguA-1u1hA:
13.42
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.
1u53 SECRETED PROTEIN
ASP-2

(Necator
americanus) 		PF00188
(CAP) 		3 VAL A 145
VAL A 154
GLN A  98
 None
 0.66A 5qguA-1u53A:
undetectable		 5qguA-1u53A:
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.
1v6u ENDO-1,4-BETA-D-XYLA
NASE

(Streptomyces
olivaceoviridis) 		PF00331
(Glyco_hydro_10)
PF00652
(Ricin_B_lectin) 		3 VAL A 326
VAL A 337
GLN A 378
 None
 0.70A 5qguA-1v6uA:
undetectable		 5qguA-1v6uA:
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.
1vh0 HYPOTHETICAL UPF0247
PROTEIN
SAV0024/SA0023

(Staphylococcus
aureus) 		PF02590
(SPOUT_MTase) 		3 VAL A   8
VAL A  38
GLN A  61
 None
 0.62A 5qguA-1vh0A:
undetectable		 5qguA-1vh0A:
22.44
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.
1w6s METHANOL
DEHYDROGENASE
SUBUNIT 1

(Methylobacterium
extorquens) 		PF01011
(PQQ)
PF13360
(PQQ_2) 		3 VAL A 133
VAL A 147
GLN A 194
 None
 0.65A 5qguA-1w6sA:
undetectable		 5qguA-1w6sA:
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.
1wcx UROPORPHYRINOGEN III
SYNTHASE

(Thermus
thermophilus) 		PF02602
(HEM4) 		3 VAL A 133
VAL A  60
GLN A  58
 None
 0.68A 5qguA-1wcxA:
undetectable		 5qguA-1wcxA:
21.85
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.
1wde PROBABLE DIPHTHINE
SYNTHASE

(Aeropyrum
pernix) 		PF00590
(TP_methylase) 		3 VAL A  38
VAL A  89
GLN A  22
 None
 0.62A 5qguA-1wdeA:
undetectable		 5qguA-1wdeA:
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.
1wgg UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE 14

(Mus musculus) 		no annotation 3 VAL A  73
VAL A  12
GLN A  36
 None
 0.51A 5qguA-1wggA:
undetectable		 5qguA-1wggA:
18.23
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.
1whd REGULATOR OF
G-PROTEIN SIGNALING
3

(Mus musculus) 		PF00595
(PDZ) 		3 VAL A  60
VAL A  91
GLN A  18
 None
 0.69A 5qguA-1whdA:
undetectable		 5qguA-1whdA:
20.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xe7 HYPOTHETICAL 22.5
KDA PROTEIN IN
TUB1-CPR3 INTERGENIC
REGION

(Saccharomyces
cerevisiae) 		PF06172
(Cupin_5) 		3 VAL A 136
VAL A 127
GLN A 112
 None
 0.67A 5qguA-1xe7A:
undetectable		 5qguA-1xe7A:
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.
1xw8 UPF0271 PROTEIN YBGL

(Escherichia
coli) 		PF03746
(LamB_YcsF) 		3 VAL A 215
VAL A 159
GLN A 190
 None
 0.67A 5qguA-1xw8A:
undetectable		 5qguA-1xw8A:
23.36
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.
1yhn RAS-RELATED PROTEIN
RAB-7

(Homo sapiens) 		PF00071
(Ras) 		3 VAL A  57
VAL A  50
GLN A 167
 None
 0.68A 5qguA-1yhnA:
undetectable		 5qguA-1yhnA:
22.75
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.
2a8k COLICIN E5

(Escherichia
coli) 		PF12106
(Colicin_E5) 		3 VAL A  75
VAL A  66
GLN A 101
 None
 0.66A 5qguA-2a8kA:
undetectable		 5qguA-2a8kA:
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.
2b39 C3

(Bos taurus) 		PF00207
(A2M)
PF01759
(NTR)
PF01821
(ANATO)
PF01835
(A2M_N)
PF07677
(A2M_recep)
PF07678
(A2M_comp)
PF07703
(A2M_N_2)
PF10569
(Thiol-ester_cl) 		3 VAL A 861
VAL A 915
GLN A 826
 None
 0.71A 5qguA-2b39A:
undetectable		 5qguA-2b39A:
7.80
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.
2b42 XYLANASE INHIBITOR-I

(Triticum
aestivum) 		PF14541
(TAXi_C)
PF14543
(TAXi_N) 		3 VAL A 232
VAL A 346
GLN A 352
 None
 0.72A 5qguA-2b42A:
undetectable		 5qguA-2b42A:
20.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2b5i CYTOKINE RECEPTOR
COMMON GAMMA CHAIN

(Homo sapiens) 		PF00041
(fn3)
PF09240
(IL6Ra-bind) 		3 VAL C  42
VAL C 130
GLN C 127
 None
 0.66A 5qguA-2b5iC:
undetectable		 5qguA-2b5iC:
21.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2bma GLUTAMATE
DEHYDROGENASE
(NADP+)

(Plasmodium
falciparum) 		PF00208
(ELFV_dehydrog)
PF02812
(ELFV_dehydrog_N) 		3 VAL A 214
VAL A 217
GLN A 231
 None
 0.68A 5qguA-2bmaA:
undetectable		 5qguA-2bmaA:
18.20
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.
2bpa PROTEIN (SUBUNIT OF
BACTERIOPHAGE
PHIX174)

(Escherichia
virus phiX174) 		PF02305
(Phage_F) 		3 VAL 1 289
VAL 1  64
GLN 1 266
 None
 0.71A 5qguA-2bpa1:
undetectable		 5qguA-2bpa1:
17.46
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.
2ddx BETA-1,3-XYLANASE

(Vibrio sp. AX-4) 		no annotation 3 VAL A 155
VAL A 117
GLN A 168
 None
 0.72A 5qguA-2ddxA:
undetectable		 5qguA-2ddxA:
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.
2dej PROBABLE
GALACTOKINASE

(Pyrococcus
horikoshii) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C)
PF10509
(GalKase_gal_bdg) 		3 VAL A 348
VAL A 154
GLN A 150
 None
 0.72A 5qguA-2dejA:
undetectable		 5qguA-2dejA:
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.
2diy THIOREDOXIN-LIKE
PROTEIN 2

(Homo sapiens) 		PF00085
(Thioredoxin) 		3 VAL A  43
VAL A  73
GLN A  28
 None
 0.69A 5qguA-2diyA:
undetectable		 5qguA-2diyA:
21.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2dvz PUTATIVE EXPORTED
PROTEIN

(Bordetella
pertussis) 		PF03401
(TctC) 		3 VAL A  23
VAL A  54
GLN A  42
 None
 0.48A 5qguA-2dvzA:
undetectable		 5qguA-2dvzA:
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.
2erj CYTOKINE RECEPTOR
COMMON GAMMA CHAIN

(Homo sapiens) 		PF00041
(fn3)
PF09240
(IL6Ra-bind) 		3 VAL C  42
VAL C 130
GLN C 127
 None
 0.51A 5qguA-2erjC:
undetectable		 5qguA-2erjC:
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.
2fck RIBOSOMAL-PROTEIN-SE
RINE
ACETYLTRANSFERASE,
PUTATIVE

(Vibrio cholerae) 		PF13302
(Acetyltransf_3) 		3 VAL A  72
VAL A  81
GLN A 107
 None
None
NO3  A 302 ( 3.1A)
 0.54A 5qguA-2fckA:
undetectable		 5qguA-2fckA:
21.52
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.
2fqx MEMBRANE LIPOPROTEIN
TMPC

(Treponema
pallidum) 		PF02608
(Bmp) 		3 VAL A 151
VAL A 210
GLN A 124
 None
GMP  A 400 (-4.0A)
GMP  A 400 ( 4.7A)
 0.69A 5qguA-2fqxA:
undetectable		 5qguA-2fqxA:
20.83
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.
2g3w HYPOTHETICAL PROTEIN
XAC2396

(Xanthomonas
citri) 		PF07152
(YaeQ) 		3 VAL A 131
VAL A 104
GLN A  86
 None
 0.62A 5qguA-2g3wA:
undetectable		 5qguA-2g3wA:
20.10
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.
2iou PERTACTIN
EXTRACELLULAR DOMAIN

(Bordetella
bronchiseptica) 		PF03212
(Pertactin) 		3 VAL G 168
VAL G 146
GLN G 152
 None
 0.68A 5qguA-2iouG:
undetectable		 5qguA-2iouG:
16.70
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.
2jza NITRITE REDUCTASE
[NAD(P)H] SMALL
SUBUNIT

(Pectobacterium
atrosepticum) 		PF13806
(Rieske_2) 		3 VAL A 104
VAL A  99
GLN A  38
 None
 0.54A 5qguA-2jzaA:
undetectable		 5qguA-2jzaA:
21.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2n5u TSR0524 PROTEIN

(Thermosynechococcus
elongatus) 		PF11061
(DUF2862) 		3 VAL A  62
VAL A   7
GLN A  29
 None
 0.66A 5qguA-2n5uA:
undetectable		 5qguA-2n5uA:
17.74
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.
2nly DIVERGENT
POLYSACCHARIDE
DEACETYLASE
HYPOTHETICAL PROTEIN

(Bacillus
halodurans) 		PF04748
(Polysacc_deac_2) 		3 VAL A  60
VAL A  83
GLN A  77
 None
 0.65A 5qguA-2nlyA:
undetectable		 5qguA-2nlyA:
21.91
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.
2nlz CEPHALOSPORIN
ACYLASE

(Bacillus
halodurans) 		PF01019
(G_glu_transpept) 		3 VAL A 481
VAL A 502
GLN A 491
 None
 0.68A 5qguA-2nlzA:
undetectable		 5qguA-2nlzA:
17.92
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.
2oap TYPE II SECRETION
SYSTEM PROTEIN

(Archaeoglobus
fulgidus) 		PF00437
(T2SSE) 		3 VAL 1 396
VAL 1 266
GLN 1 371
 None
 0.66A 5qguA-2oap1:
undetectable		 5qguA-2oap1:
16.70
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.
2ou5 PYRIDOXAMINE
5'-PHOSPHATE
OXIDASE-RELATED,
FMN-BINDING

(Jannaschia sp.
CCS1) 		PF12766
(Pyridox_oxase_2) 		3 VAL A 150
VAL A  91
GLN A  16
 None
 0.49A 5qguA-2ou5A:
undetectable		 5qguA-2ou5A:
22.02
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.
2owa ARFGAP-LIKE FINGER
DOMAIN CONTAINING
PROTEIN

(Cryptosporidium
parvum) 		PF01412
(ArfGap) 		3 VAL A  12
VAL A  18
GLN A  88
 None
 0.66A 5qguA-2owaA:
undetectable		 5qguA-2owaA:
21.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2q48 PROTEIN AT5G48480

(Arabidopsis
thaliana) 		no annotation 3 VAL A 148
VAL A 103
GLN A  28
 None
 0.52A 5qguA-2q48A:
undetectable		 5qguA-2q48A:
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.
2q5o PHENYLPYRUVATE
DECARBOXYLASE

(Azospirillum
brasilense) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		3 VAL A  83
VAL A  80
GLN A 121
 None
 0.60A 5qguA-2q5oA:
undetectable		 5qguA-2q5oA:
18.26
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.
2qej SUPERANTIGEN-LIKE
MOLECULE 7

(Staphylococcus
aureus) 		PF02876
(Stap_Strp_tox_C)
PF09199
(SSL_OB) 		3 VAL C 196
VAL C 108
GLN C 142
 None
 0.71A 5qguA-2qejC:
undetectable		 5qguA-2qejC:
21.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qsw METHIONINE IMPORT
ATP-BINDING PROTEIN
METN 2

(Enterococcus
faecalis) 		PF09383
(NIL) 		3 VAL A 341
VAL A 271
GLN A 317
 None
 0.61A 5qguA-2qswA:
undetectable		 5qguA-2qswA:
18.23
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.
2qux COAT PROTEIN

(Pseudomonas
phage PP7) 		PF09063
(Phage_coat) 		3 VAL A  78
VAL A  64
GLN A  61
 None
 0.68A 5qguA-2quxA:
undetectable		 5qguA-2quxA:
23.03
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.
2rin PUTATIVE GLYCINE
BETAINE-BINDING ABC
TRANSPORTER PROTEIN

(Sinorhizobium
meliloti) 		PF04069
(OpuAC) 		3 VAL A  85
VAL A 239
GLN A 255
 None
 0.70A 5qguA-2rinA:
undetectable		 5qguA-2rinA:
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.
2vcd OUTER MEMBRANE
PROTEIN MIP

(Legionella
pneumophila) 		PF00254
(FKBP_C)
PF01346
(FKBP_N) 		3 VAL A 133
VAL A  51
GLN A  91
 None
 0.63A 5qguA-2vcdA:
undetectable		 5qguA-2vcdA:
20.69
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.
2vd2 ATP
PHOSPHORIBOSYLTRANSF
ERASE

(Bacillus
subtilis) 		PF01634
(HisG) 		3 VAL A 155
VAL A  99
GLN A 129
 None
 0.58A 5qguA-2vd2A:
undetectable		 5qguA-2vd2A:
24.68
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.
2vd9 ALANINE RACEMASE

(Bacillus
anthracis) 		PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N) 		3 VAL A 204
VAL A 165
GLN A 190
 None
 0.67A 5qguA-2vd9A:
undetectable		 5qguA-2vd9A:
20.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vda TRANSLOCASE SUBUNIT
SECA

(Escherichia
coli) 		PF01043
(SecA_PP_bind)
PF07516
(SecA_SW)
PF07517
(SecA_DEAD) 		3 VAL A 328
VAL A 333
GLN A 366
 None
 0.69A 5qguA-2vdaA:
undetectable		 5qguA-2vdaA:
12.16
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.
2vnu EXOSOME COMPLEX
EXONUCLEASE RRP44

(Saccharomyces
cerevisiae) 		PF00773
(RNB)
PF17215
(Rrp44_S1)
PF17216
(Rrp44_CSD1) 		3 VAL D 392
VAL D 318
GLN D 275
 None
 0.57A 5qguA-2vnuD:
undetectable		 5qguA-2vnuD:
15.88
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.
2wan PULLULANASE

(Bacillus
acidopullulyticus) 		PF00128
(Alpha-amylase)
PF02922
(CBM_48) 		3 VAL A 616
VAL A 548
GLN A 487
 None
 0.71A 5qguA-2wanA:
undetectable		 5qguA-2wanA:
11.48
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.
2wm8 MAGNESIUM-DEPENDENT
PHOSPHATASE 1

(Homo sapiens) 		PF12689
(Acid_PPase) 		3 VAL A  46
VAL A  38
GLN A  80
 None
 0.65A 5qguA-2wm8A:
undetectable		 5qguA-2wm8A:
24.55
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.
2wqw INTERNALIN B

(Listeria
monocytogenes) 		PF08191
(LRR_adjacent)
PF12354
(Internalin_N)
PF12799
(LRR_4) 		3 VAL A 267
VAL A 259
GLN A 240
 None
 0.68A 5qguA-2wqwA:
undetectable		 5qguA-2wqwA:
20.48
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.
2x60 MANNOSE-1-PHOSPHATE
GUANYLYLTRANSFERASE

(Thermotoga
maritima) 		PF00483
(NTP_transferase) 		3 VAL A 249
VAL A 165
GLN A 167
 None
 0.72A 5qguA-2x60A:
undetectable		 5qguA-2x60A:
21.79
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.
2xfg ENDOGLUCANASE 1

(Ruminiclostridium
thermocellum) 		PF00942
(CBM_3) 		3 VAL B 544
VAL B 534
GLN B 520
 None
 0.66A 5qguA-2xfgB:
undetectable		 5qguA-2xfgB:
19.25
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.
2xvo SSO1725

(Sulfolobus
solfataricus) 		no annotation 3 VAL A  99
VAL A  78
GLN A  90
 None
 0.70A 5qguA-2xvoA:
undetectable		 5qguA-2xvoA:
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.
2yij PHOSPHOLIPASE
A1-IIGAMMA

(Arabidopsis
thaliana) 		PF01764
(Lipase_3) 		3 VAL A 151
VAL A 133
GLN A 211
 None
 0.69A 5qguA-2yijA:
undetectable		 5qguA-2yijA:
20.81
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.
2z8c INSULIN RECEPTOR

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		3 VAL A1140
VAL A1146
GLN A1111
 None
 0.68A 5qguA-2z8cA:
undetectable		 5qguA-2z8cA:
20.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zyz PUTATIVE
UNCHARACTERIZED
PROTEIN PAE0789

(Pyrobaculum
aerophilum) 		no annotation 3 VAL A  77
VAL A  71
GLN A   5
 None
 0.69A 5qguA-2zyzA:
undetectable		 5qguA-2zyzA:
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.
3a71 EXO-ARABINANASE

(Penicillium
chrysogenum) 		no annotation 3 VAL A 371
VAL A 353
GLN A  53
 None
 0.68A 5qguA-3a71A:
undetectable		 5qguA-3a71A:
19.55
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.
3b2z ADAMTS-4

(Homo sapiens) 		PF01421
(Reprolysin) 		3 VAL A 270
VAL A 225
GLN A 296
 None
 0.60A 5qguA-3b2zA:
undetectable		 5qguA-3b2zA:
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.
3b70 ENOYL REDUCTASE

(Aspergillus
terreus) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		3 VAL A  39
VAL A  77
GLN A  85
 None
 0.54A 5qguA-3b70A:
undetectable		 5qguA-3b70A:
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.
3b8y ENDO-PECTATE LYASE

(Dickeya
chrysanthemi) 		PF03211
(Pectate_lyase) 		3 VAL A  90
VAL A  98
GLN A  21
 None
 0.70A 5qguA-3b8yA:
undetectable		 5qguA-3b8yA:
21.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3b8z PROTEIN ADAMTS-5

(Homo sapiens) 		PF01421
(Reprolysin) 		3 VAL A 319
VAL A 274
GLN A 345
 None
 0.52A 5qguA-3b8zA:
undetectable		 5qguA-3b8zA:
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.
3bdl STAPHYLOCOCCAL
NUCLEASE
DOMAIN-CONTAINING
PROTEIN 1

(Homo sapiens) 		PF00565
(SNase)
PF00567
(TUDOR) 		3 VAL A 831
VAL A 836
GLN A 777
 None
 0.68A 5qguA-3bdlA:
undetectable		 5qguA-3bdlA:
16.64
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.
3bl6 5'-METHYLTHIOADENOSI
NE
NUCLEOSIDASE/S-ADENO
SYLHOMOCYSTEINE
NUCLEOSIDASE

(Staphylococcus
aureus) 		PF01048
(PNP_UDP_1) 		3 VAL A 128
VAL A 131
GLN A 219
 None
 0.70A 5qguA-3bl6A:
undetectable		 5qguA-3bl6A:
18.99
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.
3d8n UROPORPHYRINOGEN-III
SYNTHASE

(Thermus
thermophilus) 		PF02602
(HEM4) 		3 VAL A 125
VAL A  52
GLN A  50
 None
 0.65A 5qguA-3d8nA:
undetectable		 5qguA-3d8nA:
20.49
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.
3ehk PRUNIN

(Prunus dulcis) 		PF00190
(Cupin_1) 		3 VAL A 201
VAL A  75
GLN A 445
 None
 0.60A 5qguA-3ehkA:
undetectable		 5qguA-3ehkA:
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.
3faw RETICULOCYTE BINDING
PROTEIN

(Streptococcus
agalactiae) 		PF00128
(Alpha-amylase)
PF02922
(CBM_48) 		3 VAL A 796
VAL A 731
GLN A 659
 None
 0.70A 5qguA-3fawA:
undetectable		 5qguA-3fawA:
13.91
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.
3fjo NADPH-CYTOCHROME
P450 REDUCTASE

(Saccharomyces
cerevisiae;
Homo sapiens) 		PF00175
(NAD_binding_1)
PF00258
(Flavodoxin_1)
PF00667
(FAD_binding_1) 		3 VAL A 608
VAL A 511
GLN A 586
 None
 0.58A 5qguA-3fjoA:
undetectable		 5qguA-3fjoA:
16.06
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.
3g48 CHAPERONE CSAA

(Bacillus
anthracis) 		PF01588
(tRNA_bind) 		3 VAL A  87
VAL A  93
GLN A  48
 None
 0.67A 5qguA-3g48A:
undetectable		 5qguA-3g48A:
20.20
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.
3gfb L-THREONINE
3-DEHYDROGENASE

(Thermococcus
kodakarensis) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		3 VAL A  32
VAL A  76
GLN A  84
 None
 0.62A 5qguA-3gfbA:
undetectable		 5qguA-3gfbA:
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.
3gg0 KLEBSIELLA
PNEUMONIAE BLRP1

(Klebsiella
pneumoniae) 		PF00563
(EAL)
PF04940
(BLUF) 		3 VAL A 184
VAL A 177
GLN A 379
 None
 0.69A 5qguA-3gg0A:
undetectable		 5qguA-3gg0A:
17.94
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.
3hd8 XYLANASE INHIBITOR

(Triticum
aestivum) 		PF14541
(TAXi_C)
PF14543
(TAXi_N) 		3 VAL A 234
VAL A 348
GLN A 354
 None
 0.72A 5qguA-3hd8A:
undetectable		 5qguA-3hd8A:
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.
3hhs PHENOLOXIDASE
SUBUNIT 1

(Manduca sexta) 		PF00372
(Hemocyanin_M)
PF03722
(Hemocyanin_N)
PF03723
(Hemocyanin_C) 		3 VAL B 435
VAL B 489
GLN B 533
 None
 0.63A 5qguA-3hhsB:
undetectable		 5qguA-3hhsB:
14.89
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.
3hz2 BETA/GAMA CRYSTALLIN
FAMILY PROTEIN

(Methanosarcina
acetivorans) 		PF00030
(Crystall) 		3 VAL A  40
VAL A   5
GLN A  83
 None
 0.72A 5qguA-3hz2A:
undetectable		 5qguA-3hz2A:
16.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3i2b 6-PYRUVOYL
TETRAHYDROBIOPTERIN
SYNTHASE

(Homo sapiens) 		PF01242
(PTPS) 		3 VAL A  57
VAL A 130
GLN A 119
 None
 0.67A 5qguA-3i2bA:
undetectable		 5qguA-3i2bA:
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.
3jb8 COAT PROTEIN

(Maize chlorotic
mottle virus) 		PF00729
(Viral_coat) 		3 VAL A 206
VAL A  57
GLN A  64
 None
 0.71A 5qguA-3jb8A:
undetectable		 5qguA-3jb8A:
23.94
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.
3jru PROBABLE CYTOSOL
AMINOPEPTIDASE

(Xanthomonas
oryzae) 		no annotation 3 VAL B  77
VAL B  22
GLN B  35
 None
 0.69A 5qguA-3jruB:
undetectable		 5qguA-3jruB:
17.55
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.
3kq4 CUBILIN

(Homo sapiens) 		PF00431
(CUB) 		3 VAL B1318
VAL B1388
GLN B1286
 None
 0.67A 5qguA-3kq4B:
undetectable		 5qguA-3kq4B:
17.53
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.
3ldb ANTIBODY FAB
FRAGMENT HEAVY CHAIN

(Cricetulus
migratorius) 		PF07654
(C1-set)
PF07686
(V-set) 		3 VAL C 143
VAL C 190
GLN C 198
 None
 0.72A 5qguA-3ldbC:
undetectable		 5qguA-3ldbC:
23.32