SIMILAR PATTERNS OF AMINO ACIDS FOR 3UQ6_A_ADNA401_2

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.
1a59 CITRATE SYNTHASE

(Antarctic
bacterium
DS2-3R)
PF00285
(Citrate_synt)
4 LEU A 340
ALA A 343
MET A  94
PHE A 130
None
1.49A 3uq6A-1a59A:
undetectable
3uq6A-1a59A:
21.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1bsl BACTERIAL LUCIFERASE

(Vibrio harveyi)
PF00296
(Bac_luciferase)
4 LEU A   5
ALA A  40
MET A  24
ASN A   9
None
1.47A 3uq6A-1bslA:
undetectable
3uq6A-1bslA:
20.60
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.
1e6i TRANSCRIPTIONAL
ACTIVATOR GCN5


(Saccharomyces
cerevisiae)
PF00439
(Bromodomain)
4 LEU A 420
ALA A 396
PHE A 424
ASN A 401
None
1.47A 3uq6A-1e6iA:
undetectable
3uq6A-1e6iA:
17.41
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.
1ef9 METHYLMALONYL COA
DECARBOXYLASE


(Escherichia
coli)
PF00378
(ECH_1)
4 LEU A 160
ALA A 172
MET A 116
PHE A 129
None
1.23A 3uq6A-1ef9A:
undetectable
3uq6A-1ef9A:
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.
1geg ACETOIN REDUCTASE

(Klebsiella
pneumoniae)
PF00106
(adh_short)
4 LEU A 170
ALA A 121
PHE A 125
ASN A 136
None
1.45A 3uq6A-1gegA:
6.6
3uq6A-1gegA:
24.80
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.
1js6 DOPA DECARBOXYLASE

(Sus scrofa)
PF00282
(Pyridoxal_deC)
4 LEU A 153
ALA A 155
PHE A 238
ASN A 298
None
1.42A 3uq6A-1js6A:
undetectable
3uq6A-1js6A:
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.
1msk COBALAMIN-DEPENDENT
METHIONINE SYNTHASE


(Escherichia
coli)
PF02965
(Met_synt_B12)
4 ALA A1090
MET A 983
PHE A 950
ASN A1084
None
1.43A 3uq6A-1mskA:
undetectable
3uq6A-1mskA:
20.87
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.
1npe NIDOGEN

(Mus musculus)
PF00058
(Ldl_recept_b)
4 LEU A1117
ALA A1149
MET A1154
ASN A1132
None
1.38A 3uq6A-1npeA:
undetectable
3uq6A-1npeA:
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.
1o8u 6-OXO CAMPHOR
HYDROLASE


(Rhodococcus
erythropolis)
PF00378
(ECH_1)
4 LEU A 164
ALA A 184
PHE A 140
ASN A 191
None
0.97A 3uq6A-1o8uA:
undetectable
3uq6A-1o8uA:
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.
1oh9 ACETYLGLUTAMATE
KINASE


(Escherichia
coli)
PF00696
(AA_kinase)
4 LEU A 142
ALA A  92
PHE A  24
ASN A  85
None
1.24A 3uq6A-1oh9A:
undetectable
3uq6A-1oh9A:
23.97
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.
1pq4 PERIPLASMIC BINDING
PROTEIN COMPONENT OF
AN ABC TYPE ZINC
UPTAKE TRANSPORTER


(Synechocystis
sp. PCC 6803)
PF01297
(ZnuA)
4 LEU A 312
ALA A 327
PHE A 249
ASN A 334
None
1.48A 3uq6A-1pq4A:
4.3
3uq6A-1pq4A:
23.30
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.
1r30 BIOTIN SYNTHASE

(Escherichia
coli)
PF04055
(Radical_SAM)
PF06968
(BATS)
4 LEU A 291
ALA A 263
PHE A 285
ASN A 153
DTB  A 502 ( 3.3A)
DTB  A 502 (-3.4A)
DTB  A 502 (-4.5A)
DTB  A 502 ( 3.7A)
1.40A 3uq6A-1r30A:
2.2
3uq6A-1r30A:
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.
1tjy SUGAR TRANSPORT
PROTEIN


(Salmonella
enterica)
PF13407
(Peripla_BP_4)
4 LEU A 225
ALA A 227
PHE A 158
ASN A 195
None
1.47A 3uq6A-1tjyA:
4.7
3uq6A-1tjyA:
23.10
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.
1ttx ONCOMODULIN

(Homo sapiens)
PF13499
(EF-hand_7)
4 LEU A  59
ALA A 100
PHE A  48
ASN A  92
None
1.28A 3uq6A-1ttxA:
undetectable
3uq6A-1ttxA:
15.13
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.
1uyp BETA-FRUCTOSIDASE

(Thermotoga
maritima)
PF00251
(Glyco_hydro_32N)
PF08244
(Glyco_hydro_32C)
4 LEU A  60
ALA A  63
PHE A  31
ASN A 112
None
1.45A 3uq6A-1uypA:
undetectable
3uq6A-1uypA:
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.
1vb3 THREONINE SYNTHASE

(Escherichia
coli)
PF00291
(PALP)
PF14821
(Thr_synth_N)
4 ALA A  18
MET A 114
PHE A  15
ASN A 209
None
1.48A 3uq6A-1vb3A:
undetectable
3uq6A-1vb3A:
21.44
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.
1vbj PROSTAGLANDIN F
SYNTHASE


(Trypanosoma
brucei)
PF00248
(Aldo_ket_red)
4 LEU A   7
MET A 158
PHE A  73
ASN A  11
None
1.46A 3uq6A-1vbjA:
3.2
3uq6A-1vbjA:
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.
1vdk FUMARATE HYDRATASE
CLASS II


(Thermus
thermophilus)
PF00206
(Lyase_1)
PF10415
(FumaraseC_C)
4 LEU A  66
ALA A  56
PHE A 242
ASN A 108
None
1.44A 3uq6A-1vdkA:
undetectable
3uq6A-1vdkA:
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.
1vki HYPOTHETICAL PROTEIN
ATU3699


(Agrobacterium
fabrum)
PF04073
(tRNA_edit)
4 LEU A 138
ALA A 111
PHE A 154
ASN A  51
None
1.46A 3uq6A-1vkiA:
undetectable
3uq6A-1vkiA:
19.58
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.
1vpe PHOSPHOGLYCERATE
KINASE


(Thermotoga
maritima)
PF00162
(PGK)
4 LEU A 388
ALA A 392
MET A 171
ASN A 143
None
1.36A 3uq6A-1vpeA:
5.8
3uq6A-1vpeA:
23.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zpv ACT DOMAIN PROTEIN

(Streptococcus
pneumoniae)
PF13740
(ACT_6)
4 LEU A  28
ALA A   3
PHE A  56
ASN A  -2
None
1.43A 3uq6A-1zpvA:
undetectable
3uq6A-1zpvA:
14.05
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.
2bjs ISOPENICILLIN N
SYNTHETASE


(Aspergillus
nidulans)
PF03171
(2OG-FeII_Oxy)
PF14226
(DIOX_N)
4 LEU A 157
ALA A 161
MET A 257
PHE A 170
None
1.22A 3uq6A-2bjsA:
undetectable
3uq6A-2bjsA:
21.39
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.
2dj6 HYPOTHETICAL PROTEIN
PH0634


(Pyrococcus
horikoshii)
PF01242
(PTPS)
4 LEU A  63
ALA A  13
PHE A  31
ASN A  69
LEU  A  63 ( 0.5A)
ALA  A  13 ( 0.0A)
PHE  A  31 ( 1.3A)
ASN  A  69 ( 0.6A)
1.44A 3uq6A-2dj6A:
undetectable
3uq6A-2dj6A:
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.
2fo1 LIN-12 PROTEIN

(Caenorhabditis
elegans)
PF00023
(Ank)
PF12796
(Ank_2)
4 LEU E1131
ALA E1136
MET E1099
ASN E1124
None
1.31A 3uq6A-2fo1E:
undetectable
3uq6A-2fo1E:
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.
2hh9 THIAMIN
PYROPHOSPHOKINASE


(Candida
albicans)
PF04263
(TPK_catalytic)
PF04265
(TPK_B1_binding)
4 LEU A  54
ALA A 199
PHE A 228
ASN A 141
None
1.27A 3uq6A-2hh9A:
undetectable
3uq6A-2hh9A:
22.92
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.
2i80 D-ALANINE-D-ALANINE
LIGASE


(Staphylococcus
aureus)
PF01820
(Dala_Dala_lig_N)
PF07478
(Dala_Dala_lig_C)
4 LEU A  22
ALA A 315
PHE A 316
ASN A  29
None
1.40A 3uq6A-2i80A:
undetectable
3uq6A-2i80A:
23.61
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.
2o2q FORMYLTETRAHYDROFOLA
TE DEHYDROGENASE


(Rattus
norvegicus)
PF00171
(Aldedh)
4 LEU A 680
ALA A 835
PHE A 859
ASN A 706
None
None
None
GOL  A   1 (-3.3A)
1.17A 3uq6A-2o2qA:
3.7
3uq6A-2o2qA:
25.33
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.
2o3e NEUROLYSIN

(Rattus
norvegicus)
PF01432
(Peptidase_M3)
4 LEU A 449
ALA A 427
PHE A 429
ASN A 452
None
1.44A 3uq6A-2o3eA:
undetectable
3uq6A-2o3eA:
19.85
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.
2pq6 UDP-GLUCURONOSYL/UDP
-GLUCOSYLTRANSFERASE


(Medicago
truncatula)
PF00201
(UDPGT)
4 LEU A 314
ALA A 317
MET A 308
PHE A 343
None
1.28A 3uq6A-2pq6A:
5.8
3uq6A-2pq6A:
21.36
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.
2qy1 PECTATE LYASE II

(Xanthomonas
campestris)
PF00544
(Pec_lyase_C)
4 LEU A 130
ALA A 107
PHE A 109
ASN A 157
None
1.41A 3uq6A-2qy1A:
undetectable
3uq6A-2qy1A:
22.43
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.
2r7y RIBONUCLEASE H

(Bacillus
halodurans)
no annotation 4 LEU A 117
ALA A 165
PHE A 110
ASN A 170
None
1.24A 3uq6A-2r7yA:
undetectable
3uq6A-2r7yA:
17.72
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.
2rjn RESPONSE REGULATOR
RECEIVER:METAL-DEPEN
DENT
PHOSPHOHYDROLASE, HD
SUBDOMAIN


(Neptuniibacter
caesariensis)
PF00072
(Response_reg)
4 LEU A  41
ALA A  43
MET A  61
PHE A  69
None
1.50A 3uq6A-2rjnA:
5.5
3uq6A-2rjnA:
17.58
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.
2v5i SALMONELLA
TYPHIMURIUM DB7155
BACTERIOPHAGE DET7
TAILSPIKE


(unidentified
phage)
PF09251
(PhageP22-tail)
4 LEU A 486
ALA A 510
PHE A 517
ASN A 469
None
1.35A 3uq6A-2v5iA:
undetectable
3uq6A-2v5iA:
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.
2xu2 UPF0271 PROTEIN
PA4511


(Pseudomonas
aeruginosa)
PF03746
(LamB_YcsF)
4 LEU A 229
MET A 148
PHE A 174
ASN A  38
None
None
CIT  A1249 (-3.9A)
None
1.42A 3uq6A-2xu2A:
2.4
3uq6A-2xu2A:
23.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2z3k LEUCYL/PHENYLALANYL-
TRNA-PROTEIN
TRANSFERASE


(Escherichia
coli)
PF03588
(Leu_Phe_trans)
4 LEU A 219
ALA A 148
PHE A 153
ASN A  92
None
1.24A 3uq6A-2z3kA:
undetectable
3uq6A-2z3kA:
19.53
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.
3a28 L-2.3-BUTANEDIOL
DEHYDROGENASE


(Corynebacterium
glutamicum)
no annotation 4 LEU C 172
ALA C 123
PHE C 127
ASN C 138
None
1.38A 3uq6A-3a28C:
6.6
3uq6A-3a28C:
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.
3d1n POU DOMAIN, CLASS 6,
TRANSCRIPTION FACTOR
1


(Homo sapiens)
PF00046
(Homeobox)
PF00157
(Pou)
4 LEU I 163
ALA I 212
MET I 172
PHE I 226
None
1.33A 3uq6A-3d1nI:
undetectable
3uq6A-3d1nI:
17.60
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.
3esh PROTEIN SIMILAR TO
METAL-DEPENDENT
HYDROLASE


(Staphylococcus
aureus)
PF00753
(Lactamase_B)
4 LEU A  11
ALA A  64
PHE A 126
ASN A  68
None
1.28A 3uq6A-3eshA:
undetectable
3uq6A-3eshA:
22.28
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.
3fk9 MUTATOR MUTT PROTEIN

(Bacillus
halodurans)
PF00293
(NUDIX)
4 LEU A 144
ALA A 115
MET A  66
PHE A 142
None
1.33A 3uq6A-3fk9A:
undetectable
3uq6A-3fk9A:
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.
3gcf TERMINAL OXYGENASE
COMPONENT OF
CARBAZOLE
1,9A-DIOXYGENASE


(Nocardioides
aromaticivorans)
PF00355
(Rieske)
PF11723
(Aromatic_hydrox)
4 LEU A  55
ALA A  27
PHE A  31
ASN A 176
None
1.28A 3uq6A-3gcfA:
undetectable
3uq6A-3gcfA:
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.
3git CARBON MONOXIDE
DEHYDROGENASE/ACETYL
-COA SYNTHASE
SUBUNIT ALPHA


(Moorella
thermoacetica)
PF03598
(CdhC)
4 LEU A 587
ALA A 603
MET A 729
PHE A 644
None
1.35A 3uq6A-3gitA:
undetectable
3uq6A-3gitA:
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.
3h09 IMMUNOGLOBULIN A1
PROTEASE


(Haemophilus
influenzae)
PF02395
(Peptidase_S6)
PF03212
(Pertactin)
4 LEU A 279
ALA A 244
MET A  74
ASN A  43
None
1.50A 3uq6A-3h09A:
undetectable
3uq6A-3h09A:
17.56
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.
3kwr PUTATIVE RNA-BINDING
PROTEIN


(Lactobacillus
plantarum)
no annotation 4 LEU A  53
ALA A  31
PHE A  25
ASN A  47
None
1.08A 3uq6A-3kwrA:
undetectable
3uq6A-3kwrA:
15.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lfl GLUTATHIONE
S-TRANSFERASE
OMEGA-1


(Homo sapiens)
PF13417
(GST_N_3)
PF14497
(GST_C_3)
4 LEU A  56
ALA A 235
PHE A 224
ASN A 231
GSH  A 241 (-3.7A)
None
None
None
1.36A 3uq6A-3lflA:
undetectable
3uq6A-3lflA:
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.
3lo0 INORGANIC
PYROPHOSPHATASE


(Ehrlichia
chaffeensis)
PF00719
(Pyrophosphatase)
4 LEU A  73
ALA A  75
PHE A 131
ASN A  25
None
1.48A 3uq6A-3lo0A:
undetectable
3uq6A-3lo0A:
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.
3lst CALO1
METHYLTRANSFERASE


(Micromonospora
echinospora)
PF00891
(Methyltransf_2)
4 LEU A 144
ALA A 305
PHE A 118
ASN A 256
None
1.01A 3uq6A-3lstA:
undetectable
3uq6A-3lstA:
22.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3m7n PROBABLE EXOSOME
COMPLEX EXONUCLEASE
1


(Archaeoglobus
fulgidus)
PF01138
(RNase_PH)
PF03725
(RNase_PH_C)
4 LEU D 173
ALA D 163
MET D  47
ASN D 142
None
1.49A 3uq6A-3m7nD:
undetectable
3uq6A-3m7nD:
21.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qna 6-CARBOXY-5,6,7,8-TE
TRAHYDROPTERIN
SYNTHASE


(Escherichia
coli)
PF01242
(PTPS)
4 LEU A  68
ALA A  13
PHE A  34
ASN A  74
None
1.23A 3uq6A-3qnaA:
undetectable
3uq6A-3qnaA:
21.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3r0o CARNITINYL-COA
DEHYDRATASE


(Mycobacterium
avium)
PF00378
(ECH_1)
4 LEU A 159
ALA A 179
PHE A 136
ASN A 186
None
1.34A 3uq6A-3r0oA:
undetectable
3uq6A-3r0oA:
21.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3r9s CARNITINYL-COA
DEHYDRATASE


(Mycobacterium
avium)
PF00378
(ECH_1)
4 LEU A 153
ALA A 173
PHE A 130
ASN A 180
None
1.35A 3uq6A-3r9sA:
2.8
3uq6A-3r9sA:
21.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3uk1 TRANSKETOLASE

(Burkholderia
thailandensis)
PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C)
4 LEU A 201
MET A  53
PHE A  80
ASN A  84
None
None
None
OCS  A 177 ( 4.2A)
1.29A 3uq6A-3uk1A:
undetectable
3uq6A-3uk1A:
19.44
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.
3up9 PUTATIVE
UNCHARACTERIZED
PROTEIN


(Actinomyces
odontolyticus)
PF03180
(Lipoprotein_9)
4 LEU A 100
ALA A 103
MET A 300
ASN A 149
None
1.25A 3uq6A-3up9A:
undetectable
3uq6A-3up9A:
21.93
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3vas PUTATIVE ADENOSINE
KINASE


(Schistosoma
mansoni)
PF00294
(PfkB)
5 LEU A  16
ALA A  65
MET A 134
PHE A 169
ASN A 298
ADN  A 401 (-4.7A)
ADN  A 401 (-3.8A)
ADN  A 401 ( 4.0A)
ADN  A 401 (-3.7A)
ADN  A 401 (-3.7A)
0.19A 3uq6A-3vasA:
62.7
3uq6A-3vasA:
99.46
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.
3vvd AMINO ACID ABC
TRANSPORTER, BINDING
PROTEIN


(Thermus
thermophilus)
PF00497
(SBP_bac_3)
4 LEU A 205
ALA A 196
PHE A  91
ASN A  68
None
0.95A 3uq6A-3vvdA:
undetectable
3uq6A-3vvdA:
24.54
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.
3w6x MPR1 PROTEIN

(Saccharomyces
cerevisiae)
no annotation 4 LEU A 153
ALA A  44
MET A 228
ASN A 159
None
1.44A 3uq6A-3w6xA:
undetectable
3uq6A-3w6xA:
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.
4c2x GLYCYLPEPTIDE
N-TETRADECANOYLTRANS
FERASE 2


(Homo sapiens)
PF01233
(NMT)
PF02799
(NMT_C)
4 ALA A 452
MET A 435
PHE A 467
ASN A 424
None
1.44A 3uq6A-4c2xA:
undetectable
3uq6A-4c2xA:
24.24
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.
4c9m CYTOCHROME P450

(Novosphingobium
aromaticivorans)
PF00067
(p450)
4 LEU A 254
ALA A 183
MET A 100
ASN A 205
None
1.33A 3uq6A-4c9mA:
undetectable
3uq6A-4c9mA:
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.
4ezi UNCHARACTERIZED
PROTEIN


(Legionella
pneumophila)
no annotation 4 LEU A  67
ALA A 129
MET A 141
ASN A 124
None
1.12A 3uq6A-4eziA:
undetectable
3uq6A-4eziA:
21.64
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.
4jwv SHORT CHAIN
ENOYL-COA HYDRATASE


(Novosphingobium
aromaticivorans)
PF00378
(ECH_1)
4 LEU A 150
ALA A 170
PHE A 127
ASN A 177
None
1.11A 3uq6A-4jwvA:
undetectable
3uq6A-4jwvA:
23.50
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.
4mrp ABC TRANSPORTER
RELATED PROTEIN


(Novosphingobium
aromaticivorans)
PF00005
(ABC_tran)
PF00664
(ABC_membrane)
4 LEU A 311
MET A 280
PHE A 176
ASN A 305
None
1.39A 3uq6A-4mrpA:
undetectable
3uq6A-4mrpA:
20.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ntm 6-CARBOXY-5,6,7,8-TE
TRAHYDROPTERIN
SYNTHASE


(Escherichia
coli)
PF01242
(PTPS)
4 LEU A  69
ALA A  14
PHE A  35
ASN A  75
None
1.24A 3uq6A-4ntmA:
undetectable
3uq6A-4ntmA:
18.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4oe6 DELTA-1-PYRROLINE-5-
CARBOXYLATE
DEHYDROGENASE,
MITOCHONDRIAL


(Saccharomyces
cerevisiae)
PF00171
(Aldedh)
4 LEU A 220
ALA A 215
PHE A 169
ASN A 212
None
1.40A 3uq6A-4oe6A:
undetectable
3uq6A-4oe6A:
21.96
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.
4ww3 RHODOPSIN

(Todarodes
pacificus)
PF00001
(7tm_1)
4 LEU A 165
ALA A 167
PHE A 120
ASN A 200
None
None
RET  A 401 (-4.0A)
None
1.42A 3uq6A-4ww3A:
undetectable
3uq6A-4ww3A:
21.19
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.
4xeu TRANSKETOLASE

(Pseudomonas
aeruginosa)
PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C)
4 ALA A 151
MET A  33
PHE A  60
ASN A  64
None
1.47A 3uq6A-4xeuA:
undetectable
3uq6A-4xeuA:
21.30
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.
4ycr TELLURITE RESISTANCE
PROTEIN TEHA HOMOLOG


(Haemophilus
influenzae)
PF03595
(SLAC1)
4 LEU A 298
ALA A 259
PHE A 260
ASN A 254
None
BOG  A 401 (-4.0A)
None
None
1.22A 3uq6A-4ycrA:
undetectable
3uq6A-4ycrA:
22.87
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.
4zgs PUTATIVE D-LACTATE
DEHYDROGENASE


(Chlamydomonas
reinhardtii)
PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C)
4 LEU A 331
ALA A 145
MET A 262
ASN A 151
None
1.45A 3uq6A-4zgsA:
4.2
3uq6A-4zgsA:
21.40
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.
5a2r ANGIOTENSIN-CONVERTI
NG ENZYME


(Drosophila
melanogaster)
PF01401
(Peptidase_M2)
4 LEU A 556
ALA A 567
PHE A 393
ASN A 572
None
1.25A 3uq6A-5a2rA:
undetectable
3uq6A-5a2rA:
20.50
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.
5a8r METHYL-COENZYME M
REDUCTASE II SUBUNIT
GAMMA
METHYL-COENZYME M
REDUCTASE II,
SUBUNIT BETA


(Methanothermobacter
marburgensis)
PF02240
(MCR_gamma)
PF02241
(MCR_beta)
PF02783
(MCR_beta_N)
4 LEU B 332
ALA B 328
MET C 109
ASN B 317
None
1.42A 3uq6A-5a8rB:
undetectable
3uq6A-5a8rB:
22.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5cs4 ACETYL-COA
CARBOXYLASE


(Saccharomyces
cerevisiae)
PF08326
(ACC_central)
4 LEU A1086
ALA A1102
MET A1264
ASN A1223
None
1.49A 3uq6A-5cs4A:
undetectable
3uq6A-5cs4A:
22.15
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.
5e6k POLYKETIDE SYNTHASE
PKSL


(Bacillus
subtilis)
PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc)
4 LEU A 492
ALA A 440
MET A 498
PHE A 442
None
1.45A 3uq6A-5e6kA:
undetectable
3uq6A-5e6kA:
24.12
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.
5ei0 SERPIN A12

(Homo sapiens)
PF00079
(Serpin)
4 LEU A  74
ALA A 356
PHE A 404
ASN A 206
None
1.48A 3uq6A-5ei0A:
undetectable
3uq6A-5ei0A:
23.06
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.
5fif CARBOXYLASE

(Deinococcus
radiodurans)
PF01039
(Carboxyl_trans)
4 LEU A 377
ALA A 416
PHE A 414
ASN A 345
None
1.45A 3uq6A-5fifA:
3.0
3uq6A-5fifA:
21.02
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.
5fis EXD1

(Bombyx mori)
PF01612
(DNA_pol_A_exo1)
4 LEU B 135
ALA B 105
PHE B 102
ASN B 110
None
1.40A 3uq6A-5fisB:
undetectable
3uq6A-5fisB:
20.42
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.
5g06 EXOSOME COMPLEX
COMPONENT CSL4


(Saccharomyces
cerevisiae)
PF10447
(EXOSC1)
4 LEU I 156
ALA I 193
PHE I 201
ASN I 126
None
1.41A 3uq6A-5g06I:
undetectable
3uq6A-5g06I:
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.
5g3z ADENYLATE KINSE

(synthetic
construct)
PF00406
(ADK)
PF05191
(ADK_lid)
4 LEU A 107
ALA A  93
PHE A 185
ASN A  98
None
1.48A 3uq6A-5g3zA:
2.2
3uq6A-5g3zA:
20.27
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.
5hdm GLUTAMATE-1-SEMIALDE
HYDE 2,1-AMINOMUTASE
1, CHLOROPLASTIC


(Arabidopsis
thaliana)
PF00202
(Aminotran_3)
4 LEU A  44
ALA A  20
PHE A  17
ASN A  29
None
1.42A 3uq6A-5hdmA:
undetectable
3uq6A-5hdmA:
22.98
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.
5i6e ACETYL-COA
CARBOXYLASE


(Saccharomyces
cerevisiae)
PF08326
(ACC_central)
4 LEU A1086
ALA A1102
MET A1264
ASN A1223
None
1.45A 3uq6A-5i6eA:
undetectable
3uq6A-5i6eA:
19.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5j78 ACETALDEHYDE
DEHYDROGENASE
(ACETYLATING)


(Parageobacillus
thermoglucosidasius)
PF00171
(Aldedh)
4 LEU A 346
ALA A 348
PHE A 359
ASN A 302
None
1.36A 3uq6A-5j78A:
undetectable
3uq6A-5j78A:
26.47
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.
5lw6 DDB_G0293866

(Dictyostelium
discoideum)
no annotation 4 LEU A  51
ALA A  46
MET A  64
PHE A 215
None
1.44A 3uq6A-5lw6A:
undetectable
3uq6A-5lw6A:
24.15
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.
5mg3 PROTEIN TRANSLOCASE
SUBUNIT SECD


(Escherichia
coli)
PF02355
(SecD_SecF)
PF07549
(Sec_GG)
PF13721
(SecD-TM1)
4 LEU D 483
ALA D 520
MET D 468
ASN D 525
None
1.14A 3uq6A-5mg3D:
undetectable
3uq6A-5mg3D:
19.78
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.
5n1q METHYL-COENZYME M
REDUCTASE III FROM
METHANOTHERMOCOCCUS
THERMOLITHOTROPHICUS
SUBUNIT BETA
METHYL-COENZYME M
REDUCTASE III FROM
METHANOTHERMOCOCCUS
THERMOLITHOTROPHICUS
SUBUNIT GAMMA


(Methanothermococcus
thermolithotrophicus)
PF02240
(MCR_gamma)
PF02241
(MCR_beta)
PF02783
(MCR_beta_N)
4 LEU B 332
ALA B 328
MET C 109
ASN B 317
None
1.35A 3uq6A-5n1qB:
undetectable
3uq6A-5n1qB:
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.
5n28 METHYL-COENZYME M
REDUCTASE, BETA
SUBUNIT
METHYL-COENZYME M
REDUCTASE, GAMMA
SUBUNIT


(Methanotorris
formicicus)
PF02240
(MCR_gamma)
PF02241
(MCR_beta)
PF02783
(MCR_beta_N)
4 LEU B 333
ALA B 329
MET C 109
ASN B 318
None
1.30A 3uq6A-5n28B:
undetectable
3uq6A-5n28B:
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.
5ndf POLYPEPTIDE
N-ACETYLGALACTOSAMIN
YLTRANSFERASE 2


(Homo sapiens)
no annotation 4 LEU A 278
ALA A 384
MET A 305
ASN A 335
None
None
None
EDO  A 604 ( 4.3A)
1.39A 3uq6A-5ndfA:
undetectable
3uq6A-5ndfA:
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.
5vai UNCHARACTERIZED
PROTEIN


(Oryctolagus
cuniculus)
PF00002
(7tm_2)
PF02793
(HRM)
4 LEU R 359
ALA R 399
PHE R 184
ASN R 406
None
1.16A 3uq6A-5vaiR:
undetectable
3uq6A-5vaiR:
20.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5vbf NAD-DEPENDENT
SUCCINATE-SEMIALDEHY
DE DEHYDROGENASE


(Burkholderia
vietnamiensis)
PF00171
(Aldedh)
4 LEU A 415
ALA A 261
MET A 446
ASN A 440
None
1.24A 3uq6A-5vbfA:
undetectable
3uq6A-5vbfA:
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.
5wai POLYCOMB PROTEIN
SUZ12


(Homo sapiens)
no annotation 4 LEU B  87
ALA B  89
PHE B  90
ASN B 435
None
1.25A 3uq6A-5waiB:
undetectable
3uq6A-5waiB:
11.08
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.
5y7r IRON/ALPHA-KETOGLUTA
RATE-DEPENDENT
DIOXYGENASE ASQJ


(Aspergillus
nidulans)
no annotation 4 LEU B 226
ALA B 202
PHE B  38
ASN B 157
None
None
None
58K  B 403 ( 3.7A)
1.37A 3uq6A-5y7rB:
undetectable
3uq6A-5y7rB:
13.29
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.
5ys9 ACYL-COENZYME A
OXIDASE 3


(Yarrowia
lipolytica)
no annotation 4 LEU A 233
ALA A 212
PHE A 129
ASN A 275
None
1.27A 3uq6A-5ys9A:
undetectable
3uq6A-5ys9A:
12.72
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.
5z0y SERINE
HYDROXYMETHYLTRANSFE
RASE


(Komagataella
phaffii)
no annotation 4 LEU A  93
ALA A  95
MET A 258
PHE A  96
None
1.01A 3uq6A-5z0yA:
undetectable
3uq6A-5z0yA:
12.90
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.
6byi BETA-MANNOSIDASE

(Xanthomonas
citri)
no annotation 4 LEU A 166
ALA A  68
MET A 143
ASN A 211
None
1.25A 3uq6A-6byiA:
undetectable
3uq6A-6byiA:
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.
6c4m YERSINOPINE
DEHYDROGENASE


(Yersinia pestis)
no annotation 4 LEU C 147
ALA C 232
MET C 209
ASN C 199
None
1.36A 3uq6A-6c4mC:
3.4
3uq6A-6c4mC:
15.85
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.
6c66 CRISPR-ASSOCIATED
PROTEIN, CSE1 FAMILY


(Thermobifida
fusca)
no annotation 4 LEU A  68
ALA A  66
PHE A 377
ASN A 235
None
1.44A 3uq6A-6c66A:
undetectable
3uq6A-6c66A:
13.60
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.
6cc4 SOLUBLE CYTOCHROME
B562, LIPID II
FLIPPASE MURJ
CHIMERA


(Escherichia
coli)
no annotation 4 LEU A  91
ALA A  94
MET A 233
PHE A  55
None
1.41A 3uq6A-6cc4A:
undetectable
3uq6A-6cc4A:
15.19
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.
6ccz SERINE
HYDROXYMETHYLTRANSFE
RASE


(Medicago
truncatula)
no annotation 4 LEU A 162
ALA A 164
MET A 327
PHE A 165
None
1.05A 3uq6A-6cczA:
undetectable
3uq6A-6cczA:
13.91