SIMILAR PATTERNS OF AMINO ACIDS FOR 3ME6_A_CGEA501_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.
1a5l UREASE (ALPHA
SUBUNIT)

(Klebsiella
aerogenes) 		PF00449
(Urease_alpha)
PF01979
(Amidohydro_1) 		5 PHE C 491
ILE C 214
ALA C 418
ILE C 131
VAL C 155
 None
 1.02A 3me6A-1a5lC:
0.0		 3me6A-1a5lC:
21.14
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.
1ae1 TROPINONE
REDUCTASE-I

(Datura
stramonium) 		PF13561
(adh_short_C2) 		5 ILE A 256
PHE A 247
ALA A 246
ILE A 154
VAL A 199
 None
 1.00A 3me6A-1ae1A:
undetectable		 3me6A-1ae1A:
19.62
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.
1eth TRIACYLGLYCEROL
ACYL-HYDROLASE

(Sus scrofa) 		PF00151
(Lipase)
PF01477
(PLAT) 		5 VAL A 105
PHE A  39
ILE A  75
ALA A 127
VAL A  35
 None
 0.90A 3me6A-1ethA:
0.0		 3me6A-1ethA:
21.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1fta FRUCTOSE-1,6-BISPHOS
PHATASE

(Homo sapiens) 		PF00316
(FBPase) 		5 VAL A 302
ILE A 316
THR A 255
ILE A 261
VAL A 324
 None
 1.01A 3me6A-1ftaA:
0.0		 3me6A-1ftaA:
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.
1g7r TRANSLATION
INITIATION FACTOR
IF2/EIF5B

(Methanothermobacter
thermautotrophicus) 		PF00009
(GTP_EFTU)
PF03144
(GTP_EFTU_D2)
PF11987
(IF-2)
PF14578
(GTP_EFTU_D4) 		5 VAL A 366
PHE A 429
ILE A 407
VAL A 375
VAL A 353
 None
 1.05A 3me6A-1g7rA:
0.0		 3me6A-1g7rA:
21.46
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.
1hjo PROTEIN (HEAT-SHOCK
70KD PROTEIN)

(Homo sapiens) 		PF00012
(HSP70) 		5 ILE A 212
ALA A 178
ILE A 197
VAL A 335
VAL A 195
 None
 0.94A 3me6A-1hjoA:
undetectable		 3me6A-1hjoA:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1mus TN5 TRANSPOSASE

(Escherichia
coli) 		PF01609
(DDE_Tnp_1)
PF02281
(Dimer_Tnp_Tn5)
PF14706
(Tnp_DNA_bind) 		5 VAL A  34
ILE A 355
PHE A  17
ALA A  77
VAL A  69
 None
 1.10A 3me6A-1musA:
0.0		 3me6A-1musA:
22.96
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.
1o7l TRANSCRIPTIONAL
REGULATOR MODE

(Escherichia
coli) 		PF00126
(HTH_1)
PF03459
(TOBE) 		5 ILE A 180
THR A 260
ILE A 135
VAL A 147
VAL A 149
 None
 1.09A 3me6A-1o7lA:
undetectable		 3me6A-1o7lA:
20.62
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.
1o7l TRANSCRIPTIONAL
REGULATOR MODE

(Escherichia
coli) 		PF00126
(HTH_1)
PF03459
(TOBE) 		5 VAL A 256
ILE A 180
ILE A 135
VAL A 147
VAL A 149
 None
 1.03A 3me6A-1o7lA:
undetectable		 3me6A-1o7lA:
20.62
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.
1qy9 HYPOTHETICAL PROTEIN
YDDE

(Escherichia
coli) 		PF02567
(PhzC-PhzF) 		5 ILE A 166
ALA A 136
THR A 133
ILE A 191
VAL A 164
 None
 1.10A 3me6A-1qy9A:
0.0		 3me6A-1qy9A:
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.
1sky F1-ATPASE

(Bacillus sp.
PS3) 		PF00006
(ATP-synt_ab)
PF00306
(ATP-synt_ab_C)
PF02874
(ATP-synt_ab_N) 		5 ILE B 357
ALA B 179
THR B 182
ILE B 159
VAL B 157
 None
 0.83A 3me6A-1skyB:
undetectable		 3me6A-1skyB:
23.45
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.
1tid ANTI-SIGMA F FACTOR

(Geobacillus
stearothermophilus) 		PF13581
(HATPase_c_2) 		5 VAL A  44
ALA A  28
ILE A  70
VAL A  75
VAL A  68
 None
 1.10A 3me6A-1tidA:
undetectable		 3me6A-1tidA:
14.19
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.
1wkb LEUCYL-TRNA
SYNTHETASE

(Pyrococcus
horikoshii) 		PF00133
(tRNA-synt_1)
PF08264
(Anticodon_1) 		5 VAL A  40
PHE A  76
PHE A 137
ALA A 140
ILE A 677
 None
 1.08A 3me6A-1wkbA:
undetectable		 3me6A-1wkbA:
18.98
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.
1x9n DNA LIGASE I

(Homo sapiens) 		PF01068
(DNA_ligase_A_M)
PF04675
(DNA_ligase_A_N)
PF04679
(DNA_ligase_A_C) 		5 VAL A 349
ILE A 427
ALA A 359
THR A 362
VAL A 379
 None
 0.94A 3me6A-1x9nA:
undetectable		 3me6A-1x9nA:
21.23
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.
1z3a TRNA-SPECIFIC
ADENOSINE DEAMINASE

(Escherichia
coli) 		PF14437
(MafB19-deam) 		5 ILE A 106
ALA A 124
ILE A 143
VAL A 113
VAL A 141
 None
 1.02A 3me6A-1z3aA:
undetectable		 3me6A-1z3aA:
14.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zch HYPOTHETICAL
OXIDOREDUCTASE YCND

(Bacillus
subtilis) 		PF00881
(Nitroreductase) 		5 VAL A  48
PHE A  79
ILE A  31
ALA A 125
VAL A  75
 None
 1.03A 3me6A-1zchA:
undetectable		 3me6A-1zchA:
20.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ax4 BIFUNCTIONAL
3'-PHOSPHOADENOSINE
5'-PHOSPHOSULFATE
SYNTHETASE 2

(Homo sapiens) 		PF01583
(APS_kinase) 		5 VAL A 226
ILE A  81
ILE A 128
VAL A  55
VAL A 126
 None
 1.04A 3me6A-2ax4A:
undetectable		 3me6A-2ax4A:
16.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2bvg 6-HYDROXY-D-NICOTINE
OXIDASE

(Paenarthrobacter
nicotinovorans) 		PF01565
(FAD_binding_4)
PF08031
(BBE) 		5 VAL A 247
PHE A 337
ALA A 329
ILE A 319
VAL A 372
 None
 1.10A 3me6A-2bvgA:
undetectable		 3me6A-2bvgA:
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.
2gsk VITAMIN B12
TRANSPORTER BTUB

(Escherichia
coli) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		5 VAL A  52
ILE A  66
ILE A 129
VAL A 107
VAL A 127
 None
 1.02A 3me6A-2gskA:
undetectable		 3me6A-2gskA:
20.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ogx MOLYBDENUM STORAGE
PROTEIN SUBUNIT
ALPHA

(Azotobacter
vinelandii) 		PF00696
(AA_kinase) 		5 ALA A 216
THR A 214
ILE A 195
VAL A 228
VAL A 247
 None
None
ATP  A 281 (-4.8A)
MG  A 291 ( 4.9A)
None
 1.06A 3me6A-2ogxA:
undetectable		 3me6A-2ogxA:
22.45
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.
2oz6 VIRULENCE FACTOR
REGULATOR

(Pseudomonas
aeruginosa) 		PF00027
(cNMP_binding)
PF00325
(Crp) 		5 VAL A  99
ILE A  44
ILE A  51
VAL A  91
VAL A  49
 None
None
CMP  A 301 ( 4.1A)
CMP  A 301 ( 4.9A)
None
 1.10A 3me6A-2oz6A:
undetectable		 3me6A-2oz6A:
18.01
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.
2r6r CELL DIVISION
PROTEIN FTSZ

(Aquifex
aeolicus) 		PF00091
(Tubulin)
PF12327
(FtsZ_C) 		5 VAL 1 283
ILE 1 289
ILE 1 261
VAL 1 305
VAL 1 259
 None
 0.98A 3me6A-2r6r1:
undetectable		 3me6A-2r6r1:
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.
2re2 UNCHARACTERIZED
PROTEIN TA1041

(Thermoplasma
acidophilum) 		PF02579
(Nitro_FeMo-Co) 		5 ILE A  98
PHE A   3
ALA A   4
VAL A  12
VAL A  86
 None
 1.03A 3me6A-2re2A:
undetectable		 3me6A-2re2A:
15.72
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.
2v3c SIGNAL RECOGNITION
54 KDA PROTEIN

(Methanocaldococcus
jannaschii) 		PF00448
(SRP54)
PF02881
(SRP54_N)
PF02978
(SRP_SPB) 		5 VAL C 184
ILE C 124
ALA C 117
ILE C 154
VAL C 156
 None
 1.09A 3me6A-2v3cC:
undetectable		 3me6A-2v3cC:
22.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wzr POLYPROTEIN

(Foot-and-mouth
disease virus) 		PF00073
(Rhv) 		5 VAL 3 204
PHE 3  81
ALA 3  80
VAL 3 185
VAL 3 160
 None
 0.94A 3me6A-2wzr3:
undetectable		 3me6A-2wzr3:
18.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2x05 EXO-BETA-D-GLUCOSAMI
NIDASE

(Amycolatopsis
orientalis) 		PF00703
(Glyco_hydro_2)
PF02837
(Glyco_hydro_2_N) 		5 VAL A 177
ILE A 173
ALA A 185
ILE A  54
VAL A 221
 None
 1.05A 3me6A-2x05A:
undetectable		 3me6A-2x05A:
18.16
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.
2xgt ASPARAGINYL-TRNA
SYNTHETASE,
CYTOPLASMIC

(Brugia malayi) 		PF00152
(tRNA-synt_2)
PF01336
(tRNA_anti-codon) 		5 VAL A 157
ILE A 180
ILE A 206
VAL A 172
VAL A 178
 None
 1.09A 3me6A-2xgtA:
undetectable		 3me6A-2xgtA:
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.
2y3s TAML

(Streptomyces
sp. 307-9) 		PF01565
(FAD_binding_4)
PF08031
(BBE) 		5 VAL A 194
PHE A 489
ILE A  41
ALA A  48
VAL A  35
 FAD  A 600 ( 4.2A)
None
None
None
None
 1.06A 3me6A-2y3sA:
undetectable		 3me6A-2y3sA:
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.
3ajz ANCESTRAL CONGERIN
CON-ANC

(-) 		PF00337
(Gal-bind_lectin) 		5 VAL A  17
PHE A  83
ALA A 121
ILE A  39
VAL A  32
 None
 1.04A 3me6A-3ajzA:
undetectable		 3me6A-3ajzA:
16.78
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.
3ajz ANCESTRAL CONGERIN
CON-ANC

(-) 		PF00337
(Gal-bind_lectin) 		5 VAL A  17
PHE A  83
ILE A 118
ALA A 121
ILE A  39
 None
 1.09A 3me6A-3ajzA:
undetectable		 3me6A-3ajzA:
16.78
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.
3aqp PROBABLE SECDF
PROTEIN-EXPORT
MEMBRANE PROTEIN

(Thermus
thermophilus) 		PF02355
(SecD_SecF)
PF07549
(Sec_GG) 		5 VAL A 585
PHE A 589
ILE A 635
THR A 672
VAL A 716
 None
 1.00A 3me6A-3aqpA:
undetectable		 3me6A-3aqpA:
21.76
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.
3d0q PROTEIN CALG3

(Micromonospora
echinospora) 		PF06722
(DUF1205) 		5 ILE A 341
ALA A 236
ILE A 215
VAL A 282
VAL A 213
 None
 1.10A 3me6A-3d0qA:
undetectable		 3me6A-3d0qA:
20.86
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.
3efv PUTATIVE
SUCCINATE-SEMIALDEHY
DE DEHYDROGENASE

(Salmonella
enterica) 		PF00171
(Aldedh) 		5 VAL A 196
ILE A 200
ALA A 218
VAL A 210
VAL A 208
 NAD  A 463 (-4.2A)
None
None
None
None
 1.09A 3me6A-3efvA:
undetectable		 3me6A-3efvA:
22.16
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.
3fe1 HEAT SHOCK 70 KDA
PROTEIN 6

(Homo sapiens) 		PF00012
(HSP70) 		5 ILE A 214
ALA A 180
ILE A 199
VAL A 337
VAL A 197
 None
 0.87A 3me6A-3fe1A:
undetectable		 3me6A-3fe1A:
21.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gl1 HEAT SHOCK PROTEIN
SSB1

(Saccharomyces
cerevisiae) 		PF00012
(HSP70) 		5 ILE A 215
ALA A 180
ILE A 200
VAL A 338
VAL A 198
 None
 0.88A 3me6A-3gl1A:
undetectable		 3me6A-3gl1A:
21.46
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.
3goc ENDONUCLEASE V

(Streptomyces
avermitilis) 		PF04493
(Endonuclease_5) 		5 VAL A 191
ILE A 139
ALA A 202
THR A 204
VAL A 185
 None
 1.09A 3me6A-3gocA:
undetectable		 3me6A-3gocA:
20.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hh8 METAL ABC
TRANSPORTER
SUBSTRATE-BINDING
LIPOPROTEIN

(Streptococcus
pyogenes) 		PF01297
(ZnuA) 		5 PHE A  86
ILE A  85
ALA A  43
THR A  46
ILE A  54
 None
 1.10A 3me6A-3hh8A:
undetectable		 3me6A-3hh8A:
20.68
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.
3isp HTH-TYPE
TRANSCRIPTIONAL
REGULATOR
RV1985C/MT2039

(Mycobacterium
tuberculosis) 		PF00126
(HTH_1)
PF03466
(LysR_substrate) 		5 VAL A 113
ALA A 107
ILE A 126
VAL A 101
VAL A 124
 None
 1.10A 3me6A-3ispA:
undetectable		 3me6A-3ispA:
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.
3k21 CALCIUM-DEPENDENT
PROTEIN KINASE 3

(Plasmodium
falciparum) 		PF13499
(EF-hand_7) 		5 VAL A 172
ILE A 180
PHE A  34
ALA A  38
ILE A 124
 None
 1.10A 3me6A-3k21A:
undetectable		 3me6A-3k21A:
16.81
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.
3l4i HEAT SHOCK 70
(HSP70) PROTEIN

(Cryptosporidium
parvum) 		PF00012
(HSP70) 		5 ILE A 228
ALA A 194
ILE A 213
VAL A 352
VAL A 211
 None
 0.99A 3me6A-3l4iA:
undetectable		 3me6A-3l4iA:
19.96
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.
3lxu TRIPEPTIDYL-PEPTIDAS
E 2

(Drosophila
melanogaster) 		PF00082
(Peptidase_S8)
PF12580
(TPPII)
PF12583
(TPPII_N) 		5 VAL X 648
ALA X 632
ILE X 566
VAL X 539
VAL X 564
 None
 1.01A 3me6A-3lxuX:
undetectable		 3me6A-3lxuX:
16.93
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.
3lxu TRIPEPTIDYL-PEPTIDAS
E 2

(Drosophila
melanogaster) 		PF00082
(Peptidase_S8)
PF12580
(TPPII)
PF12583
(TPPII_N) 		5 VAL X 648
ALA X 632
ILE X 612
VAL X 564
VAL X 614
 None
 1.02A 3me6A-3lxuX:
undetectable		 3me6A-3lxuX:
16.93
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.
3m7d TOPOISOMERASE V

(Methanopyrus
kandleri) 		PF13412
(HTH_24) 		5 VAL A 232
PHE A 170
ILE A 174
ALA A 141
ILE A 188
 None
 1.10A 3me6A-3m7dA:
undetectable		 3me6A-3m7dA:
23.15
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.
3m7g TOPOISOMERASE V

(Methanopyrus
kandleri) 		PF13404
(HTH_AsnC-type) 		5 VAL A 232
PHE A 170
ILE A 174
ALA A 141
ILE A 188
 None
 1.08A 3me6A-3m7gA:
undetectable		 3me6A-3m7gA:
20.12
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.
3mjz FG41 MALONATE
SEMIALDEHYDE
DECARBOXYLASE

(coryneform
bacterium) 		PF14552
(Tautomerase_2) 		5 VAL A  23
ILE A  68
THR A   8
VAL A  97
VAL A 102
 None
 1.07A 3me6A-3mjzA:
undetectable		 3me6A-3mjzA:
14.78
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.
3no8 BTB/POZ
DOMAIN-CONTAINING
PROTEIN 2

(Homo sapiens) 		PF08005
(PHR) 		5 ILE A 424
PHE A 406
ILE A 401
VAL A 397
VAL A 459
 None
 1.07A 3me6A-3no8A:
undetectable		 3me6A-3no8A:
17.57
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.
3o0d TRIACYLGLYCEROL
LIPASE

(Yarrowia
lipolytica) 		PF01764
(Lipase_3)
PF03893
(Lipase3_N) 		5 VAL A 201
ILE A 173
ALA A 166
ILE A 130
VAL A 125
 None
None
None
NAG  A 303 (-4.5A)
None
 1.07A 3me6A-3o0dA:
undetectable		 3me6A-3o0dA:
19.34
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.
3oee ATP SYNTHASE SUBUNIT
ALPHA

(Saccharomyces
cerevisiae) 		PF00006
(ATP-synt_ab)
PF00306
(ATP-synt_ab_C)
PF02874
(ATP-synt_ab_N) 		5 ILE A 367
ALA A 181
THR A 184
ILE A 161
VAL A 159
 None
 0.79A 3me6A-3oeeA:
undetectable		 3me6A-3oeeA:
24.96
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.
3psg PEPSINOGEN

(Sus scrofa) 		PF00026
(Asp)
PF07966
(A1_Propeptide) 		6 VAL A 153
PHE A 305
ILE A 306
ILE A 192
VAL A 320
VAL A 214
 None
 1.50A 3me6A-3psgA:
undetectable		 3me6A-3psgA:
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.
3pxg NEGATIVE REGULATOR
OF GENETIC
COMPETENCE CLPC/MECB

(Bacillus
subtilis) 		PF00004
(AAA)
PF02151
(UVR)
PF02861
(Clp_N) 		5 VAL A 192
PHE A 277
ILE A 312
ALA A 216
VAL A 339
 None
 0.91A 3me6A-3pxgA:
undetectable		 3me6A-3pxgA:
23.14
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.
3pxi NEGATIVE REGULATOR
OF GENETIC
COMPETENCE CLPC/MECB

(Bacillus
subtilis) 		PF00004
(AAA)
PF02151
(UVR)
PF02861
(Clp_N)
PF07724
(AAA_2)
PF10431
(ClpB_D2-small) 		5 VAL A 192
PHE A 277
ILE A 312
ALA A 216
VAL A 339
 None
 0.90A 3me6A-3pxiA:
undetectable		 3me6A-3pxiA:
20.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ry7 RIBOKINASE

(Staphylococcus
aureus) 		PF00294
(PfkB) 		5 VAL A 138
PHE A 256
ILE A 257
ALA A 274
VAL A 184
 None
 1.09A 3me6A-3ry7A:
undetectable		 3me6A-3ry7A:
20.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3sno HYPOTHETICAL
AMINOTRANSFERASE

(Corynebacterium
glutamicum) 		PF01063
(Aminotran_4) 		5 PHE A 250
ILE A 231
ALA A 248
VAL A 279
VAL A 224
 None
 0.96A 3me6A-3snoA:
undetectable		 3me6A-3snoA:
21.50
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3tk3 CYTOCHROME P450 2B4

(Oryctolagus
cuniculus) 		PF00067
(p450) 		8 VAL A 104
PHE A 108
ILE A 209
ALA A 298
THR A 302
ILE A 363
VAL A 367
VAL A 477
 None
None
None
CPZ  A 501 (-3.5A)
CPZ  A 501 ( 3.7A)
HEM  A 500 ( 3.9A)
HEM  A 500 ( 4.3A)
None
 0.53A 3me6A-3tk3A:
62.9		 3me6A-3tk3A:
99.79
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3tk3 CYTOCHROME P450 2B4

(Oryctolagus
cuniculus) 		PF00067
(p450) 		6 VAL A 104
PHE A 108
ILE A 209
PHE A 297
ALA A 298
THR A 302
 None
None
None
CPZ  A 501 (-4.3A)
CPZ  A 501 (-3.5A)
CPZ  A 501 ( 3.7A)
 1.05A 3me6A-3tk3A:
62.9		 3me6A-3tk3A:
99.79
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.
3urg ALR1010 PROTEIN

(Nostoc sp. PCC
7120) 		PF11535
(Calci_bind_CcbP) 		5 VAL A  65
PHE A  42
ILE A 100
ALA A 112
VAL A 105
 None
NA  A 127 (-4.5A)
None
None
None
 0.88A 3me6A-3urgA:
undetectable		 3me6A-3urgA:
14.71
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.
3ux8 EXCINUCLEASE ABC, A
SUBUNIT

(Geobacillus sp.
Y412MC52) 		PF00005
(ABC_tran) 		5 VAL A 710
PHE A 711
ILE A 799
ALA A 792
VAL A 703
 None
 1.03A 3me6A-3ux8A:
undetectable		 3me6A-3ux8A:
23.42
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.
3zbi TRAF PROTEIN

(Escherichia
coli) 		PF03743
(TrbI) 		5 VAL A 889
ILE A 820
THR A 816
VAL A 767
VAL A 787
 None
 0.91A 3me6A-3zbiA:
undetectable		 3me6A-3zbiA:
20.08
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.
4bgb PUTATIVE SUGAR
KINASE MK0840

(Methanopyrus
kandleri) 		PF03702
(AnmK) 		5 VAL A  70
ILE A  91
ILE A 124
VAL A 109
VAL A  95
 GOL  A1354 ( 4.9A)
GOL  A1354 ( 4.5A)
None
None
None
 1.09A 3me6A-4bgbA:
undetectable		 3me6A-4bgbA:
20.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4db4 ATP-DEPENDENT RNA
HELICASE MSS116,
MITOCHONDRIAL

(Saccharomyces
cerevisiae) 		PF00271
(Helicase_C) 		5 PHE A 385
ILE A 529
ALA A 353
ILE A 392
VAL A 519
 None
 1.09A 3me6A-4db4A:
undetectable		 3me6A-4db4A:
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.
4ddw REVERSE GYRASE

(Thermotoga
maritima) 		PF00270
(DEAD)
PF01131
(Topoisom_bac)
PF01751
(Toprim) 		5 VAL A1035
PHE A1002
ILE A 762
ALA A1005
VAL A 758
 None
 1.05A 3me6A-4ddwA:
undetectable		 3me6A-4ddwA:
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.
4ex4 MALATE SYNTHASE G

(Mycobacterium
leprae) 		PF01274
(Malate_synthase) 		5 VAL A 105
PHE A 510
ALA A 455
ILE A 436
VAL A 434
 None
 1.10A 3me6A-4ex4A:
undetectable		 3me6A-4ex4A:
20.61
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.
4f6t MOLYBDENUM STORAGE
PROTEIN SUBUNIT
ALPHA

(Azotobacter
vinelandii) 		PF00696
(AA_kinase) 		5 ALA A 216
THR A 214
ILE A 195
VAL A 228
VAL A 247
 None
None
ATP  A 301 ( 4.9A)
None
None
 1.05A 3me6A-4f6tA:
undetectable		 3me6A-4f6tA:
20.17
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.
4f9u CG32412

(Drosophila
melanogaster) 		PF04389
(Peptidase_M28) 		5 VAL A 322
PHE A 318
ALA A 112
ILE A 211
VAL A 213
 None
 1.04A 3me6A-4f9uA:
undetectable		 3me6A-4f9uA:
22.45
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.
4fx5 VON WILLEBRAND
FACTOR TYPE A

(Catenulispora
acidiphila) 		PF13768
(VWA_3) 		5 PHE A 186
ALA A 143
ILE A  59
VAL A  96
VAL A  57
 None
 1.06A 3me6A-4fx5A:
undetectable		 3me6A-4fx5A:
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.
4g7e UREASE

(Cajanus cajan) 		PF00449
(Urease_alpha)
PF00547
(Urease_gamma)
PF00699
(Urease_beta)
PF01979
(Amidohydro_1) 		5 PHE B 536
ILE B 533
THR B 543
ILE B 557
VAL B 529
 None
 1.07A 3me6A-4g7eB:
undetectable		 3me6A-4g7eB:
20.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gfj TOPOISOMERASE V

(Methanopyrus
kandleri) 		PF13412
(HTH_24)
PF14520
(HHH_5) 		5 VAL A 232
PHE A 170
ILE A 174
ALA A 141
ILE A 188
 None
 1.08A 3me6A-4gfjA:
undetectable		 3me6A-4gfjA:
22.27
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.
4h09 HYPOTHETICAL LEUCINE
RICH REPEAT PROTEIN

(Eubacterium
ventriosum) 		PF13306
(LRR_5) 		5 VAL A 236
ILE A 232
ALA A 266
ILE A 278
VAL A 282
 None
 0.91A 3me6A-4h09A:
undetectable		 3me6A-4h09A:
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.
4h1x PHOSPHATE-BINDING
PROTEIN PSTS 2

(Streptococcus
pneumoniae) 		PF12849
(PBP_like_2) 		6 VAL A 260
PHE A  52
ILE A  94
ALA A  74
VAL A  83
VAL A  87
 None
 1.34A 3me6A-4h1xA:
undetectable		 3me6A-4h1xA:
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.
4hse CHAPERONE PROTEIN
CLPB

(Thermus
thermophilus) 		PF00004
(AAA) 		5 VAL A 182
PHE A 268
ILE A 303
ALA A 206
VAL A 329
 None
None
None
ADP  A 602 (-3.6A)
None
 0.94A 3me6A-4hseA:
undetectable		 3me6A-4hseA:
23.74
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.
4hwi HEAT SHOCK COGNATE
71 KDA PROTEIN

(Homo sapiens) 		PF00012
(HSP70) 		5 ILE A 212
ALA A 178
ILE A 197
VAL A 335
VAL A 195
 None
 0.92A 3me6A-4hwiA:
undetectable		 3me6A-4hwiA:
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.
4j8f HEAT SHOCK 70 KDA
PROTEIN 1A/1B,
HSC70-INTERACTING
PROTEIN

(Homo sapiens;
Rattus
norvegicus) 		PF00012
(HSP70) 		5 ILE A 212
ALA A 178
ILE A 197
VAL A 335
VAL A 195
 None
 0.93A 3me6A-4j8fA:
undetectable		 3me6A-4j8fA:
23.20
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.
4jcl CYCLOMALTODEXTRIN
GLUCANOTRANSFERASE

(Paenibacillus
macerans) 		PF00128
(Alpha-amylase)
PF00686
(CBM_20)
PF01833
(TIG) 		5 VAL A 582
ILE A 554
ILE A 518
VAL A 505
VAL A 516
 None
 1.09A 3me6A-4jclA:
undetectable		 3me6A-4jclA:
21.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4kkd MANNAN-BINDING
LECTIN SERINE
PROTEASE 1

(Homo sapiens) 		PF00084
(Sushi)
PF00089
(Trypsin) 		5 ALA A 555
THR A 494
ILE A 467
VAL A 516
VAL A 518
 None
 1.09A 3me6A-4kkdA:
undetectable		 3me6A-4kkdA:
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.
4kr9 PROBABLE TRNA
SULFURTRANSFERASE

(Thermotoga
maritima) 		PF02568
(ThiI)
PF02926
(THUMP) 		5 VAL A  91
ILE A 129
ILE A 121
VAL A 149
VAL A 105
 None
None
None
None
A  M  39 ( 4.1A)
 0.97A 3me6A-4kr9A:
undetectable		 3me6A-4kr9A:
20.62
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.
4q2w PUTATIVE
ENDO-BETA-N-ACETYLGL
UCOSAMINIDASE

(Streptococcus
pneumoniae) 		PF01832
(Glucosaminidase) 		5 PHE A 206
ILE A 269
ALA A 180
ILE A 276
VAL A 272
 None
 1.00A 3me6A-4q2wA:
undetectable		 3me6A-4q2wA:
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.
4q5t LIPOPROTEIN

(Streptococcus
mutans) 		PF03180
(Lipoprotein_9) 		5 VAL A 188
ALA A 198
THR A 120
ILE A 215
VAL A 205
 None
 1.08A 3me6A-4q5tA:
undetectable		 3me6A-4q5tA:
19.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4r04 TOXIN A

(Clostridioides
difficile) 		PF11713
(Peptidase_C80)
PF12918
(TcdB_N)
PF12919
(TcdA_TcdB)
PF12920
(TcdA_TcdB_pore) 		5 VAL A 106
ILE A 231
PHE A 135
ALA A 134
ILE A 239
 None
 1.05A 3me6A-4r04A:
undetectable		 3me6A-4r04A:
13.71
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.
4rae HISTIDINOL-PHOSPHATE
AMINOTRANSFERASE

(Mycobacterium
tuberculosis) 		PF00155
(Aminotran_1_2) 		5 ILE A 171
ALA A 144
ILE A 121
VAL A 161
VAL A 169
 None
 1.09A 3me6A-4raeA:
undetectable		 3me6A-4raeA:
24.56
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.
4x33 PROTEIN ATS1

(Saccharomyces
cerevisiae) 		PF00415
(RCC1) 		5 VAL B 289
ILE B 274
PHE B   7
ALA B   6
ILE B  41
 None
 1.06A 3me6A-4x33B:
undetectable		 3me6A-4x33B:
21.46
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.
4xn3 TAIL SPIKE PROTEIN

(Salmonella
virus HK620) 		no annotation 5 VAL A 485
ILE A 465
ALA A 392
ILE A 420
VAL A 449
 None
 1.04A 3me6A-4xn3A:
undetectable		 3me6A-4xn3A:
20.85
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.
4y2o CFA/I FIMBRIAL
SUBUNIT A
(COLONIZATION FACTOR
ANTIGEN SUBUNIT A
PUTATIVE CHAPERONE)

(Escherichia
coli) 		no annotation 5 PHE A 187
ILE A 181
THR A 189
ILE A 160
VAL A 157
 None
 1.04A 3me6A-4y2oA:
undetectable		 3me6A-4y2oA:
19.21
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.
5aca VP3

(Foot-and-mouth
disease virus) 		PF00073
(Rhv) 		5 VAL 3 205
PHE 3  80
ALA 3  79
VAL 3 186
VAL 3 161
 None
 1.04A 3me6A-5aca3:
undetectable		 3me6A-5aca3:
18.14
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.
5b2o CRISPR-ASSOCIATED
ENDONUCLEASE CAS9

(Francisella
tularensis) 		no annotation 5 VAL A  19
ILE A 873
PHE A1095
ALA A1096
ILE A 893
 None
 1.08A 3me6A-5b2oA:
undetectable		 3me6A-5b2oA:
14.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5e0e CYTOCHROME P450
FAMILY 2 SUBFAMILY B

(Neotoma lepida) 		PF00067
(p450) 		6 ILE A 209
PHE A 297
ALA A 298
THR A 302
ILE A 363
VAL A 367
 None
None
HEM  A 501 ( 3.1A)
CPZ  A 502 ( 4.0A)
HEM  A 501 (-4.1A)
HEM  A 501 ( 4.4A)
 1.08A 3me6A-5e0eA:
53.7		 3me6A-5e0eA:
79.87
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5e0e CYTOCHROME P450
FAMILY 2 SUBFAMILY B

(Neotoma lepida) 		PF00067
(p450) 		7 VAL A 104
PHE A 108
ILE A 209
ALA A 298
THR A 302
ILE A 363
VAL A 367
 None
None
None
HEM  A 501 ( 3.1A)
CPZ  A 502 ( 4.0A)
HEM  A 501 (-4.1A)
HEM  A 501 ( 4.4A)
 1.00A 3me6A-5e0eA:
53.7		 3me6A-5e0eA:
79.87
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.
5fpn HEAT SHOCK-RELATED
70 KDA PROTEIN 2

(Homo sapiens) 		PF00012
(HSP70) 		5 ILE A 214
ALA A 178
ILE A 199
VAL A 337
VAL A 197
 None
 0.82A 3me6A-5fpnA:
undetectable		 3me6A-5fpnA:
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.
5gqs PTS GALACTITOL
TRANSPORTER SUBUNIT
IIB

(Staphylococcus
aureus) 		PF02302
(PTS_IIB) 		5 ILE A  86
ALA A  21
ILE A  35
VAL A   6
VAL A   4
 None
 1.03A 3me6A-5gqsA:
undetectable		 3me6A-5gqsA:
13.27
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.
5i2t PERIODIC TRYPTOPHAN
PROTEIN 2

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		5 VAL A 390
PHE A 383
ILE A 369
ALA A 413
VAL A 361
 None
 1.01A 3me6A-5i2tA:
undetectable		 3me6A-5i2tA:
21.27
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.
5jd8 PERIPLASMIC SERINE
PEPTIDASE DEGS

(Yersinia pestis) 		PF13180
(PDZ_2)
PF13365
(Trypsin_2) 		5 VAL A 324
ILE A 330
ALA A 292
ILE A 303
VAL A 306
 None
 1.00A 3me6A-5jd8A:
undetectable		 3me6A-5jd8A:
23.40
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.
5ol6 NUCLEIC ACID
BINDING, OB-FOLD,
TRNA/HELICASE-TYPE,D
NA-DIRECTED DNA
POLYMERASE

(Nostoc
punctiforme) 		no annotation 5 VAL A  75
ILE A  33
ALA A  36
ILE A  50
VAL A  72
 None
 1.07A 3me6A-5ol6A:
undetectable		 3me6A-5ol6A:
15.76
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.
5u2w SHORT CHAIN
DEHYDROGENASE

(Burkholderia
cenocepacia) 		PF00106
(adh_short) 		5 VAL A  89
ALA A 215
THR A 188
ILE A 240
VAL A 183
 None
None
NAP  A 301 (-4.4A)
None
None
 1.02A 3me6A-5u2wA:
undetectable		 3me6A-5u2wA:
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.
5ubj ALPHA-L-ARABINOFURAN
OSIDASE AXHA-2

(Aspergillus
nidulans) 		PF03664
(Glyco_hydro_62) 		5 VAL A 212
ILE A 179
ALA A 182
ILE A 149
VAL A 156
 None
 1.07A 3me6A-5ubjA:
undetectable		 3me6A-5ubjA:
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.
5utt SORTASE

(Actinomyces
oris) 		PF04203
(Sortase) 		5 VAL A 170
PHE A 179
ILE A 114
PHE A 143
ALA A 144
 None
 1.00A 3me6A-5uttA:
undetectable		 3me6A-5uttA:
16.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5wbg CYTOCHROME P450 2B6

(Homo sapiens) 		no annotation 9 VAL A 104
PHE A 108
PHE A 206
ILE A 209
PHE A 297
ALA A 298
THR A 302
VAL A 367
VAL A 477
 None
9ZJ  A 502 (-4.4A)
9ZJ  A 502 (-2.6A)
9ZJ  A 502 ( 4.8A)
9ZJ  A 502 ( 4.5A)
9ZJ  A 502 ( 3.5A)
9ZJ  A 502 ( 3.9A)
9ZJ  A 502 ( 4.2A)
None
 0.54A 3me6A-5wbgA:
59.1		 3me6A-5wbgA:
86.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5wbg CYTOCHROME P450 2B6

(Homo sapiens) 		no annotation 7 VAL A 104
PHE A 115
PHE A 206
ILE A 209
PHE A 297
ALA A 298
THR A 302
 None
9ZJ  A 502 (-4.7A)
9ZJ  A 502 (-2.6A)
9ZJ  A 502 ( 4.8A)
9ZJ  A 502 ( 4.5A)
9ZJ  A 502 ( 3.5A)
9ZJ  A 502 ( 3.9A)
 1.46A 3me6A-5wbgA:
59.1		 3me6A-5wbgA:
86.25
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.
5wgc DAUNORUBICIN-DOXORUB
ICIN POLYKETIDE
SYNTHASE

(Streptomyces
peucetius) 		no annotation 5 PHE A 277
ILE A 282
ALA A 275
VAL A 325
VAL A 262
 None
None
AFY  A 401 (-3.6A)
None
None
 0.92A 3me6A-5wgcA:
undetectable		 3me6A-5wgcA:
11.29
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.
5xzq HYDROXYNITRILE LYASE

(Passiflora
edulis) 		no annotation 5 PHE A  77
PHE A  86
ALA A  87
ILE A  97
VAL A  99
 None
 1.00A 3me6A-5xzqA:
undetectable		 3me6A-5xzqA:
14.07
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.
6axe MALATE SYNTHASE G

(Mycobacterium
marinum) 		PF01274
(Malate_synthase) 		5 VAL A 105
PHE A 509
ALA A 454
ILE A 435
VAL A 433
 None
 1.10A 3me6A-6axeA:
undetectable		 3me6A-6axeA:
20.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6btm ALTERNATIVE COMPLEX
III SUBUNIT D

(Flavobacterium
johnsoniae) 		no annotation 5 PHE D 160
ALA D  19
THR D  23
ILE D  30
VAL D  33
 None
 0.91A 3me6A-6btmD:
undetectable		 3me6A-6btmD:
9.22