SIMILAR PATTERNS OF AMINO ACIDS FOR 6IFT_A_SAMA301_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.
1f82 BOTULINUM NEUROTOXIN
TYPE B

(Clostridium
botulinum) 		PF01742
(Peptidase_M27) 		5 ILE A 158
GLY A 188
ILE A 172
ASP A 173
PRO A  24
 None
 1.05A 6iftA-1f82A:
undetectable		 6iftA-1f82A:
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.
1m2w MANNITOL
DEHYDROGENASE

(Pseudomonas
fluorescens) 		PF01232
(Mannitol_dh)
PF08125
(Mannitol_dh_C) 		5 LEU A  56
ILE A  99
GLY A 100
ASP A  80
PRO A  18
 None
 1.04A 6iftA-1m2wA:
undetectable		 6iftA-1m2wA:
22.81
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.
1mjf SPERMIDINE SYNTHASE

(Pyrococcus
furiosus) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 ILE A  81
GLY A  82
GLY A  84
ILE A 105
ASP A 106
 None
 0.50A 6iftA-1mjfA:
10.1		 6iftA-1mjfA:
23.08
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.
1ne2 HYPOTHETICAL PROTEIN
TA1320

(Thermoplasma
acidophilum) 		PF06325
(PrmA) 		5 GLY A  56
GLY A  58
ILE A  79
ASP A  80
VAL A 101
 None
 0.50A 6iftA-1ne2A:
12.6		 6iftA-1ne2A:
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.
1o5w AMINE OXIDASE
[FLAVIN-CONTAINING]
A

(Rattus
norvegicus) 		PF01593
(Amino_oxidase) 		5 ILE A  19
GLY A  20
GLY A  22
ALA A  27
VAL A 244
 FAD  A 652 (-4.8A)
FAD  A 652 (-3.3A)
FAD  A 652 (-3.4A)
None
FAD  A 652 (-3.9A)
 0.69A 6iftA-1o5wA:
undetectable		 6iftA-1o5wA:
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.
1obb ALPHA-GLUCOSIDASE

(Thermotoga
maritima) 		PF02056
(Glyco_hydro_4)
PF11975
(Glyco_hydro_4C) 		5 ILE A   9
GLY A  10
GLY A  12
ILE A  40
ASP A  41
 None
NAD  A 500 (-3.5A)
NAD  A 500 (-3.0A)
NAD  A 500 (-3.9A)
None
 0.68A 6iftA-1obbA:
2.7		 6iftA-1obbA:
23.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1qyr HIGH LEVEL
KASUGAMYCIN
RESISTANCE PROTEIN

(Escherichia
coli) 		PF00398
(RrnaAD) 		8 PHE A  19
LEU A  20
GLU A  43
GLY A  45
GLY A  47
ALA A  50
ASP A  68
PRO A 115
 None
 0.77A 6iftA-1qyrA:
28.4		 6iftA-1qyrA:
33.71
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1qyr HIGH LEVEL
KASUGAMYCIN
RESISTANCE PROTEIN

(Escherichia
coli) 		PF00398
(RrnaAD) 		9 PHE A  19
LEU A  20
GLU A  43
ILE A  44
GLY A  45
GLY A  47
ALA A  50
ASP A  68
LEU A  71
 None
 0.62A 6iftA-1qyrA:
28.4		 6iftA-1qyrA:
33.71
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.
1sez PROTOPORPHYRINOGEN
OXIDASE,
MITOCHONDRIAL

(Nicotiana
tabacum) 		PF01593
(Amino_oxidase) 		5 ILE A  19
GLY A  20
GLY A  22
ALA A  27
VAL A 264
 FAD  A 600 (-4.7A)
FAD  A 600 (-3.4A)
FAD  A 600 (-3.3A)
None
FAD  A 600 (-3.8A)
 0.74A 6iftA-1sezA:
3.2		 6iftA-1sezA:
22.03
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.
1tt7 YHFP

(Bacillus
subtilis) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 GLY A  48
GLY A  51
ALA A  53
ILE A  43
LEU A  65
 None
 1.06A 6iftA-1tt7A:
4.6		 6iftA-1tt7A:
22.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1up4 6-PHOSPHO-BETA-GLUCO
SIDASE

(Thermotoga
maritima) 		PF02056
(Glyco_hydro_4)
PF11975
(Glyco_hydro_4C) 		5 ILE A   6
GLY A   7
GLY A   9
ILE A  37
ASP A  38
 None
 0.77A 6iftA-1up4A:
3.0		 6iftA-1up4A:
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.
1v6t HYPOTHETICAL UPF0271
PROTEIN PH0986

(Pyrococcus
horikoshii) 		PF03746
(LamB_YcsF) 		5 GLY A  60
ALA A  31
ILE A 132
LEU A 105
PRO A 110
 None
 1.02A 6iftA-1v6tA:
undetectable		 6iftA-1v6tA:
25.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1vbf 231AA LONG
HYPOTHETICAL
PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Sulfurisphaera
tokodaii) 		PF01135
(PCMT) 		5 GLU A  76
ILE A  77
GLY A  78
GLY A  80
ILE A 100
 None
 0.27A 6iftA-1vbfA:
9.1		 6iftA-1vbfA:
23.81
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.
1vqz LIPOATE-PROTEIN
LIGASE, PUTATIVE

(Streptococcus
pneumoniae) 		PF03099
(BPL_LplA_LipB)
PF10437
(Lip_prot_lig_C) 		5 PHE A 262
ILE A 252
GLY A 251
ALA A 263
ASP A 167
 EDO  A 408 (-4.1A)
None
UNL  A 400 (-3.5A)
None
None
 1.02A 6iftA-1vqzA:
undetectable		 6iftA-1vqzA:
25.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xj5 SPERMIDINE SYNTHASE
1

(Arabidopsis
thaliana) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 ILE A 127
GLY A 128
GLY A 130
ILE A 152
ASP A 153
 None
 0.36A 6iftA-1xj5A:
10.5		 6iftA-1xj5A:
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.
1zkd DUF185

(Rhodopseudomonas
palustris) 		PF02636
(Methyltransf_28) 		6 GLU A  86
ILE A  87
GLY A  88
GLY A  90
ILE A 119
LEU A 123
 None
 0.56A 6iftA-1zkdA:
8.1		 6iftA-1zkdA:
22.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1zq9 PROBABLE
DIMETHYLADENOSINE
TRANSFERASE

(Homo sapiens) 		PF00398
(RrnaAD) 		6 GLU A  62
GLY A  64
GLY A  66
ASP A  87
LEU A  90
VAL A 114
 None
SAM  A4000 (-3.1A)
SAM  A4000 (-3.2A)
None
SAM  A4000 (-4.8A)
SAM  A4000 (-3.9A)
 0.62A 6iftA-1zq9A:
27.0		 6iftA-1zq9A:
31.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1zq9 PROBABLE
DIMETHYLADENOSINE
TRANSFERASE

(Homo sapiens) 		PF00398
(RrnaAD) 		6 LEU A  39
GLU A  62
GLY A  64
GLY A  66
LEU A  90
VAL A 114
 None
None
SAM  A4000 (-3.1A)
SAM  A4000 (-3.2A)
SAM  A4000 (-4.8A)
SAM  A4000 (-3.9A)
 0.58A 6iftA-1zq9A:
27.0		 6iftA-1zq9A:
31.53
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.
2b2c SPERMIDINE SYNTHASE

(Caenorhabditis
elegans) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 ILE A 115
GLY A 116
GLY A 118
ILE A 140
ASP A 141
 None
 0.72A 6iftA-2b2cA:
9.2		 6iftA-2b2cA:
24.63
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.
2dw4 LYSINE-SPECIFIC
HISTONE DEMETHYLASE
1

(Homo sapiens) 		PF01593
(Amino_oxidase)
PF04433
(SWIRM) 		5 ILE A 284
GLY A 285
GLY A 287
ALA A 292
VAL A 590
 None
FAD  A1001 (-3.2A)
FAD  A1001 (-3.3A)
None
FAD  A1001 (-3.8A)
 0.76A 6iftA-2dw4A:
3.0		 6iftA-2dw4A:
19.35
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2h1r DIMETHYLADENOSINE
TRANSFERASE,
PUTATIVE

(Plasmodium
falciparum) 		PF00398
(RrnaAD) 		6 GLU A  27
ILE A  28
GLY A  29
GLY A  31
ILE A  51
ASP A  52
 None
 0.90A 6iftA-2h1rA:
24.3		 6iftA-2h1rA:
31.01
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2h1r DIMETHYLADENOSINE
TRANSFERASE,
PUTATIVE

(Plasmodium
falciparum) 		PF00398
(RrnaAD) 		5 LEU A   4
GLU A  27
ILE A  28
GLY A  29
GLY A  31
 None
 0.62A 6iftA-2h1rA:
24.3		 6iftA-2h1rA:
31.01
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.
2ipp CATHEPSIN B

(Homo sapiens) 		PF00112
(Peptidase_C1) 		5 GLU B 171
ILE B 201
GLY B 172
ALA B  77
VAL B 217
 None
 0.98A 6iftA-2ippB:
undetectable		 6iftA-2ippB:
19.52
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.
2pbh PROCATHEPSIN B

(Homo sapiens) 		PF00112
(Peptidase_C1)
PF08127
(Propeptide_C1) 		5 GLU A 171
ILE A 201
GLY A 172
ALA A  77
VAL A 217
 None
 0.91A 6iftA-2pbhA:
undetectable		 6iftA-2pbhA:
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.
2uzz N-METHYL-L-TRYPTOPHA
N OXIDASE

(Escherichia
coli) 		PF01266
(DAO) 		5 ILE A   8
GLY A   9
GLY A  11
ALA A  16
VAL A 172
 None
FAD  A1373 (-3.5A)
FAD  A1373 (-3.4A)
None
FAD  A1373 (-3.7A)
 0.70A 6iftA-2uzzA:
2.9		 6iftA-2uzzA:
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.
2ypf AVRBS3

(Xanthomonas
campestris) 		PF03377
(TAL_effector) 		5 LEU A 238
ILE A 263
GLY A 267
ALA A 237
VAL A 295
 None
 1.05A 6iftA-2ypfA:
undetectable		 6iftA-2ypfA:
16.76
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.
2yxe PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Methanocaldococcus
jannaschii) 		PF01135
(PCMT) 		5 GLU A  83
ILE A  84
GLY A  85
GLY A  87
LEU A 114
 None
 0.49A 6iftA-2yxeA:
10.1		 6iftA-2yxeA:
22.59
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.
2zsu SPERMIDINE SYNTHASE

(Pyrococcus
horikoshii) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 ILE A  83
GLY A  84
GLY A  86
ILE A 108
ASP A 109
 None
 0.51A 6iftA-2zsuA:
10.2		 6iftA-2zsuA:
22.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zwv PROBABLE RIBOSOMAL
RNA SMALL SUBUNIT
METHYLTRANSFERASE

(Thermus
thermophilus) 		PF05175
(MTS) 		5 GLY A 241
ALA A 246
ASP A 264
VAL A 289
PRO A 307
 SAH  A 376 (-3.1A)
SAH  A 376 (-3.3A)
None
SAH  A 376 (-4.0A)
SAH  A 376 ( 4.3A)
 0.79A 6iftA-2zwvA:
9.2		 6iftA-2zwvA:
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.
2zwv PROBABLE RIBOSOMAL
RNA SMALL SUBUNIT
METHYLTRANSFERASE

(Thermus
thermophilus) 		PF05175
(MTS) 		5 GLY A 241
GLY A 243
ALA A 246
ASP A 264
PRO A 307
 SAH  A 376 (-3.1A)
SAH  A 376 (-3.4A)
SAH  A 376 (-3.3A)
None
SAH  A 376 ( 4.3A)
 0.57A 6iftA-2zwvA:
9.2		 6iftA-2zwvA:
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.
3anx SPERMIDINE SYNTHASE

(Thermus
thermophilus) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 GLY A  85
GLY A  87
ALA A  90
ILE A 109
ASP A 110
 MTA  A 315 (-3.2A)
MTA  A 315 (-4.0A)
None
MTA  A 315 (-3.7A)
None
 0.60A 6iftA-3anxA:
9.5		 6iftA-3anxA:
23.58
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.
3bkx SAM-DEPENDENT
METHYLTRANSFERASE

(Lactobacillus
paracasei) 		PF13649
(Methyltransf_25) 		5 GLU A  48
ILE A  49
GLY A  50
GLY A  52
ILE A  75
 None
 0.77A 6iftA-3bkxA:
10.9		 6iftA-3bkxA:
24.39
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.
3cin MYO-INOSITOL-1-PHOSP
HATE
SYNTHASE-RELATED
PROTEIN

(Thermotoga
maritima) 		PF01658
(Inos-1-P_synth)
PF07994
(NAD_binding_5) 		5 GLU A 118
GLY A  86
ALA A 111
ILE A  83
ASP A  53
 None
None
None
None
NAD  A 400 (-2.9A)
 1.06A 6iftA-3cinA:
3.9		 6iftA-3cinA:
23.88
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.
3cin MYO-INOSITOL-1-PHOSP
HATE
SYNTHASE-RELATED
PROTEIN

(Thermotoga
maritima) 		PF01658
(Inos-1-P_synth)
PF07994
(NAD_binding_5) 		5 LEU A  35
GLY A 322
GLY A  32
ALA A  36
VAL A  12
 None
None
None
None
NAD  A 400 ( 3.7A)
 1.01A 6iftA-3cinA:
3.9		 6iftA-3cinA:
23.88
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.
3dlc PUTATIVE
S-ADENOSYL-L-METHION
INE-DEPENDENT
METHYLTRANSFERASE

(Methanococcus
maripaludis) 		PF08241
(Methyltransf_11) 		5 ILE A  49
GLY A  50
GLY A  52
ALA A  55
VAL A 101
 None
SAM  A 220 (-3.5A)
SAM  A 220 (-3.2A)
SAM  A 220 ( 4.9A)
SAM  A 220 ( 4.2A)
 0.80A 6iftA-3dlcA:
9.8		 6iftA-3dlcA:
24.41
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.
3evz METHYLTRANSFERASE

(Pyrococcus
furiosus) 		PF05175
(MTS) 		5 GLU A  86
ILE A  87
GLY A  88
GLY A  90
ASP A 113
 None
 0.62A 6iftA-3evzA:
12.4		 6iftA-3evzA:
23.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fdb PUTATIVE
PLP-DEPENDENT
BETA-CYSTATHIONASE

(Corynebacterium
diphtheriae) 		PF00155
(Aminotran_1_2) 		5 LEU A 120
ILE A 153
GLY A 128
VAL A 142
PRO A 110
 None
 1.06A 6iftA-3fdbA:
undetectable		 6iftA-3fdbA:
23.45
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3fut DIMETHYLADENOSINE
TRANSFERASE

(Thermus
thermophilus) 		PF00398
(RrnaAD) 		7 LEU A  30
GLU A  52
GLY A  54
GLY A  56
ALA A  59
ASP A  77
LEU A  80
 None
 0.54A 6iftA-3futA:
29.0		 6iftA-3futA:
37.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3fut DIMETHYLADENOSINE
TRANSFERASE

(Thermus
thermophilus) 		PF00398
(RrnaAD) 		6 PHE A  29
LEU A  30
GLY A  54
GLY A  56
ASP A  77
LEU A  80
 None
 0.54A 6iftA-3futA:
29.0		 6iftA-3futA:
37.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3fyd PROBABLE
DIMETHYLADENOSINE
TRANSFERASE

(Methanocaldococcus
jannaschii) 		PF00398
(RrnaAD) 		6 LEU A  44
ILE A  58
GLY A  40
ILE A  60
ASP A  61
LEU A  64
 None
 1.33A 6iftA-3fydA:
28.7		 6iftA-3fydA:
37.87
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3fyd PROBABLE
DIMETHYLADENOSINE
TRANSFERASE

(Methanocaldococcus
jannaschii) 		PF00398
(RrnaAD) 		9 PHE A  12
GLU A  36
ILE A  37
GLY A  38
GLY A  40
ILE A  60
ASP A  61
LEU A  64
PRO A 103
 None
 0.57A 6iftA-3fydA:
28.7		 6iftA-3fydA:
37.87
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3fyd PROBABLE
DIMETHYLADENOSINE
TRANSFERASE

(Methanocaldococcus
jannaschii) 		PF00398
(RrnaAD) 		7 PHE A  12
LEU A  13
GLU A  36
GLY A  38
ILE A  60
ASP A  61
LEU A  64
 None
 0.61A 6iftA-3fydA:
28.7		 6iftA-3fydA:
37.87
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3gry DIMETHYLADENOSINE
TRANSFERASE

(Methanocaldococcus
jannaschii) 		PF00398
(RrnaAD) 		9 PHE A  12
GLU A  36
ILE A  37
GLY A  38
GLY A  40
ILE A  60
ASP A  61
LEU A  64
PRO A 103
 None
SAM  A 300 (-4.4A)
None
SAM  A 300 (-3.3A)
SAM  A 300 (-3.3A)
SAM  A 300 (-3.9A)
None
SAM  A 300 (-4.8A)
SAM  A 300 (-3.8A)
 0.53A 6iftA-3gryA:
28.5		 6iftA-3gryA:
36.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3gry DIMETHYLADENOSINE
TRANSFERASE

(Methanocaldococcus
jannaschii) 		PF00398
(RrnaAD) 		9 PHE A  12
LEU A  13
GLU A  36
ILE A  37
GLY A  38
GLY A  40
ILE A  60
ASP A  61
LEU A  64
 None
SAM  A 300 (-4.0A)
SAM  A 300 (-4.4A)
None
SAM  A 300 (-3.3A)
SAM  A 300 (-3.3A)
SAM  A 300 (-3.9A)
None
SAM  A 300 (-4.8A)
 0.53A 6iftA-3gryA:
28.5		 6iftA-3gryA:
36.75
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.
3hrd NICOTINATE
DEHYDROGENASE
FAD-SUBUNIT

(Eubacterium
barkeri) 		PF00941
(FAD_binding_5)
PF03450
(CO_deh_flav_C) 		5 ILE C 223
GLY C 220
GLY C 202
ALA C 127
VAL C 258
 NO3  C5659 ( 4.8A)
None
None
None
None
 1.03A 6iftA-3hrdC:
undetectable		 6iftA-3hrdC:
22.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3i4t DIPHTHINE SYNTHASE

(Entamoeba
histolytica) 		PF00590
(TP_methylase) 		5 ILE A   5
GLY A   6
GLY A  83
ALA A  88
ASP A  14
 None
 0.82A 6iftA-3i4tA:
undetectable		 6iftA-3i4tA:
23.51
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.
3i6d PROTOPORPHYRINOGEN
OXIDASE

(Bacillus
subtilis) 		PF01593
(Amino_oxidase) 		5 ILE A  11
GLY A  12
GLY A  14
ALA A  19
VAL A 256
 None
FAD  A 600 (-3.4A)
FAD  A 600 (-3.2A)
None
FAD  A 600 (-4.3A)
 0.76A 6iftA-3i6dA:
2.9		 6iftA-3i6dA:
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.
3k0b PREDICTED
N6-ADENINE-SPECIFIC
DNA METHYLASE

(Listeria
monocytogenes) 		PF01170
(UPF0020)
PF02926
(THUMP) 		5 GLY A 200
ILE A 260
ASP A 261
LEU A 264
VAL A 288
 None
 0.87A 6iftA-3k0bA:
11.9		 6iftA-3k0bA:
24.82
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.
3l4g PHENYLALANYL-TRNA
SYNTHETASE BETA
CHAIN

(Homo sapiens) 		PF03483
(B3_4)
PF03484
(B5) 		5 LEU B 413
ILE B 480
GLY B 457
ILE B 423
ASP B 422
 None
 0.83A 6iftA-3l4gB:
undetectable		 6iftA-3l4gB:
19.36
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.
3lga SAM-DEPENDENT
METHYLTRANSFERASE

(Pyrococcus
abyssi) 		PF08704
(GCD14)
PF14801
(GCD14_N) 		5 GLU A  99
GLY A 101
GLY A 103
ALA A 106
ILE A 126
 SAH  A 301 ( 4.7A)
SAH  A 301 (-3.1A)
SAH  A 301 (-3.5A)
SAH  A 301 (-3.4A)
SAH  A 301 (-4.1A)
 0.70A 6iftA-3lgaA:
13.7		 6iftA-3lgaA:
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.
3liu PUTATIVE CELL
ADHESION PROTEIN

(Parabacteroides
distasonis) 		PF06321
(P_gingi_FimA) 		5 GLY A  71
GLY A  74
ILE A 125
ASP A 124
VAL A 105
 None
 1.01A 6iftA-3liuA:
undetectable		 6iftA-3liuA:
22.89
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.
3mgg METHYLTRANSFERASE

(Methanosarcina
mazei) 		PF13847
(Methyltransf_31) 		5 GLU A  41
GLY A  43
GLY A  45
ALA A  48
ILE A  67
 None
 0.83A 6iftA-3mggA:
11.2		 6iftA-3mggA:
23.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3n3a PROTEIN NRDI

(Escherichia
coli) 		PF07972
(Flavodoxin_NdrI) 		5 ILE C  97
GLY C  94
GLY C  91
ALA C  89
ILE C  79
 None
None
FMN  C 134 (-3.9A)
FMN  C 134 (-3.6A)
None
 1.03A 6iftA-3n3aC:
undetectable		 6iftA-3n3aC:
20.35
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.
3o4f SPERMIDINE SYNTHASE

(Escherichia
coli) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 ILE A  84
GLY A  85
GLY A  87
ALA A  90
ILE A 109
 None
 0.66A 6iftA-3o4fA:
9.5		 6iftA-3o4fA:
23.08
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.
3qsg NAD-BINDING
PHOSPHOGLUCONATE
DEHYDROGENASE-LIKE
PROTEIN

(Alicyclobacillus
acidocaldarius) 		PF03807
(F420_oxidored)
PF09130
(DUF1932) 		5 ILE A   6
GLY A   7
GLY A   9
ALA A  11
VAL A  53
 None
None
None
CL  A 290 ( 4.4A)
None
 0.88A 6iftA-3qsgA:
undetectable		 6iftA-3qsgA:
21.95
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.
3qvl PUTATIVE HYDANTOIN
RACEMASE

(Klebsiella
pneumoniae) 		PF01177
(Asp_Glu_race) 		5 ILE A   6
GLY A  74
GLY A  94
ILE A  97
VAL A 210
 None
 1.02A 6iftA-3qvlA:
undetectable		 6iftA-3qvlA:
24.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rw9 SPERMIDINE SYNTHASE

(Homo sapiens) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 ILE A 100
GLY A 101
GLY A 103
ILE A 125
ASP A 126
 None
DSH  A 303 (-3.4A)
DSH  A 303 (-3.5A)
DSH  A 303 (-3.8A)
None
 0.66A 6iftA-3rw9A:
9.6		 6iftA-3rw9A:
25.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tcq MATRIX PROTEIN VP40

(Sudan
ebolavirus) 		PF07447
(VP40) 		5 PHE A 209
LEU A 207
ILE A 284
GLY A 260
ILE A 258
 None
 0.99A 6iftA-3tcqA:
undetectable		 6iftA-3tcqA:
21.87
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3tqs RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE A

(Coxiella
burnetii) 		PF00398
(RrnaAD) 		9 PHE A  14
LEU A  15
GLU A  38
ILE A  39
GLY A  40
GLY A  42
ALA A  45
ASP A  63
LEU A  66
 None
 0.73A 6iftA-3tqsA:
27.9		 6iftA-3tqsA:
32.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3uzu RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE A

(Burkholderia
pseudomallei) 		PF00398
(RrnaAD) 		9 PHE A  20
LEU A  21
GLU A  44
ILE A  45
GLY A  46
GLY A  48
ALA A  51
ASP A  73
LEU A  76
 None
 0.64A 6iftA-3uzuA:
26.0		 6iftA-3uzuA:
30.84
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.
3v4p INTEGRIN ALPHA-4

(Homo sapiens) 		PF01839
(FG-GAP)
PF08441
(Integrin_alpha2) 		5 LEU A 325
ILE A 367
GLY A 356
GLY A 336
VAL A 417
 None
 0.80A 6iftA-3v4pA:
undetectable		 6iftA-3v4pA:
18.51
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.
3zqj UVRABC SYSTEM
PROTEIN A

(Mycobacterium
tuberculosis) 		PF00005
(ABC_tran) 		5 ILE A 888
ALA A 854
ILE A 881
ASP A 880
PRO A 872
 None
 1.06A 6iftA-3zqjA:
undetectable		 6iftA-3zqjA:
14.53
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.
3zuq BOTULINUM NEUROTOXIN
TYPE B

(Clostridium
botulinum) 		PF01742
(Peptidase_M27)
PF07952
(Toxin_trans) 		5 ILE A 159
GLY A 189
ILE A 173
ASP A 174
PRO A  25
 None
 0.99A 6iftA-3zuqA:
undetectable		 6iftA-3zuqA:
15.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4apb FUMARATE HYDRATASE
CLASS II

(Mycobacterium
tuberculosis) 		PF00206
(Lyase_1)
PF10415
(FumaraseC_C) 		5 ILE A 226
GLY A 227
GLY A 234
ASP A 239
VAL A 245
 None
 0.85A 6iftA-4apbA:
undetectable		 6iftA-4apbA:
22.46
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.
4bgu MALATE DEHYDROGENASE

(Haloferax
volcanii) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 ILE A   7
GLY A   8
GLY A  11
ALA A  16
ILE A  35
 None
None
None
None
CL  A1316 ( 3.9A)
 0.81A 6iftA-4bguA:
3.3		 6iftA-4bguA:
22.59
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.
4c60 OCHRATOXINASE

(Aspergillus
niger) 		PF01979
(Amidohydro_1) 		5 LEU A 107
GLY A 376
ALA A 407
ASP A 378
PRO A 384
 None
 0.97A 6iftA-4c60A:
undetectable		 6iftA-4c60A:
19.35
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.
4e0b MALATE DEHYDROGENASE

(Vibrio
vulnificus) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 ILE A   6
GLY A   7
GLY A  10
ALA A  15
ILE A  35
 None
 0.83A 6iftA-4e0bA:
3.8		 6iftA-4e0bA:
25.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4e6w CLBP PEPTIDASE

(Escherichia
coli) 		PF00144
(Beta-lactamase) 		5 GLU A 199
ILE A 198
GLY A 195
ALA A 166
VAL A 104
 None
 1.04A 6iftA-4e6wA:
undetectable		 6iftA-4e6wA:
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.
4fr2 1,3-PROPANEDIOL
DEHYDROGENASE

(Oenococcus oeni) 		PF00465
(Fe-ADH) 		5 LEU A  56
ILE A 138
ASP A 180
LEU A 183
VAL A 176
 None
 1.02A 6iftA-4fr2A:
undetectable		 6iftA-4fr2A:
20.88
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4gc5 DIMETHYLADENOSINE
TRANSFERASE 1,
MITOCHONDRIAL

(Mus musculus) 		PF00398
(RrnaAD) 		5 LEU A  38
GLU A  61
GLY A  63
GLY A  65
ASP A  87
 None
None
ACT  A 402 (-3.4A)
None
None
 0.49A 6iftA-4gc5A:
27.3		 6iftA-4gc5A:
30.97
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4gc5 DIMETHYLADENOSINE
TRANSFERASE 1,
MITOCHONDRIAL

(Mus musculus) 		PF00398
(RrnaAD) 		5 LEU A  38
GLY A  63
GLY A  65
ASP A  87
PRO A 143
 None
ACT  A 402 (-3.4A)
None
None
ACT  A 402 ( 4.9A)
 0.84A 6iftA-4gc5A:
27.3		 6iftA-4gc5A:
30.97
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.
4hsu LYSINE-SPECIFIC
HISTONE DEMETHYLASE
1B

(Homo sapiens) 		PF01593
(Amino_oxidase)
PF04433
(SWIRM)
PF07496
(zf-CW) 		5 ILE A 388
GLY A 389
GLY A 391
ALA A 396
VAL A 598
 FAD  A 901 (-4.8A)
FAD  A 901 (-3.3A)
FAD  A 901 (-3.6A)
None
FAD  A 901 (-4.2A)
 0.79A 6iftA-4hsuA:
2.9		 6iftA-4hsuA:
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.
4i59 CYCLOHEXYLAMINE
OXIDASE

(Microbacterium
oxydans) 		PF01593
(Amino_oxidase) 		5 ILE A  37
GLY A  38
GLY A  40
ALA A  45
VAL A 263
 FAD  A 501 (-4.7A)
FAD  A 501 (-3.2A)
FAD  A 501 (-3.5A)
None
FAD  A 501 (-3.9A)
 0.71A 6iftA-4i59A:
undetectable		 6iftA-4i59A:
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.
4itu SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE SDR

(Xanthobacter
autotrophicus) 		PF13561
(adh_short_C2) 		5 GLY A  14
GLY A  16
ASP A  40
LEU A  43
VAL A  65
 NAI  A 301 (-3.3A)
NAI  A 301 ( 4.6A)
None
None
NAI  A 301 (-3.5A)
 0.90A 6iftA-4ituA:
5.6		 6iftA-4ituA:
24.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4jxj RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE A

(Rickettsia
bellii) 		PF00398
(RrnaAD) 		6 GLU A  48
ILE A  49
GLY A  50
GLY A  52
ASP A  74
PRO A 118
 None
 0.53A 6iftA-4jxjA:
27.8		 6iftA-4jxjA:
33.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4jxj RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE A

(Rickettsia
bellii) 		PF00398
(RrnaAD) 		6 PHE A  24
GLU A  48
ILE A  49
GLY A  50
GLY A  52
PRO A 118
 None
 0.47A 6iftA-4jxjA:
27.8		 6iftA-4jxjA:
33.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4kam O-ACETYLHOMOSERINE
SULFHYDRYLASE METC

(Mycobacterium
marinum) 		PF01053
(Cys_Met_Meta_PP) 		5 ILE A 380
GLY A 381
GLY A 224
ALA A 227
VAL A 352
 None
 0.81A 6iftA-4kamA:
2.6		 6iftA-4kamA:
21.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4kc5 RHIE PROTEIN

(Paraburkholderia
rhizoxinica) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 PHE A3223
LEU A3222
GLY A3253
GLY A3178
ILE A3296
 None
 1.04A 6iftA-4kc5A:
2.1		 6iftA-4kc5A:
16.10
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.
4kqn D-HYDANTOINASE

(Bacillus sp.
AR9) 		PF01979
(Amidohydro_1) 		5 GLY A  53
GLY A 383
ALA A 372
ILE A 393
VAL A 430
 GLY  A  53 ( 0.0A)
GLY  A 383 ( 0.0A)
ALA  A 372 ( 0.0A)
ILE  A 393 ( 0.4A)
VAL  A 430 ( 0.5A)
 1.04A 6iftA-4kqnA:
undetectable		 6iftA-4kqnA:
22.66
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.
4l7v PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Vibrio cholerae) 		PF01135
(PCMT) 		5 GLU A  81
ILE A  82
GLY A  83
GLY A  85
LEU A 109
 SAH  A 301 ( 4.6A)
SAH  A 301 ( 4.7A)
SAH  A 301 (-3.3A)
SAH  A 301 (-3.5A)
SAH  A 301 (-4.6A)
 0.55A 6iftA-4l7vA:
10.2		 6iftA-4l7vA:
21.07
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.
4m38 PROTEIN ARGININE
N-METHYLTRANSFERASE
7

(Trypanosoma
brucei) 		PF06325
(PrmA) 		5 GLU A 101
ILE A 102
GLY A 103
GLY A 105
LEU A 130
 SAH  A 401 (-3.9A)
None
SAH  A 401 (-3.0A)
SAH  A 401 ( 3.8A)
SAH  A 401 (-4.5A)
 0.57A 6iftA-4m38A:
9.5		 6iftA-4m38A:
23.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4nas RIBULOSE-BISPHOSPHAT
E CARBOXYLASE

(Alicyclobacillus
acidocaldarius) 		PF00016
(RuBisCO_large) 		5 ILE A 298
GLY A 299
ALA A 294
LEU A 287
VAL A 356
 None
 1.05A 6iftA-4nasA:
undetectable		 6iftA-4nasA:
21.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4o29 PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE

(Pyrobaculum
aerophilum) 		PF01135
(PCMT) 		5 GLU A  78
GLY A  80
GLY A  82
ILE A 105
LEU A 109
 SAH  A 500 (-4.3A)
SAH  A 500 (-3.1A)
SAH  A 500 (-3.3A)
SAH  A 500 (-3.7A)
SAH  A 500 (-3.8A)
 0.60A 6iftA-4o29A:
9.8		 6iftA-4o29A:
23.75
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.
4piv FATTY ACID SYNTHASE

(Homo sapiens) 		PF08242
(Methyltransf_12)
PF08659
(KR) 		5 GLY A1895
GLY A1897
ALA A1901
ILE A2068
VAL A2070
 NDP  A2202 (-3.6A)
None
None
2W4  A2205 (-3.9A)
None
 1.06A 6iftA-4pivA:
9.1		 6iftA-4pivA:
18.22
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.
4q3o MGS-MT1

(unidentified) 		PF07859
(Abhydrolase_3) 		5 ILE A 124
GLY A 192
GLY A 221
ALA A 321
ILE A 218
 None
 1.02A 6iftA-4q3oA:
3.2		 6iftA-4q3oA:
21.67
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.
4rep GAMMA-CAROTENE
DESATURASE

(Nonlabens
dokdonensis) 		PF01593
(Amino_oxidase) 		5 ILE A   7
GLY A   8
GLY A  10
ALA A  15
VAL A 247
 None
FAD  A 501 (-3.3A)
FAD  A 501 (-3.4A)
None
FAD  A 501 (-4.1A)
 0.93A 6iftA-4repA:
3.5		 6iftA-4repA:
23.44
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.
4tsk KETOL-ACID
REDUCTOISOMERASE

(Alicyclobacillus
acidocaldarius) 		PF01450
(IlvC)
PF07991
(IlvN) 		5 ILE A  23
GLY A  24
GLY A  26
ALA A  31
VAL A  66
 None
NDP  A 405 ( 3.8A)
NDP  A 405 (-3.3A)
None
None
 1.00A 6iftA-4tskA:
3.4		 6iftA-4tskA:
22.07
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.
4u8t ZYRO0G01672P

(Zygosaccharomyces
rouxii) 		PF04146
(YTH) 		5 LEU A 225
ILE A 309
GLY A 237
ALA A 239
ASP A 273
 None
 1.05A 6iftA-4u8tA:
undetectable		 6iftA-4u8tA:
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.
4yv2 SPERMIDINE SYNTHASE,
PUTATIVE

(Trypanosoma
cruzi) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 ILE A  94
GLY A  95
GLY A  97
ILE A 119
ASP A 120
 None
S4M  A 301 (-3.5A)
S4M  A 301 ( 4.5A)
S4M  A 301 (-3.9A)
None
 0.61A 6iftA-4yv2A:
9.3		 6iftA-4yv2A:
21.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5bxy RNA
METHYLTRANSFERASE

(Salinibacter
ruber) 		PF13847
(Methyltransf_31) 		5 GLY A  31
GLY A  33
ILE A  54
ASP A  55
LEU A  58
 SAH  A 201 (-3.4A)
SAH  A 201 (-3.4A)
SAH  A 201 (-3.9A)
None
SAH  A 201 (-4.4A)
 0.65A 6iftA-5bxyA:
13.3		 6iftA-5bxyA:
20.07
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.
5by7 3-OXOACYL-ACP
SYNTHASE III

(Verrucosispora
maris) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		5 LEU A 111
ILE A 284
GLY A 283
GLY A 130
ALA A 110
 None
 1.03A 6iftA-5by7A:
undetectable		 6iftA-5by7A:
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.
5eku ARGININE
N-METHYLTRANSFERASE,
PUTATIVE

(Trypanosoma
brucei) 		PF06325
(PrmA) 		5 GLU A 101
ILE A 102
GLY A 103
GLY A 105
LEU A 130
 SAH  A 401 (-3.9A)
SAH  A 401 (-4.9A)
SAH  A 401 (-3.0A)
SAH  A 401 (-3.6A)
SAH  A 401 (-4.2A)
 0.61A 6iftA-5ekuA:
8.8		 6iftA-5ekuA:
23.88
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.
5evy SALICYLATE
HYDROXYLASE

(Pseudomonas
putida) 		PF01494
(FAD_binding_3) 		5 ILE X  11
GLY X  12
GLY X  14
ALA X  19
VAL X 131
 None
FAD  X 501 ( 4.0A)
FAD  X 501 (-3.7A)
None
None
 0.86A 6iftA-5evyX:
undetectable		 6iftA-5evyX:
22.10
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.
5ha5 BRUCELLA OVIS
OXIDOREDUCTASE

(Brucella ovis) 		PF13561
(adh_short_C2) 		5 GLY A  21
ALA A  29
ILE A  46
ASP A  47
VAL A  72
 None
 0.67A 6iftA-5ha5A:
5.2		 6iftA-5ha5A:
21.04
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.
5ha5 BRUCELLA OVIS
OXIDOREDUCTASE

(Brucella ovis) 		PF13561
(adh_short_C2) 		5 GLY A  21
GLY A  23
ILE A  46
ASP A  47
VAL A  72
 None
 0.73A 6iftA-5ha5A:
5.2		 6iftA-5ha5A:
21.04
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.
5ipy FLAVIN-CONTAINING
MONOOXYGENASE

(Roseovarius
nubinhibens) 		PF00743
(FMO-like) 		5 ILE A   8
GLY A   9
GLY A  11
ALA A  16
VAL A 126
 None
FAD  A 502 (-3.3A)
FAD  A 502 (-3.4A)
None
FAD  A 502 (-4.0A)
 0.77A 6iftA-5ipyA:
2.9		 6iftA-5ipyA:
20.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5l3d LYSINE-SPECIFIC
HISTONE DEMETHYLASE
1A

(Homo sapiens) 		PF01593
(Amino_oxidase)
PF04433
(SWIRM) 		5 ILE A 284
GLY A 285
GLY A 287
ALA A 292
VAL A 590
 None
FAD  A 901 (-3.3A)
FAD  A 901 (-3.5A)
None
FAD  A 901 (-3.9A)
 0.76A 6iftA-5l3dA:
2.7		 6iftA-5l3dA:
16.16
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.
5thz CURJ

(Moorea
producens) 		no annotation 5 GLU B 203
ILE B 204
GLY B 205
GLY B 207
ILE B 231
 None
None
SAH  B 501 (-3.5A)
SAH  B 501 (-3.3A)
SAH  B 501 (-3.7A)
 0.55A 6iftA-5thzB:
9.5		 6iftA-5thzB:
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.
5wgc DAUNORUBICIN-DOXORUB
ICIN POLYKETIDE
SYNTHASE

(Streptomyces
peucetius) 		no annotation 5 ILE A 304
GLY A 301
GLY A 299
ALA A 166
LEU A  86
 None
None
None
None
42Y  A 118 ( 4.7A)
 0.97A 6iftA-5wgcA:
undetectable		 6iftA-5wgcA:
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.
6d6y APRA
METHYLTRANSFERASE 2

(Moorea
bouillonii) 		no annotation 5 GLU A 835
ILE A 836
GLY A 837
GLY A 839
ILE A 865
 None
None
SAH  A1102 (-3.5A)
SAH  A1102 (-3.4A)
SAH  A1102 (-3.6A)
 0.52A 6iftA-6d6yA:
9.3		 6iftA-6d6yA:
undetectable