SIMILAR PATTERNS OF AMINO ACIDS FOR 4RTM_A_SAMA301

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.
1fcd FLAVOCYTOCHROME C
SULFIDE
DEHYDROGENASE
(FLAVIN-BINDING
SUBUNIT)


(Allochromatium
vinosum)
PF07992
(Pyr_redox_2)
PF09242
(FCSD-flav_bind)
5 GLY A  10
ALA A  18
ILE A 289
SER A 283
PRO A 104
None
None
None
None
FAD  A 699 (-4.5A)
0.75A 4rtmA-1fcdA:
undetectable
4rtmA-1fcdA:
19.95
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.
1g60 ADENINE-SPECIFIC
METHYLTRANSFERASE
MBOIIA


(Moraxella bovis)
PF01555
(N6_N4_Mtase)
5 PHE A 220
GLY A 222
ASN A 243
PRO A  32
TYR A  33
SAM  A 500 (-4.6A)
SAM  A 500 (-3.2A)
None
None
None
0.65A 4rtmA-1g60A:
2.0
4rtmA-1g60A:
19.33
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.
1h81 POLYAMINE OXIDASE

(Zea mays)
PF01593
(Amino_oxidase)
5 GLY A  42
GLY A  41
GLY A  11
ALA A  12
ILE A 276
FAD  A 579 (-3.2A)
None
FAD  A 579 (-3.1A)
None
None
1.03A 4rtmA-1h81A:
2.0
4rtmA-1h81A:
21.97
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.
1led WEST-CENTRAL AFRICAN
LEGUME LECTIN IV


(Griffonia
simplicifolia)
PF00139
(Lectin_legB)
5 GLY A 107
GLY A 106
GLY A  90
ILE A 146
TYR A 143
GAL  A 253 ( 3.4A)
FUC  A 254 ( 3.8A)
None
None
None
0.96A 4rtmA-1ledA:
undetectable
4rtmA-1ledA:
20.66
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.
1lrw METHANOL
DEHYDROGENASE
SUBUNIT 1


(Paracoccus
denitrificans)
PF01011
(PQQ)
PF13360
(PQQ_2)
5 GLY A 182
GLY A 240
GLY A 175
ALA A 176
ILE A 152
None
None
PQQ  A 701 (-3.7A)
PQQ  A 701 (-2.8A)
None
0.90A 4rtmA-1lrwA:
undetectable
4rtmA-1lrwA:
18.39
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.
1n47 ISOLECTIN B4

(Vicia villosa)
PF00139
(Lectin_legB)
5 GLY A 103
GLY A 102
GLY A  86
ILE A 138
TYR A 135
TNR  A1401 (-3.4A)
TNR  A1401 ( 3.9A)
None
None
None
1.05A 4rtmA-1n47A:
undetectable
4rtmA-1n47A:
21.24
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.
1qmo MANNOSE BINDING
LECTIN, FRIL
MANNOSE BINDING
LECTIN, FRIL


(Lablab
purpureus;
Lablab
purpureus)
PF00139
(Lectin_legB)
PF00139
(Lectin_legB)
5 GLY A 104
GLY A 103
GLY A  87
ILE E 155
TYR E 152
MAN  A 302 (-3.7A)
MAN  A 302 ( 3.8A)
None
None
None
1.04A 4rtmA-1qmoA:
undetectable
4rtmA-1qmoA:
16.89
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.
1qmo MANNOSE BINDING
LECTIN, FRIL
MANNOSE BINDING
LECTIN, FRIL


(Lablab
purpureus;
Lablab
purpureus)
PF00139
(Lectin_legB)
PF00139
(Lectin_legB)
5 GLY A 104
GLY A 103
GLY A  87
TYR E 152
TYR E 147
MAN  A 302 (-3.7A)
MAN  A 302 ( 3.8A)
None
None
None
0.91A 4rtmA-1qmoA:
undetectable
4rtmA-1qmoA:
16.89
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.
1toa PROTEIN (PERIPLASMIC
BINDING PROTEIN
TROA)


(Treponema
pallidum)
PF01297
(ZnuA)
5 GLY A  59
GLY A  41
ALA A  44
PRO A  67
TYR A  70
None
1.03A 4rtmA-1toaA:
undetectable
4rtmA-1toaA:
25.66
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.
1ur4 GALACTANASE

(Bacillus
licheniformis)
PF07745
(Glyco_hydro_53)
5 GLY A 366
GLY A 365
GLY A  82
ALA A 348
ILE A  34
None
1.01A 4rtmA-1ur4A:
undetectable
4rtmA-1ur4A:
20.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ux6 THROMBOSPONDIN-1

(Homo sapiens)
PF02412
(TSP_3)
PF05735
(TSP_C)
5 GLY A1127
GLY A1128
GLY A 848
ILE A 844
PRO A 860
None
None
None
None
CA  A2009 ( 4.8A)
0.88A 4rtmA-1ux6A:
undetectable
4rtmA-1ux6A:
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.
1vqv THIAMINE
MONOPHOSPHATE KINASE


(Aquifex
aeolicus)
PF00586
(AIRS)
5 GLY A  77
GLY A  76
ALA A  74
ILE A  65
ASN A  68
None
0.95A 4rtmA-1vqvA:
undetectable
4rtmA-1vqvA:
21.71
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.
1x1n 4-ALPHA-GLUCANOTRANS
FERASE


(Solanum
tuberosum)
PF02446
(Glyco_hydro_77)
5 GLY A 325
GLY A 328
GLY A 349
ILE A 356
TYR A 245
None
None
None
None
GOL  A1002 (-4.7A)
0.94A 4rtmA-1x1nA:
undetectable
4rtmA-1x1nA:
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.
1x3l HYPOTHETICAL PROTEIN
PH0495


(Pyrococcus
horikoshii)
PF05161
(MOFRL)
PF13660
(DUF4147)
5 GLY A 342
GLY A 341
GLY A 378
ALA A 376
ILE A 428
None
1.04A 4rtmA-1x3lA:
3.3
4rtmA-1x3lA:
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.
1xnf LIPOPROTEIN NLPI

(Escherichia
coli)
PF07719
(TPR_2)
PF13181
(TPR_8)
5 GLY A 143
GLY A 144
ALA A 149
ASN A 135
SER A 121
None
0.91A 4rtmA-1xnfA:
undetectable
4rtmA-1xnfA:
22.85
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.
1yfj DNA ADENINE
METHYLASE


(Escherichia
virus T4)
PF02086
(MethyltransfD12)
5 GLY A   9
GLY A  34
ILE A  51
PRO A 173
TYR A 174
None
SAH  A 401 (-3.2A)
SAH  A 401 (-3.6A)
SAH  A 401 (-4.0A)
None
1.05A 4rtmA-1yfjA:
26.3
4rtmA-1yfjA:
27.27
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.
1yfj DNA ADENINE
METHYLASE


(Escherichia
virus T4)
PF02086
(MethyltransfD12)
5 GLY A   9
PHE A  32
GLY A  34
ILE A  51
PRO A 173
None
SAH  A 401 (-4.2A)
SAH  A 401 (-3.2A)
SAH  A 401 (-3.6A)
SAH  A 401 (-4.0A)
0.47A 4rtmA-1yfjA:
26.3
4rtmA-1yfjA:
27.27
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.
2ahw PUTATIVE ENZYME YDIF

(Escherichia
coli)
PF01144
(CoA_trans)
5 GLY A  39
GLY A  38
GLY A  35
ALA A  36
ILE A 186
None
0.97A 4rtmA-2ahwA:
undetectable
4rtmA-2ahwA:
20.34
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.
2cdp BETA-AGARASE 1

(Saccharophagus
degradans)
PF03422
(CBM_6)
5 GLY A  72
GLY A 121
ALA A 122
SER A  28
TYR A  40
None
None
None
None
AAL  A1006 ( 3.8A)
1.00A 4rtmA-2cdpA:
undetectable
4rtmA-2cdpA:
23.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2cvt RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE
LARGE CHAIN 1


(Saccharomyces
cerevisiae)
PF00317
(Ribonuc_red_lgN)
PF02867
(Ribonuc_red_lgC)
PF03477
(ATP-cone)
5 GLY A 246
GLY A 247
GLY A 295
ALA A 296
TYR A 285
None
0.98A 4rtmA-2cvtA:
undetectable
4rtmA-2cvtA:
14.83
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.
2ddt SPHINGOMYELIN
PHOSPHODIESTERASE


(Bacillus cereus)
PF03372
(Exo_endo_phos)
5 GLY A 101
GLY A 102
PHE A 133
ALA A 104
ILE A 115
None
0.93A 4rtmA-2ddtA:
undetectable
4rtmA-2ddtA:
21.22
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.
2dpm PROTEIN
(ADENINE-SPECIFIC
METHYLTRANSFERASE
DPNII 1)


(Streptococcus
pneumoniae)
PF02086
(MethyltransfD12)
7 GLY A  19
GLY A  20
PHE A  43
GLY A  45
ASN A  64
PRO A 196
TYR A 197
SAM  A 300 (-4.4A)
SAM  A 300 (-3.3A)
SAM  A 300 (-4.2A)
SAM  A 300 (-3.6A)
None
SAM  A 300 ( 4.1A)
None
0.84A 4rtmA-2dpmA:
28.6
4rtmA-2dpmA:
29.97
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.
2ghb MALTOSE ABC
TRANSPORTER,
PERIPLASMIC
MALTOSE-BINDING
PROTEIN


(Thermotoga
maritima)
PF13416
(SBP_bac_8)
5 GLY A 169
GLY A 168
GLY A 194
SER A 153
TYR A 159
None
1.04A 4rtmA-2ghbA:
undetectable
4rtmA-2ghbA:
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.
2oas 4-HYDROXYBUTYRATE
COENZYME A
TRANSFERASE


(Shewanella
oneidensis)
PF02550
(AcetylCoA_hydro)
PF13336
(AcetylCoA_hyd_C)
5 GLY A 130
GLY A  28
ALA A  29
ILE A 180
SER A 182
None
1.03A 4rtmA-2oasA:
2.4
4rtmA-2oasA:
20.37
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.
2okb DEOXYURIDINE
5'-TRIPHOSPHATE
NUCLEOTIDOHYDROLASE


(Vaccinia virus)
PF00692
(dUTPase)
5 GLY A  82
GLY A  81
GLY A  93
ILE A  54
TYR A  35
None
0.94A 4rtmA-2okbA:
undetectable
4rtmA-2okbA:
16.72
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.
2q9t DING

(Pseudomonas
fluorescens)
PF12849
(PBP_like_2)
5 GLY A 179
GLY A 178
PHE A 117
ILE A 136
ASN A 122
None
0.97A 4rtmA-2q9tA:
undetectable
4rtmA-2q9tA:
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.
2qi9 VITAMIN B12 IMPORT
SYSTEM PERMEASE
PROTEIN BTUC


(Escherichia
coli)
PF01032
(FecCD)
5 GLY A 251
GLY A  98
ALA A  97
ILE A 164
SER A 167
None
0.80A 4rtmA-2qi9A:
undetectable
4rtmA-2qi9A:
19.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vpj KELCH-LIKE PROTEIN
12


(Homo sapiens)
PF01344
(Kelch_1)
5 GLY A 433
GLY A 432
GLY A 465
ALA A 466
TYR A 337
None
None
None
None
ACT  A1569 ( 4.9A)
0.99A 4rtmA-2vpjA:
undetectable
4rtmA-2vpjA:
21.74
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.
2wtb FATTY ACID
MULTIFUNCTIONAL
PROTEIN (ATMFP2)


(Arabidopsis
thaliana)
PF00378
(ECH_1)
PF00725
(3HCDH)
PF02737
(3HCDH_N)
5 GLY A 116
GLY A 115
GLY A 147
ILE A  91
TYR A  88
None
1.01A 4rtmA-2wtbA:
6.4
4rtmA-2wtbA:
15.93
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.
2ygl BLOOD GROUP A-AND
B-CLEAVING
ENDO-BETA-GALACTOSID
ASE


(Streptococcus
pneumoniae)
PF08305
(NPCBM)
5 GLY A 248
GLY A 247
PHE A 324
ALA A 411
TYR A 250
None
1.04A 4rtmA-2yglA:
undetectable
4rtmA-2yglA:
21.33
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.
2yky BETA-TRANSAMINASE

(Mesorhizobium
sp. LUK)
PF00202
(Aminotran_3)
5 GLY A 171
GLY A 170
GLY A 224
ALA A 225
GLN A 266
None
None
None
SFE  A1546 (-3.4A)
None
1.05A 4rtmA-2ykyA:
undetectable
4rtmA-2ykyA:
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.
3c9r THIAMINE
MONOPHOSPHATE KINASE


(Aquifex
aeolicus)
PF00586
(AIRS)
5 GLY A  77
GLY A  76
ALA A  74
ILE A  65
ASN A  68
None
0.96A 4rtmA-3c9rA:
undetectable
4rtmA-3c9rA:
23.86
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.
3d46 PUTATIVE GALACTONATE
DEHYDRATASE


(Salmonella
enterica)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
5 GLY A 187
GLY A 188
PHE A 170
ALA A 180
ASN A 376
None
1.04A 4rtmA-3d46A:
undetectable
4rtmA-3d46A:
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.
3dy5 ALLENE OXIDE
SYNTHASE-LIPOXYGENAS
E PROTEIN


(Plexaura
homomalla)
PF00305
(Lipoxygenase)
PF01477
(PLAT)
5 GLY A 421
GLY A 383
PHE A 418
GLY A 389
ALA A 388
None
1.00A 4rtmA-3dy5A:
undetectable
4rtmA-3dy5A:
13.11
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.
3ekg MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME


(Azotobacter
vinelandii)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
5 GLY A 177
GLY A 178
PHE A 160
ALA A 170
ASN A 367
None
0.91A 4rtmA-3ekgA:
undetectable
4rtmA-3ekgA:
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.
3ggg PREPHENATE
DEHYDROGENASE


(Aquifex
aeolicus)
no annotation 5 GLY D  42
GLY D  43
ALA D  71
ILE D  63
ASN D  64
None
None
None
NAD  D6686 (-4.0A)
None
1.04A 4rtmA-3gggD:
4.1
4rtmA-3gggD:
25.30
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.
3h0g DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB1
DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB2
DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB11


(Schizosaccharomyces
pombe;
Schizosaccharomyces
pombe;
Schizosaccharomyces
pombe)
PF00623
(RNA_pol_Rpb1_2)
PF04983
(RNA_pol_Rpb1_3)
PF04990
(RNA_pol_Rpb1_7)
PF04992
(RNA_pol_Rpb1_6)
PF04997
(RNA_pol_Rpb1_1)
PF04998
(RNA_pol_Rpb1_5)
PF05000
(RNA_pol_Rpb1_4)
PF00562
(RNA_pol_Rpb2_6)
PF04560
(RNA_pol_Rpb2_7)
PF04561
(RNA_pol_Rpb2_2)
PF04563
(RNA_pol_Rpb2_1)
PF04565
(RNA_pol_Rpb2_3)
PF04566
(RNA_pol_Rpb2_4)
PF04567
(RNA_pol_Rpb2_5)
PF13656
(RNA_pol_L_2)
5 GLY B 821
GLY A 361
SER A 472
TYR B 983
GLN K   3
None
1.02A 4rtmA-3h0gB:
undetectable
4rtmA-3h0gB:
13.46
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.
3k55 BETA-HEMOLYSIN

(Staphylococcus
aureus)
PF03372
(Exo_endo_phos)
5 GLY A 100
GLY A 101
PHE A 132
ALA A 103
ILE A 114
None
0.84A 4rtmA-3k55A:
undetectable
4rtmA-3k55A:
26.85
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.
3mq3 PYRUVATE
DEHYDROGENASE
PHOSPHATASE 1


(Bos taurus)
PF00481
(PP2C)
5 GLY A 200
GLY A  77
ALA A  76
ILE A  52
ASN A  49
None
0.96A 4rtmA-3mq3A:
undetectable
4rtmA-3mq3A:
20.64
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.
3n79 PDUT

(Salmonella
enterica)
PF00936
(BMC)
5 GLY A 134
GLY A 133
ILE A  99
SER A 168
TYR A 166
None
1.01A 4rtmA-3n79A:
undetectable
4rtmA-3n79A:
20.65
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.
3nep MALATE DEHYDROGENASE

(Salinibacter
ruber)
PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C)
5 GLY X 193
GLY X 194
GLY X 165
ALA X 164
ILE X 268
None
0.74A 4rtmA-3nepX:
2.8
4rtmA-3nepX:
21.97
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.
3qv2 5-CYTOSINE DNA
METHYLTRANSFERASE


(Entamoeba
histolytica)
PF00145
(DNA_methylase)
5 PHE A  12
GLY A  14
ILE A  38
ASN A  39
PRO A  80
SAH  A 323 (-4.4A)
SAH  A 323 (-3.6A)
SAH  A 323 (-4.0A)
SAH  A 323 (-4.8A)
SAH  A 323 (-4.4A)
0.92A 4rtmA-3qv2A:
undetectable
4rtmA-3qv2A:
20.22
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.
3red HYDROXYNITRILE LYASE

(Prunus mume)
PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C)
5 GLY A  35
GLY A  34
GLY A 259
ALA A 258
SER A 494
FAD  A 773 (-3.4A)
None
FAD  A 773 (-3.5A)
FAD  A 773 (-3.6A)
None
1.04A 4rtmA-3redA:
2.3
4rtmA-3redA:
20.34
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.
3rha PUTRESCINE OXIDASE

(Paenarthrobacter
aurescens)
PF01593
(Amino_oxidase)
5 GLY A  44
GLY A  43
GLY A  14
ALA A  15
SER A 271
FDA  A 483 (-3.1A)
None
FDA  A 483 (-3.1A)
None
None
0.96A 4rtmA-3rhaA:
undetectable
4rtmA-3rhaA:
19.76
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.
3rju BETA-LACTAMASE/D-ALA
NINE
CARBOXYPEPTIDASE


(Yersinia pestis)
PF00144
(Beta-lactamase)
5 GLY A 224
GLY A 225
GLY A 303
TYR A 309
GLN A 298
None
0.89A 4rtmA-3rjuA:
undetectable
4rtmA-3rjuA:
19.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3u0f BETA-KETOACYL
SYNTHASE


(Brucella
abortus)
PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
5 GLY A 186
GLY A 187
PHE A 184
ALA A 140
ASN A 154
None
1.03A 4rtmA-3u0fA:
undetectable
4rtmA-3u0fA:
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.
3v7p AMIDOHYDROLASE
FAMILY PROTEIN


(Nitratiruptor
sp. SB155-2)
PF01979
(Amidohydro_1)
5 PHE A 353
GLY A 347
ALA A 346
ILE A 116
ASN A  59
None
1.04A 4rtmA-3v7pA:
undetectable
4rtmA-3v7pA:
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.
3vgl GLUCOKINASE

(Streptomyces
griseus)
PF00480
(ROK)
5 GLY A 260
GLY A 259
GLY A 302
ALA A 301
ILE A   9
ANP  A 325 ( 4.1A)
None
None
None
None
0.95A 4rtmA-3vglA:
undetectable
4rtmA-3vglA:
20.88
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.
3vgl GLUCOKINASE

(Streptomyces
griseus)
PF00480
(ROK)
5 GLY A 260
GLY A 259
GLY A 302
ALA A 301
ILE A  14
ANP  A 325 ( 4.1A)
None
None
None
None
0.99A 4rtmA-3vglA:
undetectable
4rtmA-3vglA:
20.88
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.
3vpz GLUCOKINASE

(Pseudoalteromonas
sp. AS-131)
PF02685
(Glucokinase)
5 GLY A 268
GLY A 269
GLY A 265
ALA A 261
GLN A 161
None
0.93A 4rtmA-3vpzA:
undetectable
4rtmA-3vpzA:
19.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3vrb FLAVOPROTEIN SUBUNIT
OF COMPLEX II


(Ascaris suum)
PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C)
5 GLY A  50
GLY A  51
GLY A 420
ALA A 441
ILE A 393
FAD  A 702 (-3.0A)
FAD  A 702 (-4.4A)
FAD  A 702 (-3.6A)
FAD  A 702 ( 4.3A)
None
0.99A 4rtmA-3vrbA:
undetectable
4rtmA-3vrbA:
18.65
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.
3wuy NITRILASE

(Synechocystis
sp. PCC 6803)
PF00795
(CN_hydrolase)
5 GLY A 271
ALA A  18
ILE A 255
ASN A 223
SER A 256
None
0.96A 4rtmA-3wuyA:
undetectable
4rtmA-3wuyA:
23.76
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.
3wuy NITRILASE

(Synechocystis
sp. PCC 6803)
PF00795
(CN_hydrolase)
5 GLY A 271
ALA A  18
ILE A 255
SER A 256
PRO A 265
None
1.02A 4rtmA-3wuyA:
undetectable
4rtmA-3wuyA:
23.76
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.
4ae0 DIPHTHERIA TOXIN

(Corynebacterium
diphtheriae)
PF01324
(Diphtheria_R)
PF02763
(Diphtheria_C)
PF02764
(Diphtheria_T)
5 GLY A  75
ILE A 165
ASN A 166
TYR A  60
GLN A 184
None
0.99A 4rtmA-4ae0A:
undetectable
4rtmA-4ae0A:
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.
4af1 PEPTIDE CHAIN
RELEASE FACTOR
SUBUNIT 1


(Halobacterium
salinarum)
PF03463
(eRF1_1)
PF03464
(eRF1_2)
PF03465
(eRF1_3)
5 GLY A  29
PHE A  97
GLY A  99
ALA A 100
ILE A  37
None
1.00A 4rtmA-4af1A:
undetectable
4rtmA-4af1A:
22.04
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.
4bvl PHB DEPOLYMERASE
PHAZ7


(Paucimonas
lemoignei)
PF01674
(Lipase_2)
5 GLY A 163
GLY A 164
ALA A 258
ILE A 272
ASN A 273
None
0.74A 4rtmA-4bvlA:
undetectable
4rtmA-4bvlA:
19.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4d5g CYCLOHEXANE-1,2-DION
E HYDROLASE


(Azoarcus sp.
BH72)
PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N)
5 GLY A 429
GLY A 450
ALA A 453
ASN A 400
SER A 376
None
TPP  A1589 (-3.3A)
TPP  A1589 (-3.3A)
TPP  A1589 (-4.3A)
None
1.02A 4rtmA-4d5gA:
undetectable
4rtmA-4d5gA:
17.94
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4gom DNA ADENINE
METHYLASE


(Escherichia
coli)
PF02086
(MethyltransfD12)
9 GLY D  12
PHE D  35
ILE D  55
ASN D  56
SER D 164
TYR D 165
PRO D 183
TYR D 184
GLN D 205
None
0Y0  D 301 (-4.4A)
0Y0  D 301 (-3.8A)
None
0Y0  D 301 (-3.6A)
None
0Y0  D 301 (-4.0A)
0Y0  D 301 (-3.4A)
0Y0  D 301 ( 4.6A)
1.06A 4rtmA-4gomD:
38.9
4rtmA-4gomD:
92.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4gom DNA ADENINE
METHYLASE


(Escherichia
coli)
PF02086
(MethyltransfD12)
10 PHE D  35
GLY D  37
ALA D  38
ILE D  55
ASN D  56
SER D 164
TYR D 165
PRO D 183
TYR D 184
GLN D 205
0Y0  D 301 (-4.4A)
0Y0  D 301 ( 3.8A)
None
0Y0  D 301 (-3.8A)
None
0Y0  D 301 (-3.6A)
None
0Y0  D 301 (-4.0A)
0Y0  D 301 (-3.4A)
0Y0  D 301 ( 4.6A)
0.33A 4rtmA-4gomD:
38.9
4rtmA-4gomD:
92.95
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.
4gpg PROTEASE 1

(Achromobacter
lyticus)
PF00089
(Trypsin)
5 GLY A 171
GLY A 174
ALA A 173
SER A 233
GLN A 208
None
1.02A 4rtmA-4gpgA:
undetectable
4rtmA-4gpgA:
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.
4h7u PYRANOSE
DEHYDROGENASE


(Leucoagaricus
meleagris)
PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C)
5 GLY A 515
GLY A 317
ILE A 296
ASN A 313
SER A 294
None
1.03A 4rtmA-4h7uA:
undetectable
4rtmA-4h7uA:
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.
4ia4 AQUAPORIN

(Spinacia
oleracea)
PF00230
(MIP)
5 GLY A 151
GLY A 150
ALA A 229
ILE A 221
ASN A 222
None
1.04A 4rtmA-4ia4A:
undetectable
4rtmA-4ia4A:
20.75
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.
4ita SUCCINATE-SEMIALDEHY
DE DEHYDROGENASE


(Synechococcus
sp. PCC 7002)
PF00171
(Aldedh)
5 GLY A 427
GLY A 426
GLY A 388
ALA A 410
GLN A 357
None
EDO  A 515 (-4.0A)
None
EDO  A 515 ( 3.7A)
None
0.91A 4rtmA-4itaA:
2.7
4rtmA-4itaA:
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.
4iv9 TRYPTOPHAN
2-MONOOXYGENASE


(Pseudomonas
savastanoi)
PF01593
(Amino_oxidase)
5 GLY A  76
GLY A  75
GLY A  45
ALA A  46
ILE A 337
FAD  A 601 (-3.1A)
None
FAD  A 601 (-3.1A)
None
None
0.97A 4rtmA-4iv9A:
undetectable
4rtmA-4iv9A:
20.54
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.
4jcl CYCLOMALTODEXTRIN
GLUCANOTRANSFERASE


(Paenibacillus
macerans)
PF00128
(Alpha-amylase)
PF00686
(CBM_20)
PF01833
(TIG)
5 GLY A 524
GLY A 525
GLY A 528
ALA A 527
PRO A 500
None
None
None
CL  A 707 ( 4.3A)
None
0.95A 4rtmA-4jclA:
undetectable
4rtmA-4jclA:
19.03
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.
4m3c SEED LECTIN BETA
CHAIN


(Spatholobus
parviflorus)
PF00139
(Lectin_legB)
5 GLY F 106
GLY F 105
GLY F  89
ILE F 143
TYR F 140
CA  F 301 ( 4.6A)
None
None
None
None
0.98A 4rtmA-4m3cF:
undetectable
4rtmA-4m3cF:
20.89
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.
4nd4 LACTATE
DEHYDROGENASE,
ADJACENT GENE
ENCODES PREDICTED
MALATE DEHYDROGENASE


(Cryptosporidium
parvum)
PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C)
5 GLY A 193
GLY A 194
GLY A 165
ALA A 164
SER A 188
None
GOL  A 405 (-3.8A)
None
NAD  A 401 ( 4.5A)
None
0.87A 4rtmA-4nd4A:
undetectable
4rtmA-4nd4A:
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.
4plh MALATE DEHYDROGENASE

(Apicomplexa)
PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C)
5 GLY A 175
GLY A 176
GLY A 147
ALA A 146
ILE A 254
None
None
None
NAI  A 403 ( 4.5A)
None
0.89A 4rtmA-4plhA:
3.5
4rtmA-4plhA:
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.
4qfh GLUCOSE-6-PHOSPHATE
ISOMERASE


(Trypanosoma
cruzi)
PF00342
(PGI)
5 GLY A 207
PHE A 232
GLY A 205
ILE A 256
PRO A 213
G6P  A 700 ( 4.3A)
None
None
None
None
1.05A 4rtmA-4qfhA:
3.2
4rtmA-4qfhA:
20.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4r9n LMO0547 PROTEIN

(Listeria
monocytogenes)
PF04198
(Sugar-bind)
5 GLY A 263
GLY A 199
ILE A 137
SER A 168
TYR A 170
None
1.04A 4rtmA-4r9nA:
undetectable
4rtmA-4r9nA:
18.71
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.
4rep GAMMA-CAROTENE
DESATURASE


(Nonlabens
dokdonensis)
PF01593
(Amino_oxidase)
5 GLY A  13
GLY A  12
PHE A 231
GLY A  37
ASN A  33
None
FAD  A 501 (-3.4A)
None
None
FAD  A 501 (-3.7A)
0.94A 4rtmA-4repA:
2.6
4rtmA-4repA:
20.89
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.
4rjk ACETOLACTATE
SYNTHASE


(Bacillus
subtilis)
PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N)
5 GLY A  86
GLY A  88
GLY A 111
ALA A 110
ILE A 114
None
1.00A 4rtmA-4rjkA:
undetectable
4rtmA-4rjkA:
20.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rlb CARBAPENEM-ASSOCIATE
D RESISTANCE PROTEIN


(Acinetobacter
baumannii)
no annotation 5 GLY A 151
GLY A 100
ALA A  99
ILE A 146
TYR A 103
None
1.00A 4rtmA-4rlbA:
undetectable
4rtmA-4rlbA:
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.
4s28 PHOSPHOMETHYLPYRIMID
INE SYNTHASE,
CHLOROPLASTIC


(Arabidopsis
thaliana)
PF01964
(ThiC_Rad_SAM)
5 GLY A 344
GLY A 345
ALA A 349
ILE A 295
TYR A 286
AIR  A 702 (-3.6A)
None
None
None
AIR  A 702 (-4.6A)
0.97A 4rtmA-4s28A:
2.4
4rtmA-4s28A:
17.69
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.
4tqo METHANOL
DEHYDROGENASE
PROTEIN, LARGE
SUBUNIT


(Methylococcus
capsulatus)
no annotation 5 GLY B 210
GLY B 268
GLY B 203
ALA B 204
ILE B 180
None
None
PQQ  B 702 (-3.1A)
PQQ  B 702 (-3.0A)
None
0.95A 4rtmA-4tqoB:
undetectable
4rtmA-4tqoB:
20.00
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.
4txg CHITINASE

(Chromobacterium
violaceum)
PF00704
(Glyco_hydro_18)
PF06483
(ChiC)
5 GLY A 518
GLY A 517
GLY A 401
ALA A 402
SER A 396
None
0.96A 4rtmA-4txgA:
undetectable
4rtmA-4txgA:
15.47
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.
4y63 HISTO-BLOOD GROUP
ABO SYSTEM
TRANSFERASE


(Homo sapiens)
PF03414
(Glyco_transf_6)
5 GLY A 266
GLY A 267
GLY A 230
ILE A  94
PRO A 321
None
0.96A 4rtmA-4y63A:
undetectable
4rtmA-4y63A:
21.75
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.
5cde PROLINE DIPEPTIDASE

(Xanthomonas
campestris)
PF00557
(Peptidase_M24)
PF01321
(Creatinase_N)
5 GLY A 162
GLY A 157
ALA A 158
ILE A 137
TYR A  61
None
0.83A 4rtmA-5cdeA:
undetectable
4rtmA-5cdeA:
20.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5cju ISOBUTYRYL-COA
MUTASE FUSED


(Cupriavidus
metallidurans)
PF01642
(MM_CoA_mutase)
PF02310
(B12-binding)
PF03308
(ArgK)
5 GLY A 216
GLY A 219
ALA A 220
PRO A 250
GLN A  51
None
GDP  A1104 (-3.2A)
GDP  A1104 (-4.8A)
None
None
0.97A 4rtmA-5cjuA:
undetectable
4rtmA-5cjuA:
14.96
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.
5cmc ML032222A IGLUR

(Mnemiopsis
leidyi)
PF10613
(Lig_chan-Glu_bd)
5 GLY A 142
GLY A  64
ALA A  65
ILE A  90
SER A  14
None
1.04A 4rtmA-5cmcA:
undetectable
4rtmA-5cmcA:
22.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5e72 N2,
N2-DIMETHYLGUANOSINE
TRNA
METHYLTRANSFERASE


(Thermococcus
kodakarensis)
PF01170
(UPF0020)
PF02926
(THUMP)
6 PHE A 187
GLY A 189
ALA A 190
ILE A 209
PRO A 256
TYR A 257
SAM  A 400 (-4.7A)
SAM  A 400 (-3.3A)
None
SAM  A 400 (-3.9A)
SAM  A 400 (-4.2A)
None
0.83A 4rtmA-5e72A:
12.4
4rtmA-5e72A:
23.32
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.
5fkr ENDO-1,4-BETA-GLUCAN
ASE/XYLOGLUCANASE,
PUTATIVE, GLY74A


(Cellvibrio
japonicus)
no annotation 5 GLY A 295
GLY A 296
ILE A 289
TYR A 206
GLN A 269
None
0.87A 4rtmA-5fkrA:
undetectable
4rtmA-5fkrA:
15.14
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.
5fsa CYP51 VARIANT1

(Candida
albicans)
PF00067
(p450)
5 GLY A 465
GLY A 466
PHE A 463
ASN A 435
PRO A 462
None
None
HEM  A 580 ( 4.5A)
None
None
1.04A 4rtmA-5fsaA:
undetectable
4rtmA-5fsaA:
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.
5fsg MALTOSE-BINDING
PERIPLASMIC PROTEIN,
HANTAVIRUS
NUCLEOPROTEIN


(Hantaan
orthohantavirus)
PF00846
(Hanta_nucleocap)
PF13416
(SBP_bac_8)
5 GLY A-303
ILE A-106
ASN A-105
TYR A-266
TYR A-273
None
1.03A 4rtmA-5fsgA:
undetectable
4rtmA-5fsgA:
18.12
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.
5fya PATATIN-LIKE
PROTEIN, PLPD


(Pseudomonas
aeruginosa)
PF01734
(Patatin)
6 GLY A  66
GLY A  67
GLY A  58
ALA A 163
ILE A 214
ASN A 213
None
1.23A 4rtmA-5fyaA:
undetectable
4rtmA-5fyaA:
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.
5h7d PUTRESCINE
AMINOTRANSFERASE,IMM
UNOGLOBULIN
G-BINDING PROTEIN A


(Escherichia
coli;
Staphylococcus
aureus)
PF00202
(Aminotran_3)
PF02216
(B)
5 GLY A  92
GLY A 305
ASN A 100
SER A  72
GLN A 437
None
1.03A 4rtmA-5h7dA:
2.1
4rtmA-5h7dA:
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.
5hsi PUTATIVE
DECARBOXYLASE


(Lactobacillus
brevis)
PF00282
(Pyridoxal_deC)
5 GLY A 402
GLY A 401
ILE A 414
SER A 415
TYR A 435
None
0.92A 4rtmA-5hsiA:
undetectable
4rtmA-5hsiA:
18.08
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.
5l46 DIMETHYLGLYCINE
DEHYDROGENASE,
MITOCHONDRIAL


(Homo sapiens)
PF01266
(DAO)
PF01571
(GCV_T)
PF08669
(GCV_T_C)
PF16350
(FAO_M)
6 GLY A  58
GLY A  57
GLY A 249
ALA A 248
ILE A 372
TYR A 399
FAD  A 901 (-3.3A)
FAD  A 901 (-4.5A)
FAD  A 901 (-3.4A)
FAD  A 901 (-4.1A)
FAD  A 901 (-4.3A)
None
1.31A 4rtmA-5l46A:
2.4
4rtmA-5l46A:
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.
5m49 AMINOTRANSFERASE
CLASS-III


(Rhizobium
freirei)
PF00202
(Aminotran_3)
5 GLY A 271
GLY A 272
GLY A  50
ALA A  48
SER A 247
None
1.01A 4rtmA-5m49A:
undetectable
4rtmA-5m49A:
20.22
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.
5m6g BETA-GLUCOSIDASE

(Saccharopolyspora
erythraea)
no annotation 5 GLY A 454
GLY A 442
ILE A 465
TYR A 194
GLN A 413
None
0.88A 4rtmA-5m6gA:
undetectable
4rtmA-5m6gA:
18.04
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.
5mzs FERRIC ENTEROBACTIN
RECEPTOR


(Pseudomonas
aeruginosa)
no annotation 5 GLY A 325
GLY A 324
GLY A 321
ILE A 318
ASN A 319
None
0.87A 4rtmA-5mzsA:
undetectable
4rtmA-5mzsA:
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.
5wt3 TRNA
(GUANINE(37)-N1)-MET
HYLTRANSFERASE TRM5A


(Pyrococcus
abyssi)
no annotation 5 PHE A 191
GLY A 193
ILE A 214
ASN A 215
PRO A 262
MTA  A 401 (-4.4A)
MTA  A 401 (-3.6A)
MTA  A 401 (-3.7A)
None
G  C  37 ( 4.1A)
0.83A 4rtmA-5wt3A:
0.0
4rtmA-5wt3A:
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.
5xm3 GLUCOSE
DEHYDROGENASE


(Methylophaga
aminisulfidivorans)
no annotation 5 GLY A 213
GLY A 271
GLY A 206
ALA A 207
ILE A 183
None
None
PQQ  A 701 (-3.7A)
PQQ  A 701 (-3.0A)
None
1.03A 4rtmA-5xm3A:
undetectable
4rtmA-5xm3A:
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.
6b07 FARNESYL DIPHOSPHATE
SYNTHASE


(Choristoneura
fumiferana)
no annotation 5 PHE A 282
GLY A 280
ALA A 246
ILE A 389
TYR A 393
None
1.03A 4rtmA-6b07A:
undetectable
4rtmA-6b07A:
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.
6bka NITRONATE
MONOOXYGENASE


(Cyberlindnera
mrakii)
no annotation 5 GLY A 240
GLY A 239
GLY A 195
ILE A 301
SER A 302
FMN  A 401 (-3.4A)
FMN  A 401 (-3.2A)
FMN  A 401 (-3.7A)
None
None
0.98A 4rtmA-6bkaA:
undetectable
4rtmA-6bkaA:
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.
6cmz DIHYDROLIPOYL
DEHYDROGENASE


(Burkholderia
cenocepacia)
no annotation 5 GLY A  16
GLY A  17
GLY A  40
ILE A  49
SER A  51
FAD  A 502 (-3.7A)
None
None
None
FAD  A 502 (-3.6A)
1.05A 4rtmA-6cmzA:
2.5
4rtmA-6cmzA:
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.
6eic MYCOBACTERIUM
TUBERCULOSIS
MONOGLYCERIDE LIPASE


(Mycobacterium
tuberculosis)
no annotation 5 GLY C 112
GLY C 114
ALA C 136
ILE C 171
SER C 172
None
None
SO4  C 301 ( 4.0A)
MPD  C 302 ( 4.6A)
None
0.94A 4rtmA-6eicC:
2.4
4rtmA-6eicC:
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.
6enx NAD-DEPENDENT
PROTEIN DEACYLASE
SIRTUIN-5,
MITOCHONDRIAL


(Danio rerio)
no annotation 5 GLY A 290
PHE A 285
GLY A 287
SER A  33
TYR A 283
None
1.02A 4rtmA-6enxA:
3.2
4rtmA-6enxA:
20.30
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.
6fay ODZ3 PROTEIN

(Mus musculus)
no annotation 6 GLY A2356
GLY A2357
ILE A2103
ASN A2314
TYR A2291
GLN A2084
None
1.25A 4rtmA-6fayA:
undetectable
4rtmA-6fayA:
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.
6fb3 TENEURIN-2

(Gallus gallus)
no annotation 6 GLY A2441
GLY A2442
ILE A2188
ASN A2399
TYR A2376
GLN A2169
None
1.31A 4rtmA-6fb3A:
undetectable
4rtmA-6fb3A:
undetectable
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4gom DNA ADENINE
METHYLASE


(Escherichia
coli)
PF02086
(MethyltransfD12)
4 TRP D  10
SER D  40
ASP D  54
ASP D 181
0Y0  D 301 (-4.5A)
None
0Y0  D 301 (-2.8A)
0Y0  D 301 (-3.2A)
0.59A 4rtmA-4gomD:
38.9
4rtmA-4gomD:
92.95
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.
4zfl AMIDOHYDROLASE EGTC

(Mycolicibacterium
smegmatis)
PF13522
(GATase_6)
4 TRP A  59
SER A 101
ASP A  68
ASP A  62
None
1.33A 4rtmA-4zflA:
0.0
4rtmA-4zflA:
21.59