SIMILAR PATTERNS OF AMINO ACIDS FOR 4RTP_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.
1dpp DIPEPTIDE BINDING
PROTEIN

(Escherichia
coli) 		PF00496
(SBP_bac_5) 		5 GLY A 181
ILE A 157
ASN A  34
PRO A  16
GLN A  97
 None
 1.30A 4rtpA-1dppA:
undetectable		 4rtpA-1dppA:
21.00
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.
1drk D-RIBOSE-BINDING
PROTEIN

(Escherichia
coli) 		PF13407
(Peripla_BP_4) 		5 ALA A  27
ILE A 101
SER A  99
ASP A 249
GLN A 258
 None
 1.26A 4rtpA-1drkA:
3.4		 4rtpA-1drkA:
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.
1f8f BENZYL ALCOHOL
DEHYDROGENASE

(Acinetobacter
calcoaceticus) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 GLY A 200
ALA A 201
SER A 205
ILE A 223
SER A 242
 NAD  A 375 (-3.3A)
NAD  A 375 (-4.1A)
None
NAD  A 375 ( 4.4A)
NAD  A 375 ( 3.7A)
 1.30A 4rtpA-1f8fA:
4.7		 4rtpA-1f8fA:
20.45
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.
1fue FLAVODOXIN

(Helicobacter
pylori) 		PF00258
(Flavodoxin_1) 		5 PHE A 101
GLY A  58
ALA A  57
ILE A 100
TYR A 104
 None
FMN  A 165 (-3.8A)
None
None
None
 1.29A 4rtpA-1fueA:
undetectable		 4rtpA-1fueA:
19.80
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.
1g60 ADENINE-SPECIFIC
METHYLTRANSFERASE
MBOIIA

(Moraxella bovis) 		PF01555
(N6_N4_Mtase) 		5 PHE A 220
GLY A 222
ASN A 243
ASP A  30
PRO A  32
 SAM  A 500 (-4.6A)
SAM  A 500 (-3.2A)
None
SAM  A 500 (-3.7A)
None
 0.85A 4rtpA-1g60A:
undetectable		 4rtpA-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.
1mjf SPERMIDINE SYNTHASE

(Pyrococcus
furiosus) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 GLY A 151
ILE A 146
ASN A 149
TYR A 188
ASP A 153
 None
 1.27A 4rtpA-1mjfA:
9.9		 4rtpA-1mjfA:
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.
1ogp SULFITE OXIDASE

(Arabidopsis
thaliana) 		PF00174
(Oxidored_molyb)
PF03404
(Mo-co_dimer) 		5 GLY A 212
SER A 292
ILE A 175
SER A 174
ASP A 263
 None
None
None
GOL  A1393 (-2.5A)
None
 1.23A 4rtpA-1ogpA:
undetectable		 4rtpA-1ogpA:
21.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pek PROTEINASE K

(Parengyodontium
album) 		PF00082
(Peptidase_S8) 		5 GLY E 181
ALA E 182
ASN E 194
SER E 197
PRO E 265
 None
 1.30A 4rtpA-1pekE:
2.2		 4rtpA-1pekE:
20.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qho ALPHA-AMYLASE

(Geobacillus
stearothermophilus) 		PF00128
(Alpha-amylase)
PF00686
(CBM_20)
PF01833
(TIG)
PF02806
(Alpha-amylase_C) 		5 ALA A   4
SER A   1
ILE A 322
SER A 358
ASP A 223
 None
 1.16A 4rtpA-1qhoA:
undetectable		 4rtpA-1qhoA:
19.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ql0 NUCLEASE

(Serratia
marcescens) 		PF01223
(Endonuclease_NS) 		5 PHE A  38
SER A  18
ILE A 111
ASN A 110
PRO A 167
 None
 1.26A 4rtpA-1ql0A:
undetectable		 4rtpA-1ql0A:
19.61
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.
1r4n AMYLOID BETA
PRECURSOR
PROTEIN-BINDING
PROTEIN 1
UBIQUITIN-ACTIVATING
ENZYME E1C

(Homo sapiens;
Homo sapiens) 		PF00899
(ThiF)
PF00899
(ThiF)
PF08825
(E2_bind) 		5 GLY B  60
ALA B  56
ILE B 299
ASN B 296
GLN A 527
 None
ATP  B   5 (-4.7A)
None
None
None
 1.27A 4rtpA-1r4nB:
4.0		 4rtpA-1r4nB:
22.42
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.
1sc6 D-3-PHOSPHOGLYCERATE
DEHYDROGENASE

(Escherichia
coli) 		PF00389
(2-Hacid_dh)
PF01842
(ACT)
PF02826
(2-Hacid_dh_C) 		5 GLY A 222
ALA A 223
SER A 227
ASN A 219
SER A 216
 None
None
None
None
NAD  A2101 (-2.8A)
 1.29A 4rtpA-1sc6A:
4.9		 4rtpA-1sc6A:
22.35
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.
1ud3 AMYLASE

(Bacillus sp.
KSM-K38) 		PF00128
(Alpha-amylase)
PF09154
(DUF1939) 		5 GLY A  88
ILE A  95
ASN A  93
TYR A  98
ASP A 224
 None
 0.94A 4rtpA-1ud3A:
undetectable		 4rtpA-1ud3A:
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.
1xg5 ARPG836

(Homo sapiens) 		PF00106
(adh_short) 		5 GLY A  24
ALA A  25
SER A  20
ILE A 196
SER A 197
 None
None
NAP  A1301 (-2.7A)
None
None
 1.27A 4rtpA-1xg5A:
5.1		 4rtpA-1xg5A:
23.53
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.
1yfj DNA ADENINE
METHYLASE

(Escherichia
virus T4) 		PF02086
(MethyltransfD12) 		6 PHE A  32
GLY A  34
SER A  37
ILE A  51
ASP A 171
PRO A 173
 SAH  A 401 (-4.2A)
SAH  A 401 (-3.2A)
SAH  A 401 (-2.4A)
SAH  A 401 (-3.6A)
SAH  A 401 (-3.8A)
SAH  A 401 (-4.0A)
 0.34A 4rtpA-1yfjA:
25.8		 4rtpA-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.
1yln HYPOTHETICAL PROTEIN
VCA0042

(Vibrio cholerae) 		PF07238
(PilZ)
PF12945
(YcgR_2) 		5 SER A 109
ILE A  27
ASN A  28
SER A  25
GLN A 134
 None
 1.19A 4rtpA-1ylnA:
undetectable		 4rtpA-1ylnA:
24.92
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.
2a5j RAS-RELATED PROTEIN
RAB-2B

(Homo sapiens) 		PF00071
(Ras) 		5 PHE A  12
GLY A  86
ALA A  87
TYR A  10
GLN A 177
 None
 1.21A 4rtpA-2a5jA:
undetectable		 4rtpA-2a5jA:
25.78
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.
2dph FORMALDEHYDE
DISMUTASE

(Pseudomonas
putida) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 GLY A  65
SER A 132
ILE A  44
ASN A  43
TYR A  52
 None
 1.31A 4rtpA-2dphA:
4.5		 4rtpA-2dphA:
22.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2dpm PROTEIN
(ADENINE-SPECIFIC
METHYLTRANSFERASE
DPNII 1)

(Streptococcus
pneumoniae) 		PF02086
(MethyltransfD12) 		6 TRP A  17
PHE A  43
GLY A  45
ASN A  64
ASP A 194
PRO A 196
 SAM  A 300 (-4.3A)
SAM  A 300 (-4.2A)
SAM  A 300 (-3.6A)
None
SAM  A 300 (-3.7A)
SAM  A 300 ( 4.1A)
 0.31A 4rtpA-2dpmA:
9.2		 4rtpA-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.
2e7u GLUTAMATE-1-SEMIALDE
HYDE 2,1-AMINOMUTASE

(Thermus
thermophilus) 		PF00202
(Aminotran_3) 		5 GLY A 213
ALA A 212
ILE A 357
ASN A 351
TYR A  57
 None
 1.12A 4rtpA-2e7uA:
3.6		 4rtpA-2e7uA:
22.60
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.
2esr METHYLTRANSFERASE

(Streptococcus
pyogenes) 		PF03602
(Cons_hypoth95) 		5 PHE A  49
GLY A  51
ASN A  73
ASP A 117
PRO A 119
 None
 0.85A 4rtpA-2esrA:
11.0		 4rtpA-2esrA:
20.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2g5c PREPHENATE
DEHYDROGENASE

(Aquifex
aeolicus) 		PF02153
(PDH) 		5 GLY A  39
SER A  44
ILE A  63
ASN A  64
PRO A 100
 NAD  A3686 (-3.3A)
None
NAD  A3686 (-3.9A)
None
NAD  A3686 (-4.5A)
 1.15A 4rtpA-2g5cA:
5.6		 4rtpA-2g5cA:
20.39
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.
2jjq UNCHARACTERIZED RNA
METHYLTRANSFERASE
PYRAB10780

(Pyrococcus
abyssi) 		PF05958
(tRNA_U5-meth_tr) 		5 GLY A 280
ASN A 301
SER A 325
ASP A 340
PRO A 342
 SAH  A1406 (-3.4A)
None
SAH  A1406 (-4.0A)
SAH  A1406 (-3.8A)
SAH  A1406 (-4.1A)
 0.77A 4rtpA-2jjqA:
11.5		 4rtpA-2jjqA:
27.04
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.
2p65 HYPOTHETICAL PROTEIN
PF08_0063

(Plasmodium
falciparum) 		PF00004
(AAA) 		5 GLY A 129
ALA A 130
ILE A 143
ASN A 142
GLN A 111
 None
 1.10A 4rtpA-2p65A:
undetectable		 4rtpA-2p65A:
19.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pgc UNCHARACTERIZED
PROTEIN

(uncultured
marine organism) 		no annotation 5 GLY A  88
ILE A  92
ASN A  91
ASP A  86
GLN A  75
 None
 1.23A 4rtpA-2pgcA:
undetectable		 4rtpA-2pgcA:
20.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2r3b YJEF-RELATED PROTEIN

(Enterococcus
faecalis) 		PF01256
(Carb_kinase) 		5 GLY A 101
ALA A  40
SER A  44
ASP A 128
GLN A 137
 None
 0.99A 4rtpA-2r3bA:
3.4		 4rtpA-2r3bA:
21.86
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.
2uy3 ENDOCHITINASE

(Saccharomyces
cerevisiae) 		PF00704
(Glyco_hydro_18) 		5 PHE A 154
GLY A 108
SER A  59
ASN A 158
ASP A 153
 None
 1.31A 4rtpA-2uy3A:
undetectable		 4rtpA-2uy3A:
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.
2vn7 GLUCOAMYLASE

(Trichoderma
reesei) 		PF00686
(CBM_20)
PF00723
(Glyco_hydro_15) 		5 GLY A 174
SER A 185
SER A 102
ASP A 126
PRO A 107
 None
 1.29A 4rtpA-2vn7A:
undetectable		 4rtpA-2vn7A:
19.02
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.
2xd7 CORE HISTONE
MACRO-H2A.2

(Homo sapiens) 		PF01661
(Macro) 		5 ALA A 261
SER A 263
ILE A 294
ASN A 296
PRO A 218
 None
 1.30A 4rtpA-2xd7A:
undetectable		 4rtpA-2xd7A:
23.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cj1 ECTONUCLEOSIDE
TRIPHOSPHATE
DIPHOSPHOHYDROLASE 2

(Rattus
norvegicus) 		PF01150
(GDA1_CD39) 		5 GLY A 204
ALA A 205
SER A 206
TYR A 349
ASP A 201
 None
 1.16A 4rtpA-3cj1A:
undetectable		 4rtpA-3cj1A:
21.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3czm L-LACTATE
DEHYDROGENASE

(Toxoplasma
gondii) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 PHE A 115
GLY A  99
ALA A  98
ASN A 140
PRO A 114
 None
NAD  A 401 (-4.4A)
NAD  A 401 (-3.4A)
OXQ  A 708 ( 3.4A)
None
 1.11A 4rtpA-3czmA:
4.2		 4rtpA-3czmA:
23.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dc7 PUTATIVE
UNCHARACTERIZED
PROTEIN LP_3323

(Lactobacillus
plantarum) 		PF13472
(Lipase_GDSL_2) 		6 GLY A  59
ALA A  33
SER A  61
ILE A  79
TYR A  76
ASP A  70
 None
 1.36A 4rtpA-3dc7A:
3.9		 4rtpA-3dc7A:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3df7 PUTATIVE ATP-GRASP
SUPERFAMILY PROTEIN

(Archaeoglobus
fulgidus) 		PF02655
(ATP-grasp_3) 		5 GLY A 167
ILE A 204
SER A 205
ASP A 238
PRO A 240
 None
 1.27A 4rtpA-3df7A:
undetectable		 4rtpA-3df7A:
23.12
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.
3egw RESPIRATORY NITRATE
REDUCTASE 1 BETA
CHAIN

(Escherichia
coli) 		PF13247
(Fer4_11)
PF14711
(Nitr_red_bet_C) 		5 ALA B 448
ASN B  12
SER B 260
ASP B 454
PRO B 329
 None
 1.10A 4rtpA-3egwB:
undetectable		 4rtpA-3egwB:
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.
3gdf PROBABLE
NADP-DEPENDENT
MANNITOL
DEHYDROGENASE

(Cladosporium
herbarum) 		PF13561
(adh_short_C2) 		5 GLY A  35
ALA A  28
SER A  29
ILE A 202
SER A 203
 None
 1.23A 4rtpA-3gdfA:
5.6		 4rtpA-3gdfA:
19.74
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.
3ggg PREPHENATE
DEHYDROGENASE

(Aquifex
aeolicus) 		no annotation 5 GLY D  39
SER D  44
ILE D  63
ASN D  64
PRO D 100
 NAD  D6686 (-3.3A)
None
NAD  D6686 (-4.0A)
None
NAD  D6686 (-4.6A)
 1.14A 4rtpA-3gggD:
4.9		 4rtpA-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.
3gv0 TRANSCRIPTIONAL
REGULATOR, LACI
FAMILY

(Agrobacterium
fabrum) 		PF13377
(Peripla_BP_3) 		5 GLY A 264
ALA A 267
ILE A 259
SER A 256
ASP A 235
 None
 1.22A 4rtpA-3gv0A:
undetectable		 4rtpA-3gv0A:
21.98
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.
3htx HEN1

(Arabidopsis
thaliana) 		PF13847
(Methyltransf_31) 		5 GLY A 723
SER A 726
ILE A 746
SER A 778
GLN A 805
 SAH  A 951 (-3.7A)
SAH  A 951 (-3.1A)
SAH  A 951 (-3.8A)
SAH  A 951 (-3.2A)
None
 0.90A 4rtpA-3htxA:
11.1		 4rtpA-3htxA:
16.14
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.
3htx HEN1

(Arabidopsis
thaliana) 		PF13847
(Methyltransf_31) 		5 GLY A 723
SER A 726
ILE A 746
TYR A 924
ASP A 719
 SAH  A 951 (-3.7A)
SAH  A 951 (-3.1A)
SAH  A 951 (-3.8A)
None
None
 1.21A 4rtpA-3htxA:
11.1		 4rtpA-3htxA:
16.14
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.
3kyz SENSOR PROTEIN PFES

(Pseudomonas
aeruginosa) 		PF16750
(HK_sensor) 		5 PHE A  69
GLY A  65
ALA A  64
SER A  93
TYR A  50
 FMT  A 150 ( 4.6A)
None
None
None
None
 1.20A 4rtpA-3kyzA:
undetectable		 4rtpA-3kyzA:
17.47
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.
3om9 LACTATE
DEHYDROGENASE

(Toxoplasma
gondii) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 PHE A 115
GLY A  99
ALA A  98
ASN A 140
PRO A 114
 None
NAD  A 701 (-4.2A)
NAD  A 701 (-3.4A)
OXQ  A 702 ( 3.2A)
None
 1.11A 4rtpA-3om9A:
undetectable		 4rtpA-3om9A:
21.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3oml PEROXISOMAL
MULTIFUNCTIONAL
ENZYME TYPE 2,
CG3415

(Drosophila
melanogaster) 		PF00106
(adh_short)
PF01575
(MaoC_dehydratas)
PF13452
(MaoC_dehydrat_N) 		5 GLY A 463
ALA A 462
SER A 429
ASP A 415
GLN A 367
 None
 1.10A 4rtpA-3omlA:
undetectable		 4rtpA-3omlA:
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.
3pic CIP2

(Trichoderma
reesei) 		no annotation 5 GLY A 251
ALA A 249
ILE A 175
SER A 176
PRO A 152
 None
 1.14A 4rtpA-3picA:
undetectable		 4rtpA-3picA:
19.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pic CIP2

(Trichoderma
reesei) 		no annotation 5 GLY A 251
ILE A 175
SER A 176
ASP A 257
PRO A 152
 None
 1.20A 4rtpA-3picA:
undetectable		 4rtpA-3picA:
19.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qdr PROTEIN TOLA

(Escherichia
coli) 		PF06519
(TolA) 		5 GLY A 342
SER A 346
ILE A 337
ASN A 338
PRO A 404
 None
 1.31A 4rtpA-3qdrA:
undetectable		 4rtpA-3qdrA:
19.59
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.
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)
 0.90A 4rtpA-3qv2A:
6.1		 4rtpA-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.
3r0o CARNITINYL-COA
DEHYDRATASE

(Mycobacterium
avium) 		PF00378
(ECH_1) 		5 GLY A 112
ALA A 134
SER A 133
ILE A  26
ASP A  66
 None
 1.19A 4rtpA-3r0oA:
undetectable		 4rtpA-3r0oA:
20.32
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.
3r4t 4-AMINOBUTYRATE
AMINOTRANSFERASE
GABT

(Mycobacterium
marinum) 		PF00202
(Aminotran_3) 		5 ALA A 269
ILE A 427
SER A 428
ASP A 341
GLN A   6
 None
 1.26A 4rtpA-3r4tA:
2.1		 4rtpA-3r4tA:
21.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rd7 ACYL-COA
THIOESTERASE

(Mycobacterium
avium) 		PF13622
(4HBT_3) 		5 PHE A  63
GLY A  67
ILE A  35
SER A  37
GLN A 275
 None
 1.29A 4rtpA-3rd7A:
undetectable		 4rtpA-3rd7A:
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.
3ruy ORNITHINE
AMINOTRANSFERASE

(Bacillus
anthracis) 		PF00202
(Aminotran_3) 		5 GLY A 106
ALA A 107
ILE A 264
ASN A 104
SER A 296
 LLP  A 255 ( 3.5A)
LLP  A 255 ( 3.4A)
None
None
None
 1.23A 4rtpA-3ruyA:
undetectable		 4rtpA-3ruyA:
21.62
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.
3up4 OTEMO

(Pseudomonas
putida) 		PF00743
(FMO-like) 		5 GLY A 334
ALA A 335
SER A 290
TYR A 257
GLN A 282
 None
 1.31A 4rtpA-3up4A:
undetectable		 4rtpA-3up4A:
20.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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
 1.02A 4rtpA-3v7pA:
undetectable		 4rtpA-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.
3vqr PUTATIVE
OXIDOREDUCTASE

(Aeropyrum
pernix) 		PF01266
(DAO) 		5 GLY A  15
ALA A 229
SER A 172
ASP A  34
PRO A  39
 None
None
None
FAD  A1001 (-2.6A)
None
 1.18A 4rtpA-3vqrA:
2.2		 4rtpA-3vqrA:
23.46
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.
3wq4 BETA-PRIMEVEROSIDASE

(Camellia
sinensis) 		PF00232
(Glyco_hydro_1) 		5 PHE A 461
ALA A 464
ILE A 414
ASN A 417
TYR A 413
 None
 1.13A 4rtpA-3wq4A:
undetectable		 4rtpA-3wq4A:
20.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4d0p COP9 SIGNALOSOME
COMPLEX SUBUNIT 4

(Homo sapiens) 		PF01399
(PCI) 		5 PHE A 321
GLY A 325
ALA A 326
SER A 340
GLN A 354
 None
None
None
NA  A 509 (-2.2A)
None
 1.27A 4rtpA-4d0pA:
undetectable		 4rtpA-4d0pA:
24.87
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.
4d47 LEVANSUCRASE

(Erwinia
amylovora) 		PF02435
(Glyco_hydro_68) 		5 PHE A 207
GLY A  55
ILE A 208
TYR A 216
PRO A 206
 None
 1.26A 4rtpA-4d47A:
undetectable		 4rtpA-4d47A:
19.81
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.
4g1p CYS-GLY
METALLODIPEPTIDASE
DUG1

(Saccharomyces
cerevisiae) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 GLY A 387
ALA A 388
SER A 173
ASP A 179
GLN A  69
 None
 1.27A 4rtpA-4g1pA:
undetectable		 4rtpA-4g1pA:
20.28
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) 		12 TRP D  10
PHE D  35
GLY D  37
ALA D  38
SER D  40
ILE D  55
ASN D  56
SER D 164
TYR D 165
ASP D 181
PRO D 183
GLN D 205
 0Y0  D 301 (-4.5A)
0Y0  D 301 (-4.4A)
0Y0  D 301 ( 3.8A)
None
None
0Y0  D 301 (-3.8A)
None
0Y0  D 301 (-3.6A)
None
0Y0  D 301 (-3.2A)
0Y0  D 301 (-4.0A)
0Y0  D 301 ( 4.6A)
 0.51A 4rtpA-4gomD:
38.4		 4rtpA-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.
4iig BETA-GLUCOSIDASE 1

(Aspergillus
aculeatus) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		5 GLY A 160
ALA A 145
ASN A 157
SER A 550
PRO A 597
 None
 1.27A 4rtpA-4iigA:
3.1		 4rtpA-4iigA:
17.34
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.
4lvk PLASMID
RECOMBINATION ENZYME

(Streptococcus
agalactiae) 		PF01076
(Mob_Pre) 		5 GLY A 137
ALA A 121
ILE A  85
ASP A  81
GLN A 161
 None
 1.18A 4rtpA-4lvkA:
undetectable		 4rtpA-4lvkA:
23.63
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.
4mca GLYCEROL
DEHYDROGENASE

(Serratia
plymuthica) 		PF00465
(Fe-ADH) 		5 GLY A 168
ALA A 167
ILE A 234
ASP A 121
PRO A 123
 None
None
None
GOL  A1002 ( 2.2A)
None
 1.28A 4rtpA-4mcaA:
undetectable		 4rtpA-4mcaA:
20.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4n83 RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE
SUBUNIT BETA

(Streptococcus
sanguinis) 		PF00268
(Ribonuc_red_sm) 		5 ILE A 183
ASN A 179
SER A 103
TYR A 104
PRO A 168
 None
 1.00A 4rtpA-4n83A:
undetectable		 4rtpA-4n83A:
21.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4plf LACTATE
DEHYDROGENASE

(Apicomplexa) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 PHE A 105
GLY A  85
ALA A  84
ASN A 131
PRO A 104
 None
NAI  A 401 (-4.0A)
NAI  A 401 (-3.4A)
NAI  A 401 ( 3.2A)
None
 1.11A 4rtpA-4plfA:
3.6		 4rtpA-4plfA:
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.
4pmz XYLANASE

(Xanthomonas
citri) 		PF00331
(Glyco_hydro_10) 		5 ALA A 217
ILE A 192
SER A 191
TYR A 190
PRO A 139
 None
 1.21A 4rtpA-4pmzA:
undetectable		 4rtpA-4pmzA:
21.45
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.
4pyh PHOSPHOGLUCAN
PHOSPHATASE DSP4,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF00782
(DSPc)
PF16561
(AMPK1_CBM) 		5 GLY A 201
ALA A 200
ILE A 101
ASN A  99
GLN A 217
 PO4  A 408 (-3.5A)
GLC  A 402 ( 3.5A)
None
None
None
 1.28A 4rtpA-4pyhA:
undetectable		 4rtpA-4pyhA:
23.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qey UNCHARACTERIZED
PROTEIN

(Bacteroides
ovatus) 		PF14466
(PLCC) 		5 GLY A 103
ALA A 102
SER A 148
ILE A 106
SER A 107
 PEG  A 201 (-4.3A)
PEG  A 201 (-3.6A)
None
None
None
 1.27A 4rtpA-4qeyA:
undetectable		 4rtpA-4qeyA:
17.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4r04 TOXIN A

(Clostridioides
difficile) 		PF11713
(Peptidase_C80)
PF12918
(TcdB_N)
PF12919
(TcdA_TcdB)
PF12920
(TcdA_TcdB_pore) 		5 PHE A1317
ALA A1320
SER A1340
ILE A1157
TYR A1315
 None
 1.30A 4rtpA-4r04A:
undetectable		 4rtpA-4r04A:
9.39
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.
4v12 MAOC LIKE DOMAIN
PROTEIN

(Mycolicibacterium
smegmatis) 		PF01575
(MaoC_dehydratas)
PF13452
(MaoC_dehydrat_N) 		5 GLY A 268
ALA A 269
SER A 273
ILE A 331
SER A 326
 None
 1.13A 4rtpA-4v12A:
undetectable		 4rtpA-4v12A:
24.65
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.
4y9l PROTEIN ACDH-11,
ISOFORM B

(Caenorhabditis
elegans) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M) 		5 GLY A 205
ALA A 250
SER A 161
PRO A 302
GLN A 300
 None
 1.30A 4rtpA-4y9lA:
undetectable		 4rtpA-4y9lA:
21.10
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.
4ye4 HT593.1 GP120
HEAVY CHAIN HUMAN
ANTIBODY HJ16

(Human
immunodeficiency
virus;
Homo sapiens) 		PF00516
(GP120)
PF07654
(C1-set)
PF07686
(V-set) 		5 GLY G 474
SER G 256
ASN H 105
SER G 365
GLN G 362
 None
 1.23A 4rtpA-4ye4G:
undetectable		 4rtpA-4ye4G:
18.82
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.
4yuf CORB

(Corallococcus
coralloides) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		5 GLY A  62
ALA A  63
ILE A 150
SER A 151
PRO A  21
 None
 1.12A 4rtpA-4yufA:
undetectable		 4rtpA-4yufA:
22.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4z19 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3

(Yersinia pestis) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		5 GLY A 138
ALA A 277
SER A 275
ILE A  76
SER A 105
 None
None
SCY  A 112 ( 3.5A)
None
None
 1.22A 4rtpA-4z19A:
undetectable		 4rtpA-4z19A:
20.11
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.
5a2k IG LAMBDA-1 CHAIN V
REGION S43

(Mus musculus) 		PF07686
(V-set) 		5 PHE H1062
GLY H1046
ALA H 101
PRO H1059
GLN H1079
 None
 1.23A 4rtpA-5a2kH:
undetectable		 4rtpA-5a2kH:
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.
5by3 BTGH115A

(Bacteroides
thetaiotaomicron) 		PF15979
(Glyco_hydro_115) 		5 TRP A 212
PHE A 238
GLY A 240
ALA A 241
GLN A  94
 None
 1.17A 4rtpA-5by3A:
undetectable		 4rtpA-5by3A:
17.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dkv ABC TRANSPORTER
SUBSTRATE BINDING
PROTEIN (RIBOSE)

(Agrobacterium
vitis) 		PF13407
(Peripla_BP_4) 		5 PHE A 235
GLY A 239
ALA A 213
SER A 214
ASP A 208
 T6T  A 401 ( 4.5A)
None
None
None
None
 1.21A 4rtpA-5dkvA:
undetectable		 4rtpA-5dkvA:
24.78
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.
5dxx ARTEMISINIC ALDEHYDE
DELTA(11(13))
REDUCTASE

(Artemisia annua) 		PF00724
(Oxidored_FMN) 		5 PHE A  54
GLY A  52
ALA A  51
ASN A  17
TYR A 271
 None
 1.11A 4rtpA-5dxxA:
undetectable		 4rtpA-5dxxA:
19.00
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.
5e72 N2,
N2-DIMETHYLGUANOSINE
TRNA
METHYLTRANSFERASE

(Thermococcus
kodakarensis) 		PF01170
(UPF0020)
PF02926
(THUMP) 		5 GLY A 189
ALA A 190
ILE A 209
ASP A 254
PRO A 256
 SAM  A 400 (-3.3A)
None
SAM  A 400 (-3.9A)
None
SAM  A 400 (-4.2A)
 0.97A 4rtpA-5e72A:
13.9		 4rtpA-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.
5e72 N2,
N2-DIMETHYLGUANOSINE
TRNA
METHYLTRANSFERASE

(Thermococcus
kodakarensis) 		PF01170
(UPF0020)
PF02926
(THUMP) 		5 PHE A 187
GLY A 189
ALA A 190
ILE A 209
PRO A 256
 SAM  A 400 (-4.7A)
SAM  A 400 (-3.3A)
None
SAM  A 400 (-3.9A)
SAM  A 400 (-4.2A)
 0.55A 4rtpA-5e72A:
13.9		 4rtpA-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.
5f1q PERIPLASMIC
DIPEPTIDE TRANSPORT
PROTEIN

(Yersinia pestis) 		PF00496
(SBP_bac_5) 		5 GLY A 209
ILE A 185
ASN A  62
PRO A  44
GLN A 125
 None
 1.29A 4rtpA-5f1qA:
undetectable		 4rtpA-5f1qA:
20.23
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.
5gp4 GLUTAMATE
DECARBOXYLASE

(Lactobacillus
brevis) 		no annotation 5 PHE C 265
ALA C 224
ILE C 271
ASN C 269
ASP C 264
 None
 1.23A 4rtpA-5gp4C:
3.2		 4rtpA-5gp4C:
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.
5gw5 T-COMPLEX PROTEIN 1
SUBUNIT THETA
T-COMPLEX PROTEIN 1
SUBUNIT ZETA

(Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae) 		PF00118
(Cpn60_TCP1)
PF00118
(Cpn60_TCP1) 		5 GLY z  49
ALA z  50
SER q  20
PRO q  80
GLN q  27
 None
 1.24A 4rtpA-5gw5z:
undetectable		 4rtpA-5gw5z:
18.92
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.
5gzt CHITINASE

(Paenibacillus
sp. FPU-7) 		PF00704
(Glyco_hydro_18) 		5 ALA B1078
ILE B1073
ASN B1074
TYR B1118
ASP B1112
 None
 1.28A 4rtpA-5gztB:
undetectable		 4rtpA-5gztB:
13.77
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.
5gzu CHITINASE

(Paenibacillus
sp. FPU-7) 		PF00704
(Glyco_hydro_18) 		5 ALA A1078
ILE A1073
ASN A1074
TYR A1118
ASP A1112
 None
 1.23A 4rtpA-5gzuA:
undetectable		 4rtpA-5gzuA:
17.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ikj CRYPTIC LOCI
REGULATOR 2

(Schizosaccharomyces
pombe) 		PF10383
(Clr2)
PF16761
(Clr2_transil) 		5 SER A 165
ASN A 189
SER A 184
TYR A 180
GLN A 210
 None
 1.23A 4rtpA-5ikjA:
undetectable		 4rtpA-5ikjA:
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.
5j72 PUTATIVE
N-ACETYLMURAMOYL-L-A
LANINE
AMIDASE,AUTOLYSIN
CWP6

(Clostridioides
difficile) 		PF01520
(Amidase_3)
PF04122
(CW_binding_2) 		5 GLY A 352
ALA A 353
ILE A 323
ASN A 284
TYR A 322
 None
 1.18A 4rtpA-5j72A:
undetectable		 4rtpA-5j72A:
18.17
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.
5jrp MARBERG VIRUS
MONOCLONAL ANTIBODY
MR78 FAB HEAVY CHAIN

(Homo sapiens) 		no annotation 5 TRP H  43
GLY H  42
ILE H  30
SER H  31
TYR H  60
 None
 1.19A 4rtpA-5jrpH:
undetectable		 4rtpA-5jrpH:
20.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5nkp KELCH-LIKE PROTEIN 3

(Homo sapiens) 		PF01344
(Kelch_1) 		5 GLY A 543
ALA A 530
ASN A 550
SER A 572
GLN A 329
 None
None
CL  A 603 ( 4.4A)
None
None
 1.23A 4rtpA-5nkpA:
undetectable		 4rtpA-5nkpA:
21.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5tg8 HEMAGGLUTININ HA1
CHAIN

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		5 GLY A 134
ALA A 135
SER A 146
ILE A 130
GLN A 166
 None
 1.15A 4rtpA-5tg8A:
undetectable		 4rtpA-5tg8A:
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.
5u7x NOD FACTOR BINDING
LECTIN-NUCLEOTIDE
PHOSPHOHYDROLASE

(Vigna
unguiculata) 		PF01150
(GDA1_CD39) 		5 GLY F 161
ALA F 162
SER F 163
TYR F 302
ASP F 158
 PO4  F 502 (-3.8A)
PO4  F 502 (-3.7A)
PO4  F 502 (-3.8A)
None
MN  F 503 ( 4.1A)
 1.13A 4rtpA-5u7xF:
undetectable		 4rtpA-5u7xF:
22.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5vn3 ENVELOPE
GLYCOPROTEIN GP160

(Human
immunodeficiency
virus 1) 		PF00517
(GP41) 		5 PHE A 522
GLY A 516
ALA A 525
ILE A 519
TYR A 586
 None
 1.29A 4rtpA-5vn3A:
undetectable		 4rtpA-5vn3A:
18.97
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.
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)
 0.79A 4rtpA-5wt3A:
11.2		 4rtpA-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.
5wy0 SMALL RNA
2'-O-METHYLTRANSFERA
SE

(Homo sapiens) 		no annotation 5 GLY A  27
ILE A  49
ASN A  50
SER A  84
ASP A  23
 SAM  A 800 (-3.5A)
SAM  A 800 (-4.0A)
None
SAM  A 800 (-3.4A)
SAM  A 800 ( 4.5A)
 1.26A 4rtpA-5wy0A:
10.5		 4rtpA-5wy0A:
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.
5xgz BETA-GLYCOSIDASE

(uncultured
microorganism) 		no annotation 5 GLY A 101
ALA A 100
ILE A  84
SER A  83
PRO A  87
 None
 1.29A 4rtpA-5xgzA:
undetectable		 4rtpA-5xgzA:
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.
5xr6 RAS-RELATED PROTEIN
RABA1A

(Arabidopsis
thaliana) 		no annotation 5 PHE A  14
GLY A  88
ALA A  89
ILE A 177
TYR A  12
 None
 1.22A 4rtpA-5xr6A:
undetectable		 4rtpA-5xr6A:
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
 1.05A 4rtpA-6b07A:
undetectable		 4rtpA-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.
6bo0 MDBA PROTEIN

(Corynebacterium
matruchotii) 		no annotation 5 GLY A 136
ALA A 135
ILE A 203
SER A  68
ASP A  88
 None
None
None
None
CSO  A  91 ( 4.7A)
 1.09A 4rtpA-6bo0A:
undetectable		 4rtpA-6bo0A:
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.
6c1d UNCONVENTIONAL
MYOSIN-IB

(Rattus
norvegicus) 		no annotation 5 GLY P 631
ALA P 630
ILE P 687
ASN P 689
GLN P 636
 None
 1.29A 4rtpA-6c1dP:
undetectable		 4rtpA-6c1dP:
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.
6f0k FE-S-CLUSTER-CONTAIN
ING HYDROGENASE

(Rhodothermus
marinus) 		no annotation 5 GLY B 126
ALA B 136
SER B 133
SER B 116
TYR B  99
 None
 1.24A 4rtpA-6f0kB:
undetectable		 4rtpA-6f0kB:
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.
6fhv GLUCOAMYLASE

(Penicillium
oxalicum) 		no annotation 5 GLY A 208
SER A 219
SER A 136
ASP A 160
PRO A 141
 None
 1.30A 4rtpA-6fhvA:
undetectable		 4rtpA-6fhvA:
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.
6gu8 -

(-) 		no annotation 5 GLY A 232
ALA A 233
SER A 105
ASP A 238
PRO A  76
 None
 1.20A 4rtpA-6gu8A:
undetectable		 4rtpA-6gu8A:
undetectable