SIMILAR PATTERNS OF AMINO ACIDS FOR 4J7X_A_SASA806

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.
1b8x PROTEIN (AML-1B)

(Escherichia
coli) 		PF02798
(GST_N)
PF14497
(GST_C_3) 		5 PHE A 121
GLN A 203
ALA A 109
ASP A 165
MET A 164
 None
 1.28A 4j7xA-1b8xA:
undetectable		 4j7xA-1b8xA:
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.
1cuk RUVA PROTEIN

(Escherichia
coli) 		PF01330
(RuvA_N)
PF07499
(RuvA_C)
PF14520
(HHH_5) 		5 LEU A 124
PHE A  98
ALA A 109
MET A  93
GLY A  92
 None
 1.38A 4j7xA-1cukA:
undetectable		 4j7xA-1cukA:
21.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1dlp LECTIN SCAFET
PRECURSOR

(Hyacinthoides
hispanica) 		PF01453
(B_lectin) 		5 LEU A 225
PHE A 217
TYR A 228
ASP A 194
GLY A 207
 None
 1.39A 4j7xA-1dlpA:
undetectable		 4j7xA-1dlpA:
23.64
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.
1dys ENDOGLUCANASE

(Humicola
insolens) 		PF01341
(Glyco_hydro_6) 		5 SER A  99
TYR A  86
GLN A 159
ALA A 140
GLY A 147
 None
 1.25A 4j7xA-1dysA:
3.3		 4j7xA-1dysA:
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.
1e3d [NIFE] HYDROGENASE
LARGE SUBUNIT
[NIFE] HYDROGENASE
SMALL SUBUNIT

(Desulfovibrio
desulfuricans) 		PF00374
(NiFeSe_Hases)
PF01058
(Oxidored_q6)
PF14720
(NiFe_hyd_SSU_C) 		5 PHE B 352
TYR B 336
ASP A  83
MET A  82
GLY A  81
 None
 1.37A 4j7xA-1e3dB:
undetectable		 4j7xA-1e3dB:
20.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1fez PHOSPHONOACETALDEHYD
E HYDROLASE

(Bacillus cereus) 		PF13419
(HAD_2) 		5 SER A 114
LEU A 115
GLN A 250
ALA A 107
ASP A  12
 None
None
None
None
MG  A 801 (-3.7A)
 1.44A 4j7xA-1fezA:
2.2		 4j7xA-1fezA:
22.68
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.
1naa CELLOBIOSE
DEHYDROGENASE

(Phanerochaete
chrysosporium) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		5 LEU A 341
TYR A 337
ALA A 745
ASP A 721
GLY A 228
 None
None
None
6FA  A 801 (-4.3A)
None
 1.26A 4j7xA-1naaA:
undetectable		 4j7xA-1naaA:
20.70
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1oaa SEPIAPTERIN
REDUCTASE

(Mus musculus) 		PF00106
(adh_short) 		8 SER A 158
LEU A 159
CYH A 160
TRP A 168
TYR A 171
PRO A 201
GLN A 207
ALA A 210
 OAA  A   1 (-2.5A)
None
OAA  A   1 ( 3.9A)
None
OAA  A   1 ( 4.3A)
None
OAA  A   1 ( 3.6A)
OAA  A   1 (-3.5A)
 0.35A 4j7xA-1oaaA:
42.1		 4j7xA-1oaaA:
72.01
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1oaa SEPIAPTERIN
REDUCTASE

(Mus musculus) 		PF00106
(adh_short) 		5 SER A 158
LEU A 159
PRO A 201
GLN A 207
ASP A 216
 OAA  A   1 (-2.5A)
None
None
OAA  A   1 ( 3.6A)
None
 0.97A 4j7xA-1oaaA:
42.1		 4j7xA-1oaaA:
72.01
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.
1rzr GLUCOSE-RESISTANCE
AMYLASE REGULATOR

(Bacillus
megaterium) 		no annotation 5 SER G 330
LEU G 287
ALA G 258
ASP G 224
GLY G 226
 None
 1.43A 4j7xA-1rzrG:
3.0		 4j7xA-1rzrG:
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.
1uz4 MAN5A

(Cellvibrio
mixtus) 		PF00150
(Cellulase) 		5 LEU A 280
PHE A 268
ALA A 314
ASP A 264
MET A 265
 None
 1.45A 4j7xA-1uz4A:
2.6		 4j7xA-1uz4A:
21.92
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.
1v8d HYPOTHETICAL PROTEIN
(TT1679)

(Thermus
thermophilus) 		PF04260
(DUF436) 		5 LEU A  93
ALA A  50
ASP A 172
MET A 171
GLY A 170
 None
 1.35A 4j7xA-1v8dA:
undetectable		 4j7xA-1v8dA:
24.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1v8d HYPOTHETICAL PROTEIN
(TT1679)

(Thermus
thermophilus) 		PF04260
(DUF436) 		5 LEU A  93
ALA A  51
ASP A 172
MET A 171
GLY A 170
 None
 1.24A 4j7xA-1v8dA:
undetectable		 4j7xA-1v8dA:
24.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1v8d HYPOTHETICAL PROTEIN
(TT1679)

(Thermus
thermophilus) 		PF04260
(DUF436) 		5 LEU A  97
ALA A  50
ASP A 172
MET A 171
GLY A 170
 None
 1.32A 4j7xA-1v8dA:
undetectable		 4j7xA-1v8dA:
24.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ycg NITRIC OXIDE
REDUCTASE

(Moorella
thermoacetica) 		PF00258
(Flavodoxin_1)
PF00753
(Lactamase_B) 		5 PRO A 372
GLN A 352
ALA A 351
ASP A 260
GLY A 310
 None
 1.28A 4j7xA-1ycgA:
2.0		 4j7xA-1ycgA:
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.
2ad1 SULFOTRANSFERASE 1C2

(Homo sapiens) 		PF00685
(Sulfotransfer_1) 		5 LEU A 164
PHE A 160
TRP A 156
TYR A 159
PRO A 133
 None
 1.08A 4j7xA-2ad1A:
undetectable		 4j7xA-2ad1A:
21.08
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.
2ef4 ARGINASE

(Thermus
thermophilus) 		PF00491
(Arginase) 		5 PRO A 139
ALA A  74
ASP A  21
MET A  11
GLY A  95
 None
 0.85A 4j7xA-2ef4A:
3.0		 4j7xA-2ef4A:
25.88
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.
2fqz R.ECL18KI

(Enterobacter
cloacae) 		PF09019
(EcoRII-C) 		5 LEU A 130
PHE A  25
GLN A 282
ALA A 144
ASP A 288
 None
 1.27A 4j7xA-2fqzA:
undetectable		 4j7xA-2fqzA:
21.47
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.
2glj PROBABLE M18-FAMILY
AMINOPEPTIDASE 1

(Clostridium
acetobutylicum) 		PF02127
(Peptidase_M18) 		5 LEU A 438
GLN A 404
ALA A 406
ASP A 342
GLY A 434
 None
None
None
MN  A6002 (-2.0A)
None
 1.41A 4j7xA-2gljA:
undetectable		 4j7xA-2gljA:
22.48
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.
2i7d 5'(3')-DEOXYRIBONUCL
EOTIDASE, CYTOSOLIC
TYPE

(Homo sapiens) 		PF06941
(NT5C) 		5 LEU A 102
CYH A 108
PHE A  71
ASP A  17
GLY A  13
 DUR  A 300 (-4.7A)
None
None
None
MG  A 728 ( 4.5A)
 1.16A 4j7xA-2i7dA:
undetectable		 4j7xA-2i7dA:
22.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jar 5'(3')-DEOXYRIBONUCL
EOTIDASE

(Mus musculus) 		PF06941
(NT5C) 		5 LEU A 104
CYH A 110
PHE A  73
ASP A  19
GLY A  15
 UMP  A1200 (-4.1A)
UMP  A1200 ( 4.5A)
None
None
MG  A1201 ( 4.5A)
 1.08A 4j7xA-2jarA:
undetectable		 4j7xA-2jarA:
21.99
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.
2ong 4S-LIMONENE SYNTHASE

(Mentha spicata) 		PF01397
(Terpene_synth)
PF03936
(Terpene_synth_C) 		5 SER A 454
TRP A 324
ALA A 569
ASP A 577
GLY A 499
 FPG  A 600 ( 4.4A)
FPG  A 600 ( 3.8A)
None
None
None
 1.01A 4j7xA-2ongA:
undetectable		 4j7xA-2ongA:
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.
2pro ALPHA-LYTIC PROTEASE

(Lysobacter
enzymogenes) 		PF02983
(Pro_Al_protease) 		5 LEU A  27
GLN A  22
ASP A  15
MET A  12
GLY A  17
 None
 1.37A 4j7xA-2proA:
undetectable		 4j7xA-2proA:
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.
2qob EPHRIN RECEPTOR

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		5 SER A 809
LEU A 747
PHE A 871
ASP A 739
GLY A 741
 None
 1.44A 4j7xA-2qobA:
undetectable		 4j7xA-2qobA:
21.94
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.
2r2p EPHRIN TYPE-A
RECEPTOR 5

(Homo sapiens) 		PF07714
(Pkinase_Tyr)
PF14575
(EphA2_TM) 		5 SER A 863
LEU A 801
PHE A 925
ASP A 793
GLY A 795
 None
 1.47A 4j7xA-2r2pA:
undetectable		 4j7xA-2r2pA:
20.52
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.
2rhz LETHAL(3)MALIGNANT
BRAIN TUMOR-LIKE
PROTEIN

(Homo sapiens) 		PF02820
(MBT) 		5 SER A 394
CYH A 390
PHE A 375
TYR A 388
ALA A 365
 None
 1.17A 4j7xA-2rhzA:
undetectable		 4j7xA-2rhzA:
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.
2yjq CEL44C

(Paenibacillus
polymyxa) 		PF12891
(Glyco_hydro_44) 		5 LEU A 316
TYR A 321
PRO A 287
ALA A 308
GLY A 369
 None
 1.44A 4j7xA-2yjqA:
undetectable		 4j7xA-2yjqA:
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.
2z06 PUTATIVE
UNCHARACTERIZED
PROTEIN TTHA0625

(Thermus
thermophilus) 		PF13277
(YmdB) 		5 GLN A 224
ALA A 222
ASP A   8
MET A  10
GLY A 195
 None
 1.35A 4j7xA-2z06A:
2.7		 4j7xA-2z06A:
23.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ze0 ALPHA-GLUCOSIDASE

(Geobacillus sp.
HTA-462) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		5 LEU A  97
PHE A  81
PRO A  16
ASP A  79
GLY A  76
 None
 1.49A 4j7xA-2ze0A:
undetectable		 4j7xA-2ze0A:
19.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zm5 TRNA
DELTA(2)-ISOPENTENYL
PYROPHOSPHATE
TRANSFERASE

(Escherichia
coli) 		PF01715
(IPPT) 		5 LEU A 115
PHE A  14
TRP A 289
MET A  16
GLY A 106
 None
 1.04A 4j7xA-2zm5A:
3.2		 4j7xA-2zm5A:
25.92
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.
2zm5 TRNA
DELTA(2)-ISOPENTENYL
PYROPHOSPHATE
TRANSFERASE

(Escherichia
coli) 		PF01715
(IPPT) 		5 LEU A 115
PHE A  14
TRP A 289
MET A  16
GLY A 107
 None
 1.09A 4j7xA-2zm5A:
3.2		 4j7xA-2zm5A:
25.92
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.
3a8r PUTATIVE
UNCHARACTERIZED
PROTEIN

(Oryza sativa) 		PF08414
(NADPH_Ox)
PF13499
(EF-hand_7) 		5 SER A 201
LEU A 202
PHE A 182
MET A 188
GLY A 157
 None
 1.01A 4j7xA-3a8rA:
undetectable		 4j7xA-3a8rA:
17.99
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.
3afl OLIGO ALGINATE LYASE

(Agrobacterium
fabrum) 		PF07940
(Hepar_II_III)
PF16332
(DUF4962) 		5 SER A 530
LEU A 529
TYR A 365
ASP A 500
GLY A 502
 LGU  A1001 (-3.3A)
None
LGU  A1002 (-3.5A)
None
None
 1.35A 4j7xA-3aflA:
undetectable		 4j7xA-3aflA:
17.23
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.
3d3a BETA-GALACTOSIDASE

(Bacteroides
thetaiotaomicron) 		PF01301
(Glyco_hydro_35) 		5 LEU A  76
PRO A  52
ALA A 122
MET A 298
GLY A 301
 None
 1.38A 4j7xA-3d3aA:
undetectable		 4j7xA-3d3aA:
17.59
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.
3dbj ALLOPHYCOCYANIN

(Thermosynechococcus
vulcanus) 		PF00502
(Phycobilisome) 		5 SER A 142
LEU A 143
GLN A  58
ALA A 135
ASP A  89
 None
 1.40A 4j7xA-3dbjA:
undetectable		 4j7xA-3dbjA:
19.72
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.
3dko EPHRIN TYPE-A
RECEPTOR 7

(Homo sapiens) 		PF07714
(Pkinase_Tyr)
PF14575
(EphA2_TM) 		5 SER A 821
LEU A 759
PHE A 883
ASP A 751
GLY A 753
 None
 1.43A 4j7xA-3dkoA:
undetectable		 4j7xA-3dkoA:
22.58
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.
3dwf 11-BETA-HYDROXYSTERO
ID DEHYDROGENASE 1

(Cavia porcellus) 		PF00106
(adh_short) 		5 LEU A 251
ALA A 166
ASP A 114
MET A 115
GLY A 163
 None
 1.26A 4j7xA-3dwfA:
24.1		 4j7xA-3dwfA:
28.35
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.
3eo7 PUTATIVE
NITROREDUCTASE

(Trichormus
variabilis) 		PF00881
(Nitroreductase) 		5 LEU A  83
CYH A 129
PHE A  39
ALA A 108
GLY A 104
 None
None
None
None
FMN  A 700 ( 4.0A)
 1.19A 4j7xA-3eo7A:
undetectable		 4j7xA-3eo7A:
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.
3fhc ATP-DEPENDENT RNA
HELICASE DDX19B

(Homo sapiens) 		PF00270
(DEAD) 		5 LEU B 272
PHE B 277
PRO B 292
GLN B  81
ASP B 279
 None
 1.30A 4j7xA-3fhcB:
2.3		 4j7xA-3fhcB:
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.
3ju1 ENOYL-COA
HYDRATASE/ISOMERASE
FAMILY PROTEIN

(Shewanella
oneidensis) 		PF16113
(ECH_2) 		5 SER A 326
TYR A 110
GLN A 306
MET A 155
GLY A 184
 None
 1.37A 4j7xA-3ju1A:
undetectable		 4j7xA-3ju1A:
22.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kul EPHRIN TYPE-A
RECEPTOR 8

(Homo sapiens) 		PF07714
(Pkinase_Tyr)
PF14575
(EphA2_TM) 		5 SER A 823
LEU A 761
PHE A 885
ASP A 753
GLY A 755
 None
None
None
SO4  A 910 ( 4.1A)
None
 1.50A 4j7xA-3kulA:
undetectable		 4j7xA-3kulA:
25.59
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.
3kux PUTATIVE
OXIDOREDUCTASE

(Yersinia pestis) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		5 LEU A  80
PHE A  60
PRO A  71
ASP A  62
GLY A   8
 None
 1.35A 4j7xA-3kuxA:
7.1		 4j7xA-3kuxA:
21.94
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.
3ldr FRUCTOSYLTRANSFERASE

(Aspergillus
japonicus) 		PF00251
(Glyco_hydro_32N)
PF08244
(Glyco_hydro_32C) 		5 SER A 612
LEU A 611
PHE A 609
TYR A 604
GLY A 360
 None
 1.19A 4j7xA-3ldrA:
undetectable		 4j7xA-3ldrA:
17.98
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.
3n0r RESPONSE REGULATOR

(Caulobacter
vibrioides) 		PF00072
(Response_reg) 		5 SER A  67
LEU A  79
ALA A  93
ASP A  24
GLY A  28
 None
 1.44A 4j7xA-3n0rA:
undetectable		 4j7xA-3n0rA:
25.62
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.
3n0r RESPONSE REGULATOR

(Caulobacter
vibrioides) 		PF00072
(Response_reg) 		5 SER A  67
LEU A  79
GLN A  98
ALA A  93
ASP A  24
 None
 1.29A 4j7xA-3n0rA:
undetectable		 4j7xA-3n0rA:
25.62
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.
3oqn CATABOLITE CONTROL
PROTEIN A

(Bacillus
subtilis) 		PF00356
(LacI)
PF13377
(Peripla_BP_3) 		5 SER A 331
LEU A 288
ALA A 259
ASP A 225
GLY A 227
 None
 1.33A 4j7xA-3oqnA:
2.5		 4j7xA-3oqnA:
23.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3out GLUTAMATE RACEMASE

(Francisella
tularensis) 		PF01177
(Asp_Glu_race) 		5 SER A  12
CYH A  74
PRO A  42
ALA A 118
GLY A 144
 DGL  A 266 (-2.8A)
DGL  A 266 ( 3.7A)
DGL  A 266 (-4.5A)
None
None
 0.96A 4j7xA-3outA:
undetectable		 4j7xA-3outA:
24.84
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.
3ozq SERPIN48

(Tenebrio
molitor) 		PF00079
(Serpin) 		5 LEU A  94
PHE A  52
GLN A  22
MET A 378
GLY A 377
 None
 1.43A 4j7xA-3ozqA:
undetectable		 4j7xA-3ozqA:
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.
3qr3 ENDOGLUCANASE EG-II

(Trichoderma
reesei) 		PF00150
(Cellulase) 		5 LEU A  31
PHE A  12
TYR A  28
GLN A  46
ASP A 102
 None
 1.50A 4j7xA-3qr3A:
undetectable		 4j7xA-3qr3A:
20.99
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.
3rbl AROMATIC L-AMINO
ACID DECARBOXYLASE

(Homo sapiens) 		PF00282
(Pyridoxal_deC) 		5 SER A 108
CYH A 111
PHE A 357
ASP A  92
GLY A  96
 None
 1.34A 4j7xA-3rblA:
undetectable		 4j7xA-3rblA:
21.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rcn BETA-N-ACETYLHEXOSAM
INIDASE

(Paenarthrobacter
aurescens) 		PF00728
(Glyco_hydro_20)
PF02838
(Glyco_hydro_20b) 		5 LEU A 288
PHE A 344
GLN A 324
ALA A 325
GLY A 258
 None
None
SO4  A 553 (-4.1A)
None
None
 1.43A 4j7xA-3rcnA:
undetectable		 4j7xA-3rcnA:
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.
3s3f TYROSINE-PROTEIN
PHOSPHATASE 10D

(Drosophila
melanogaster) 		PF00102
(Y_phosphatase) 		5 SER A 249
LEU A 144
CYH A 242
ASP A 210
GLY A 212
 None
 1.49A 4j7xA-3s3fA:
undetectable		 4j7xA-3s3fA:
23.48
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.
3t6q CD180 ANTIGEN

(Mus musculus) 		PF13855
(LRR_8) 		5 SER A 491
LEU A 492
PHE A 481
ASP A 507
GLY A 478
 None
 1.32A 4j7xA-3t6qA:
undetectable		 4j7xA-3t6qA:
19.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3v4c ALDEHYDE
DEHYDROGENASE
(NADP+)

(Sinorhizobium
meliloti) 		PF00171
(Aldedh) 		5 SER A 363
TYR A 342
GLN A 331
ALA A 296
GLY A  91
 None
 1.48A 4j7xA-3v4cA:
undetectable		 4j7xA-3v4cA:
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.
3vup BETA-1,4-MANNANASE

(Aplysia kurodai) 		PF00150
(Cellulase) 		5 LEU A 126
PHE A 203
TYR A 195
GLN A  66
MET A 160
 None
 1.44A 4j7xA-3vupA:
undetectable		 4j7xA-3vupA:
19.77
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.
3vup BETA-1,4-MANNANASE

(Aplysia kurodai) 		PF00150
(Cellulase) 		5 LEU A 126
TYR A 195
GLN A  66
ALA A 113
MET A 160
 None
 1.42A 4j7xA-3vupA:
undetectable		 4j7xA-3vupA:
19.77
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.
3wl4 UNCHARACTERIZED
PROTEIN

(Pyrococcus
furiosus) 		PF02585
(PIG-L) 		5 SER A  56
LEU A  55
ALA A 211
ASP A  43
GLY A  47
 None
None
None
CD  A 301 ( 2.1A)
None
 1.39A 4j7xA-3wl4A:
4.2		 4j7xA-3wl4A:
20.46
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.
4au0 EXOGLUCANASE 2

(Trichoderma
reesei) 		PF01341
(Glyco_hydro_6) 		5 SER A 181
TRP A 135
TYR A 169
ALA A 304
GLY A 398
 None
None
None
BGC  A 602 ( 4.4A)
None
 1.34A 4j7xA-4au0A:
3.2		 4j7xA-4au0A:
21.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4av6 K(+)-STIMULATED
PYROPHOSPHATE-ENERGI
ZED SODIUM PUMP

(Thermotoga
maritima) 		PF03030
(H_PPase) 		5 LEU A 286
PHE A 355
PRO A 290
ALA A 366
ASP A 432
 None
 1.30A 4j7xA-4av6A:
undetectable		 4j7xA-4av6A:
19.13
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.
4d4g APNAA1

(Planktothrix
agardhii) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		5 TYR A 367
PRO A 301
ALA A 364
ASP A 381
GLY A 359
 None
ANP  A1489 ( 4.4A)
None
GOL  A1491 (-2.5A)
None
 1.23A 4j7xA-4d4gA:
undetectable		 4j7xA-4d4gA:
21.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ehj PHOSPHOGLYCERATE
KINASE

(Francisella
tularensis) 		PF00162
(PGK) 		5 LEU A 380
TYR A 152
ALA A 155
ASP A 139
MET A 138
 None
 1.47A 4j7xA-4ehjA:
4.0		 4j7xA-4ehjA:
22.58
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.
4fd4 ARYLALKYLAMINE
N-ACETYLTRANSFERASE
LIKE 5B

(Aedes aegypti) 		PF00583
(Acetyltransf_1) 		5 SER A  76
LEU A 132
PHE A 167
MET A 181
GLY A 180
 None
 1.46A 4j7xA-4fd4A:
undetectable		 4j7xA-4fd4A:
21.82
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.
4fi4 MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN

(Caulobacter sp.
K31) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 SER A 163
PHE A 168
TYR A 169
ALA A 172
GLY A  15
 None
 1.38A 4j7xA-4fi4A:
undetectable		 4j7xA-4fi4A:
21.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hxq ARGINASE-1

(Homo sapiens) 		PF00491
(Arginase) 		5 SER A  94
LEU A  95
ALA A 104
MET A 276
GLY A  99
 None
 1.34A 4j7xA-4hxqA:
2.7		 4j7xA-4hxqA:
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.
4iqf METHIONYL-TRNA
FORMYLTRANSFERASE

(Bacillus
anthracis) 		PF00551
(Formyl_trans_N)
PF02911
(Formyl_trans_C) 		5 PHE A 270
PRO A 287
GLN A 241
ALA A 239
GLY A 301
 None
 1.28A 4j7xA-4iqfA:
7.1		 4j7xA-4iqfA:
21.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4iql ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
II

(Porphyromonas
gingivalis) 		PF03060
(NMO) 		5 SER A 222
LEU A 223
PHE A 236
TYR A 237
ALA A 242
 None
 1.22A 4j7xA-4iqlA:
undetectable		 4j7xA-4iqlA:
24.55
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.
4jre NITRITE EXTRUSION
PROTEIN 1

(Escherichia
coli) 		PF07690
(MFS_1) 		5 SER A 332
LEU A 335
TYR A 446
ALA A 362
GLY A 297
 None
None
GYP  A 502 ( 4.9A)
None
None
 1.40A 4j7xA-4jreA:
undetectable		 4j7xA-4jreA:
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.
4l11 AGAP007709-PA

(Anopheles
gambiae) 		PF00027
(cNMP_binding) 		5 LEU A 636
PHE A 672
ALA A 664
ASP A 669
GLY A 667
 None
 1.47A 4j7xA-4l11A:
undetectable		 4j7xA-4l11A:
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.
4l59 LETHAL(3)MALIGNANT
BRAIN TUMOR-LIKE
PROTEIN 3

(Homo sapiens) 		PF02820
(MBT) 		5 SER A 420
CYH A 416
PHE A 401
TYR A 414
ALA A 391
 None
 1.19A 4j7xA-4l59A:
undetectable		 4j7xA-4l59A:
21.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4nsx U3 SMALL NUCLEOLAR
RNA-ASSOCIATED
PROTEIN 21

(Saccharomyces
cerevisiae) 		PF00400
(WD40)
PF12894
(ANAPC4_WD40) 		5 SER A  34
PRO A  38
GLN A 300
ASP A 272
GLY A 267
 None
 1.35A 4j7xA-4nsxA:
undetectable		 4j7xA-4nsxA:
16.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qqf MITOCHONDRIAL IMPORT
INNER MEMBRANE
TRANSLOCASE SUBUNIT
TIM50

(Saccharomyces
cerevisiae) 		no annotation 5 LEU D 323
PHE D 224
TYR D 232
PRO D 325
ASP D 222
 None
None
None
None
MG  D 401 ( 4.4A)
 1.34A 4j7xA-4qqfD:
undetectable		 4j7xA-4qqfD:
21.48
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.
4qvj VP1

(Norwalk virus) 		PF08435
(Calici_coat_C) 		5 LEU A 497
PHE A 227
TRP A 555
ALA A 506
ASP A 553
 None
 1.39A 4j7xA-4qvjA:
undetectable		 4j7xA-4qvjA:
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.
4u6b CONSERVED
HYPOTHETICAL
LIPOPROTEIN

(Zobellia
galactanivorans) 		PF04616
(Glyco_hydro_43) 		5 SER A 181
LEU A 148
CYH A 149
PRO A 204
GLY A 130
 None
None
None
PEG  A 504 ( 4.8A)
None
 1.11A 4j7xA-4u6bA:
undetectable		 4j7xA-4u6bA:
21.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ug4 CHOLINE SULFATASE

(Sinorhizobium
meliloti) 		PF00884
(Sulfatase)
PF12411
(Choline_sulf_C) 		5 LEU A 420
GLN A 232
ASP A 299
MET A 300
GLY A 302
 None
 1.50A 4j7xA-4ug4A:
2.9		 4j7xA-4ug4A:
20.53
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.
4uzs BETA-GALACTOSIDASE

(Bifidobacterium
bifidum) 		PF02449
(Glyco_hydro_42)
PF08532
(Glyco_hydro_42M)
PF08533
(Glyco_hydro_42C) 		5 LEU A 613
PHE A 497
ALA A 589
MET A 620
GLY A 621
 None
 1.37A 4j7xA-4uzsA:
3.7		 4j7xA-4uzsA:
19.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4wr4 GLUTATHIONE
S-TRANSFERASE
CLASS-MU 26 KDA
ISOZYME

(Schistosoma
japonicum) 		PF02798
(GST_N)
PF14497
(GST_C_3) 		5 PHE A 121
GLN A 203
ALA A 109
ASP A 165
MET A 164
 None
 1.24A 4j7xA-4wr4A:
undetectable		 4j7xA-4wr4A:
23.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xax DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA DOMAIN 1

(Thermus
aquaticus) 		PF04563
(RNA_pol_Rpb2_1) 		5 LEU A  94
PHE A 344
ASP A 342
MET A 340
GLY A 337
 None
 1.35A 4j7xA-4xaxA:
undetectable		 4j7xA-4xaxA:
22.46
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4z3k SEPIAPTERIN
REDUCTASE

(Homo sapiens) 		PF00106
(adh_short) 		11 SER A 154
CYH A 156
PHE A 161
TRP A 164
TYR A 167
PRO A 197
GLN A 203
ALA A 206
ASP A 214
MET A 215
GLY A 218
 4KL  A 802 (-2.6A)
4KL  A 802 ( 4.2A)
None
None
4KL  A 802 ( 4.1A)
4KL  A 802 (-4.0A)
4KL  A 802 ( 3.2A)
4KL  A 802 ( 4.3A)
None
None
None
 0.63A 4j7xA-4z3kA:
45.1		 4j7xA-4z3kA:
94.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4z3k SEPIAPTERIN
REDUCTASE

(Homo sapiens) 		PF00106
(adh_short) 		7 SER A 154
LEU A 155
CYH A 156
PHE A 161
PRO A 197
GLN A 203
ASP A 212
 4KL  A 802 (-2.6A)
4KL  A 802 (-4.0A)
4KL  A 802 ( 4.2A)
None
4KL  A 802 (-4.0A)
4KL  A 802 ( 3.2A)
None
 1.08A 4j7xA-4z3kA:
45.1		 4j7xA-4z3kA:
94.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4z3k SEPIAPTERIN
REDUCTASE

(Homo sapiens) 		PF00106
(adh_short) 		11 SER A 154
LEU A 155
CYH A 156
PHE A 161
TRP A 164
TYR A 167
PRO A 197
GLN A 203
ALA A 206
MET A 215
GLY A 218
 4KL  A 802 (-2.6A)
4KL  A 802 (-4.0A)
4KL  A 802 ( 4.2A)
None
None
4KL  A 802 ( 4.1A)
4KL  A 802 (-4.0A)
4KL  A 802 ( 3.2A)
4KL  A 802 ( 4.3A)
None
None
 0.56A 4j7xA-4z3kA:
45.1		 4j7xA-4z3kA:
94.44
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.
5bv9 CELLULOSE
1,4-BETA-CELLOBIOSID
ASE

(Bacillus
pumilus) 		PF02011
(Glyco_hydro_48) 		5 SER A 332
LEU A 331
GLN A 356
MET A 264
GLY A 263
 None
 1.45A 4j7xA-5bv9A:
undetectable		 4j7xA-5bv9A:
17.03
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.
5d8w ENDOGLUCANASE

(Ganoderma
lucidum) 		PF00150
(Cellulase) 		5 LEU A 173
PRO A 169
ALA A 123
ASP A 139
GLY A 134
 None
 1.09A 4j7xA-5d8wA:
2.0		 4j7xA-5d8wA:
22.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5e9a BETA-GALACTOSIDASE

(Rahnella sp. R3) 		PF02449
(Glyco_hydro_42)
PF08532
(Glyco_hydro_42M)
PF08533
(Glyco_hydro_42C) 		5 SER A   8
LEU A   7
PHE A  84
ASP A  19
GLY A  17
 None
 1.19A 4j7xA-5e9aA:
undetectable		 4j7xA-5e9aA:
19.20
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.
5h8y SULFITE REDUCTASE
[FERREDOXIN],
CHLOROPLASTIC

(Zea mays) 		PF01077
(NIR_SIR)
PF03460
(NIR_SIR_ferr) 		5 LEU A 502
CYH A 500
PRO A 541
ALA A 507
GLY A 558
 SF4  A 701 (-4.2A)
SF4  A 701 ( 2.3A)
None
None
None
 1.48A 4j7xA-5h8yA:
undetectable		 4j7xA-5h8yA:
19.86
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.
5huc 3-DEOXY-D-ARABINO-HE
PTULOSONATE
7-PHOSPHATE (DAHP)
SYNTHASE

(Corynebacterium
glutamicum) 		PF01474
(DAHP_synth_2) 		5 SER A 285
TYR A 264
GLN A 140
ALA A 142
GLY A 292
 None
None
None
None
PEP  A 502 (-3.2A)
 0.95A 4j7xA-5hucA:
undetectable		 4j7xA-5hucA:
21.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ip9 DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB1
DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB2

(Saccharomyces
cerevisiae) 		PF00562
(RNA_pol_Rpb2_6)
PF00623
(RNA_pol_Rpb1_2)
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)
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) 		5 SER A 751
CYH A 529
PHE A 662
PRO B1018
GLY A 665
 None
 1.36A 4j7xA-5ip9A:
undetectable		 4j7xA-5ip9A:
10.60
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.
5j4a TRNA NUCLEASE CDIA

(Burkholderia
pseudomallei) 		no annotation 5 LEU A 284
PHE A 268
PRO A 248
GLN A 253
ASP A 262
 None
 1.45A 4j7xA-5j4aA:
undetectable		 4j7xA-5j4aA:
22.82
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.
5ja1 ENTEROBACTIN
SYNTHASE COMPONENT F

(Escherichia
coli) 		PF00501
(AMP-binding)
PF00550
(PP-binding)
PF00668
(Condensation)
PF00975
(Thioesterase)
PF13193
(AMP-binding_C) 		5 LEU A 522
TYR A 577
ALA A 494
ASP A 506
GLY A 529
 None
 1.27A 4j7xA-5ja1A:
3.3		 4j7xA-5ja1A:
12.84
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.
5kju SHIKIMATE
O-HYDROXYCINNAMOYLTR
ANSFERASE

(Arabidopsis
thaliana) 		PF02458
(Transferase) 		5 LEU A  64
PHE A 164
ALA A 155
MET A 151
GLY A 150
 None
None
None
6TO  A 800 (-3.9A)
None
 1.50A 4j7xA-5kjuA:
undetectable		 4j7xA-5kjuA:
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.
5ldf GLUTAMINE SYNTHETASE

(Salmonella
enterica) 		PF00120
(Gln-synt_C)
PF03951
(Gln-synt_N) 		5 LEU A 311
ALA A 111
ASP A 380
MET A 376
GLY A 378
 None
 1.46A 4j7xA-5ldfA:
undetectable		 4j7xA-5ldfA:
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.
5m6p TYROCIDINE SYNTHASE
2

(Brevibacillus
parabrevis) 		no annotation 5 LEU A3220
PHE A3241
TYR A3203
ALA A3252
GLY A3497
 None
 1.43A 4j7xA-5m6pA:
undetectable		 4j7xA-5m6pA:
14.13
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.
5swn FLUOROACETATE
DEHALOGENASE

(Rhodopseudomonas
palustris) 		PF00561
(Abhydrolase_1) 		5 SER A 116
LEU A 119
PHE A 104
ALA A  63
MET A  96
 None
 1.23A 4j7xA-5swnA:
undetectable		 4j7xA-5swnA:
22.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5uu1 SERINE/THREONINE-PRO
TEIN KINASE VRK2

(Homo sapiens) 		PF00069
(Pkinase) 		5 SER A 190
TYR A 162
ALA A  81
ASP A 152
GLY A  99
 None
 1.19A 4j7xA-5uu1A:
undetectable		 4j7xA-5uu1A:
23.68
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.
5uxn PHOSPHO-2-DEHYDRO-3-
DEOXYHEPTONATE
ALDOLASE

(Pseudomonas
aeruginosa) 		no annotation 5 SER A 258
TYR A 240
GLN A 112
ALA A 114
GLY A 265
 None
None
PEP  A 504 ( 4.8A)
None
PEP  A 504 (-3.3A)
 0.97A 4j7xA-5uxnA:
undetectable		 4j7xA-5uxnA:
13.12
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.
5x3h URACIL-DNA
GLYCOSYLASE

(Nitratifractor
salsuginis) 		no annotation 5 LEU A  75
PHE A 159
ASP A 250
MET A 249
GLY A 247
 None
 1.39A 4j7xA-5x3hA:
undetectable		 4j7xA-5x3hA:
23.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xh9 EXTRACELLULAR
INVERTASE

(Aspergillus
kawachii) 		PF00251
(Glyco_hydro_32N)
PF08244
(Glyco_hydro_32C) 		5 SER A 585
LEU A 584
PHE A 582
TYR A 577
GLY A 333
 None
 1.20A 4j7xA-5xh9A:
undetectable		 4j7xA-5xh9A:
19.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5zmy -

(-) 		no annotation 5 LEU A 136
PRO A 179
ASP A 197
MET A 196
GLY A 199
 None
 1.48A 4j7xA-5zmyA:
2.1		 4j7xA-5zmyA:
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.
6a91 -

(-) 		no annotation 5 LEU A1496
PHE A1433
TYR A1430
ALA A1146
ASP A1441
 None
 1.25A 4j7xA-6a91A:
undetectable		 4j7xA-6a91A:
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.
6b82 CYTOCHROME P450,
FAMILY 17, SUBFAMILY
A, POLYPEPTIDE 1

(Danio rerio) 		no annotation 5 SER A 285
PHE A 136
GLN A 272
MET A 140
GLY A 143
 None
 1.32A 4j7xA-6b82A:
undetectable		 4j7xA-6b82A:
12.50