SIMILAR PATTERNS OF AMINO ACIDS FOR 4J7X_F_SASF805_1

List of similar pattern of amino acids derived from ASSAM search

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1bt2 PROTEIN (CATECHOL
OXIDASE)

(Ipomoea batatas) 		PF00264
(Tyrosinase)
PF12142
(PPO1_DWL) 		5 PHE A 270
ASP A 267
ASP A 257
MET A 258
GLY A 259
 C2O  A 500 ( 4.8A)
None
None
None
None
 1.28A 4j7xF-1bt2A:
undetectable		 4j7xF-1bt2A:
22.06
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.
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
 1.35A 4j7xF-1dlpA:
undetectable		 4j7xF-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.
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
 1.30A 4j7xF-1e3dB:
undetectable		 4j7xF-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.
1ezv UBIQUINOL-CYTOCHROME
C REDUCTASE COMPLEX
CORE PROTEIN I

(Saccharomyces
cerevisiae) 		PF00675
(Peptidase_M16)
PF05193
(Peptidase_M16_C) 		5 SER A 320
LEU A 319
TYR A 274
GLN A 372
GLY A 285
 None
 1.41A 4j7xF-1ezvA:
undetectable		 4j7xF-1ezvA:
24.00
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.
1nfd H57 FAB

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		5 LEU E  96
PHE F 100
TRP F 103
ASP F 101
ASP F  99
 None
 1.17A 4j7xF-1nfdE:
undetectable		 4j7xF-1nfdE:
21.68
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
ASP A 216
 OAA  A   1 (-2.5A)
None
OAA  A   1 ( 3.9A)
None
OAA  A   1 ( 4.3A)
None
OAA  A   1 ( 3.6A)
None
 0.47A 4j7xF-1oaaA:
42.1		 4j7xF-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
 1.02A 4j7xF-1oaaA:
42.1		 4j7xF-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.
1qf6 THREONYL-TRNA
SYNTHETASE

(Escherichia
coli) 		PF00587
(tRNA-synt_2b)
PF02824
(TGS)
PF03129
(HGTP_anticodon)
PF07973
(tRNA_SAD) 		5 LEU A  25
TYR A  14
ASP A  49
ASP A  46
GLY A  38
 None
 1.19A 4j7xF-1qf6A:
undetectable		 4j7xF-1qf6A:
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.
1rkq HYPOTHETICAL PROTEIN
YIDA

(Escherichia
coli) 		PF08282
(Hydrolase_3) 		5 SER A 204
LEU A 205
ASP A 225
ASP A  10
GLY A  45
 None
None
MG  A1273 ( 4.4A)
MG  A1273 ( 2.6A)
CL  A1272 (-3.7A)
 1.43A 4j7xF-1rkqA:
4.0		 4j7xF-1rkqA:
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.
1rp1 PANCREATIC LIPASE
RELATED PROTEIN 1

(Canis lupus) 		PF00151
(Lipase)
PF01477
(PLAT) 		5 SER A 266
LEU A 175
ASP A 192
MET A 221
GLY A 222
 None
None
CA  A 501 (-3.4A)
None
None
 1.16A 4j7xF-1rp1A:
3.1		 4j7xF-1rp1A:
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.
1tke THREONYL-TRNA
SYNTHETASE

(Escherichia
coli) 		PF02824
(TGS)
PF07973
(tRNA_SAD) 		5 LEU A  25
TYR A  14
ASP A  49
ASP A  46
GLY A  38
 None
 1.16A 4j7xF-1tkeA:
undetectable		 4j7xF-1tkeA:
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.
1xfk FORMIMIDOYLGLUTAMASE

(Vibrio cholerae) 		PF00491
(Arginase) 		5 LEU A 276
PHE A 258
ASP A 256
ASP A 157
GLY A 200
 None
 1.11A 4j7xF-1xfkA:
2.2		 4j7xF-1xfkA:
19.88
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.
1xkh FERRIPYOVERDINE
RECEPTOR

(Pseudomonas
aeruginosa) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		5 SER A 479
PRO A 223
GLN A 218
ASP A 591
GLY A 260
 None
 1.48A 4j7xF-1xkhA:
undetectable		 4j7xF-1xkhA:
18.10
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.
1xkh FERRIPYOVERDINE
RECEPTOR

(Pseudomonas
aeruginosa) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		5 SER A 479
TYR A 532
GLN A 218
ASP A 591
GLY A 260
 None
 1.26A 4j7xF-1xkhA:
undetectable		 4j7xF-1xkhA:
18.10
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.
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
 1.07A 4j7xF-2ad1A:
undetectable		 4j7xF-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.
2hae MALATE
OXIDOREDUCTASE

(Thermotoga
maritima) 		PF00390
(malic)
PF03949
(Malic_M) 		5 SER A 144
LEU A 143
ASP A 155
ASP A 130
GLY A 132
 None
 1.32A 4j7xF-2haeA:
2.5		 4j7xF-2haeA:
21.87
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.
2hcf HYDROLASE, HALOACID
DEHALOGENASE-LIKE
FAMILY

(Chlorobaculum
tepidum) 		PF13419
(HAD_2) 		5 LEU A 100
PHE A   8
TYR A 135
ASP A   9
ASP A 177
 None
None
None
MG  A 300 (-2.5A)
MG  A 300 (-2.7A)
 1.48A 4j7xF-2hcfA:
2.1		 4j7xF-2hcfA:
23.41
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.
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)
 1.19A 4j7xF-2i7dA:
3.5		 4j7xF-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.
2igs HYPOTHETICAL PROTEIN

(Pseudomonas
aeruginosa) 		PF11508
(DUF3218) 		5 LEU A 209
PHE A 119
TYR A 211
ASP A 117
GLY A 112
 None
None
None
None
ACY  A2018 (-3.5A)
 1.39A 4j7xF-2igsA:
undetectable		 4j7xF-2igsA:
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.
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)
 1.11A 4j7xF-2jarA:
undetectable		 4j7xF-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.
2o2k METHIONINE SYNTHASE

(Homo sapiens) 		PF02965
(Met_synt_B12) 		5 PHE A1220
TYR A1227
PRO A1175
ASP A1084
GLY A1064
 None
 1.37A 4j7xF-2o2kA:
undetectable		 4j7xF-2o2kA:
23.66
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.
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
 1.35A 4j7xF-2proA:
undetectable		 4j7xF-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
 1.43A 4j7xF-2qobA:
undetectable		 4j7xF-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
 1.45A 4j7xF-2r2pA:
undetectable		 4j7xF-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.
2ybx PHOSPHATIDYLINOSITOL
-5-PHOSPHATE
4-KINASE TYPE-2
ALPHA

(Homo sapiens) 		PF01504
(PIP5K) 		5 PHE A 112
GLN A 177
ASP A 111
ASP A 108
GLY A 106
 None
 1.49A 4j7xF-2ybxA:
undetectable		 4j7xF-2ybxA:
19.26
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.
2yeq ALKALINE PHOSPHATASE
D

(Bacillus
subtilis) 		PF09423
(PhoD)
PF16655
(PhoD_N) 		5 PRO A 345
ASP A 289
ASP A 350
MET A 349
GLY A 354
 None
 1.50A 4j7xF-2yeqA:
2.8		 4j7xF-2yeqA:
20.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yev CYTOCHROME C OXIDASE
POLYPEPTIDE I+III

(Thermus
thermophilus) 		PF00115
(COX1)
PF00510
(COX3) 		5 LEU A 662
TRP A 781
TYR A 789
ASP A 778
GLY A 700
 None
 1.36A 4j7xF-2yevA:
undetectable		 4j7xF-2yevA:
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.
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
 1.03A 4j7xF-2zm5A:
3.1		 4j7xF-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
 1.06A 4j7xF-2zm5A:
3.1		 4j7xF-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.
2zsi PROBABLE GIBBERELLIN
RECEPTOR GID1L1

(Arabidopsis
thaliana) 		PF07859
(Abhydrolase_3) 		5 LEU A 130
CYH A 131
PHE A 111
TYR A  81
GLY A 115
 None
None
None
None
GA4  A 345 (-3.1A)
 1.30A 4j7xF-2zsiA:
3.6		 4j7xF-2zsiA:
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.
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
 1.03A 4j7xF-3a8rA:
undetectable		 4j7xF-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
 1.32A 4j7xF-3aflA:
undetectable		 4j7xF-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.
3bdr YCF58 PROTEIN

(Synechococcus
elongatus) 		PF09367
(CpeS) 		5 PHE A  10
ASP A   9
ASP A   6
MET A   5
GLY A   4
 None
 1.40A 4j7xF-3bdrA:
undetectable		 4j7xF-3bdrA:
19.15
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.
3cue TRANSPORT PROTEIN
PARTICLE 23 KDA
SUBUNIT

(Saccharomyces
cerevisiae) 		PF04099
(Sybindin) 		5 SER A 187
LEU A 185
CYH A 184
PHE A 106
ASP A 104
 None
 1.07A 4j7xF-3cueA:
undetectable		 4j7xF-3cueA:
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.
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
 1.42A 4j7xF-3dkoA:
undetectable		 4j7xF-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.
3ebl GIBBERELLIN RECEPTOR
GID1

(Oryza sativa) 		PF07859
(Abhydrolase_3) 		5 LEU A 137
CYH A 138
PHE A 141
TYR A  81
GLY A 201
 None
 1.38A 4j7xF-3eblA:
3.5		 4j7xF-3eblA:
21.72
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.
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
 1.29A 4j7xF-3fhcB:
2.2		 4j7xF-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.
3it4 ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ ALPHA CHAIN
ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ BETA CHAIN

(Mycobacterium
tuberculosis) 		PF01960
(ArgJ) 		5 CYH B 268
PHE B 228
ASP B 241
MET B 201
GLY A 190
 None
 1.36A 4j7xF-3it4B:
undetectable		 4j7xF-3it4B:
26.40
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.
3iv3 TAGATOSE
1,6-DIPHOSPHATE
ALDOLASE 2

(Streptococcus
mutans) 		PF01791
(DeoC) 		5 LEU A  52
PHE A  26
PRO A  44
ASP A  27
GLY A  30
 None
None
None
EDO  A 335 (-3.2A)
None
 1.29A 4j7xF-3iv3A:
undetectable		 4j7xF-3iv3A:
23.80
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.
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
 1.36A 4j7xF-3ju1A:
undetectable		 4j7xF-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.
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 4j7xF-3ldrA:
undetectable		 4j7xF-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.
3o0d TRIACYLGLYCEROL
LIPASE

(Yarrowia
lipolytica) 		PF01764
(Lipase_3)
PF03893
(Lipase3_N) 		5 LEU A  83
PHE A  59
ASP A  61
ASP A  67
GLY A  87
 None
 1.30A 4j7xF-3o0dA:
2.4		 4j7xF-3o0dA:
21.54
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.
3ozq SERPIN48

(Tenebrio
molitor) 		PF00079
(Serpin) 		5 LEU A  94
PHE A  52
GLN A  22
MET A 378
GLY A 377
 None
 1.41A 4j7xF-3ozqA:
undetectable		 4j7xF-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
 1.49A 4j7xF-3qr3A:
undetectable		 4j7xF-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
 1.32A 4j7xF-3rblA:
undetectable		 4j7xF-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.
3ruc WBGU

(Plesiomonas
shigelloides) 		PF01370
(Epimerase) 		5 SER A 332
LEU A 329
TYR A 238
GLN A 201
ASP A 235
 None
None
None
NAD  A 343 ( 4.8A)
None
 1.49A 4j7xF-3rucA:
6.5		 4j7xF-3rucA:
23.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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
 1.46A 4j7xF-3s3fA:
undetectable		 4j7xF-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.
3so4 METHIONINE-ADENOSYLT
RANSFERASE

(Entamoeba
histolytica) 		PF00438
(S-AdoMet_synt_N)
PF02772
(S-AdoMet_synt_M)
PF02773
(S-AdoMet_synt_C) 		5 SER A  13
PRO A  17
ASP A  80
ASP A  81
GLY A  85
 None
 1.47A 4j7xF-3so4A:
undetectable		 4j7xF-3so4A:
23.94
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.
3ty7 PUTATIVE ALDEHYDE
DEHYDROGENASE
SAV2122

(Staphylococcus
aureus) 		PF00171
(Aldedh) 		5 SER A 154
LEU A 157
PHE A 186
TYR A  77
ASP A 187
 None
 1.30A 4j7xF-3ty7A:
3.5		 4j7xF-3ty7A:
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.
3wfo POLY A POLYMERASE

(Aquifex
aeolicus) 		PF01743
(PolyA_pol)
PF01966
(HD)
PF12627
(PolyA_pol_RNAbd) 		5 LEU A 143
CYH A  37
PHE A  61
ASP A 112
GLY A  42
 None
None
None
None
SO4  A 601 ( 4.3A)
 1.34A 4j7xF-3wfoA:
undetectable		 4j7xF-3wfoA:
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.
4bc7 ALKYLDIHYDROXYACETON
EPHOSPHATE SYNTHASE,
PEROXISOMAL

(Cavia porcellus) 		PF01565
(FAD_binding_4)
PF02913
(FAD-oxidase_C) 		5 LEU A 405
CYH A 404
PHE A 395
PRO A 415
GLY A 391
 None
 1.40A 4j7xF-4bc7A:
undetectable		 4j7xF-4bc7A:
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.
4bju N-ACETYLGLUCOSAMINE-
PHOSPHATE MUTASE

(Aspergillus
fumigatus) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I) 		5 SER A 430
LEU A 434
PHE A 379
GLN A 423
GLY A 376
 None
 1.31A 4j7xF-4bjuA:
2.3		 4j7xF-4bjuA:
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.
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
 1.47A 4j7xF-4fd4A:
undetectable		 4j7xF-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.
4fo0 ACTIN-RELATED
PROTEIN 8

(Homo sapiens) 		PF00022
(Actin) 		5 LEU A 346
PHE A 318
TYR A 319
PRO A 328
ASP A 383
 None
 1.36A 4j7xF-4fo0A:
2.1		 4j7xF-4fo0A:
20.03
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.
4hxq ARGINASE-1

(Homo sapiens) 		PF00491
(Arginase) 		5 SER A  94
LEU A  95
ASP A 232
MET A 276
GLY A  99
 None
None
MN  A 902 (-3.0A)
None
None
 1.24A 4j7xF-4hxqA:
4.7		 4j7xF-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.
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
 1.38A 4j7xF-4nsxA:
undetectable		 4j7xF-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)
 1.36A 4j7xF-4qqfD:
undetectable		 4j7xF-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.
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
 1.10A 4j7xF-4u6bA:
undetectable		 4j7xF-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
 1.48A 4j7xF-4ug4A:
2.3		 4j7xF-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.
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
 1.39A 4j7xF-4xaxA:
undetectable		 4j7xF-4xaxA:
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.
4y9w ASPARTIC ACID
ENDOPEPTIDASE SAPP2

(Candida
parapsilosis) 		PF00026
(Asp) 		5 LEU A 299
PHE A 261
PRO A 297
ASP A 262
GLY A 205
 None
 1.21A 4j7xF-4y9wA:
undetectable		 4j7xF-4y9wA:
22.86
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) 		12 SER A 154
LEU A 155
CYH A 156
PHE A 161
TRP A 164
TYR A 167
PRO A 197
GLN A 203
ASP A 212
ASP A 214
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)
None
None
None
None
 0.69A 4j7xF-4z3kA:
45.0		 4j7xF-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) 		6 SER A 154
LEU A 155
PHE A 161
PRO A 197
GLN A 203
ASP A 212
 4KL  A 802 (-2.6A)
4KL  A 802 (-4.0A)
None
4KL  A 802 (-4.0A)
4KL  A 802 ( 3.2A)
None
 1.16A 4j7xF-4z3kA:
45.0		 4j7xF-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.
4zn6 1-DEOXY-D-XYLULOSE
5-PHOSPHATE
REDUCTOISOMERASE

(Acinetobacter
baumannii) 		PF02670
(DXP_reductoisom)
PF08436
(DXP_redisom_C)
PF13288
(DXPR_C) 		5 LEU A 120
PRO A 118
GLN A  91
ASP A 390
GLY A 112
 None
 1.37A 4j7xF-4zn6A:
6.7		 4j7xF-4zn6A:
24.88
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.
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
 1.47A 4j7xF-5bv9A:
undetectable		 4j7xF-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.
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
 1.21A 4j7xF-5e9aA:
undetectable		 4j7xF-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.
5erb POLYKETIDE SYNTHASE

(Bacillus
amyloliquefaciens) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		5 LEU A 580
PHE A 555
ASP A 558
ASP A 560
MET A 561
 None
 1.21A 4j7xF-5erbA:
undetectable		 4j7xF-5erbA:
19.22
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.
5fus PUTATIVE ENOYL COA
HYDRATASE

(Burkholderia
cenocepacia) 		PF00378
(ECH_1) 		5 LEU A 163
PHE A  88
PRO A 165
ASP A  84
GLY A  82
 None
DAO  A1285 (-3.4A)
None
None
DAO  A1285 ( 4.6A)
 1.35A 4j7xF-5fusA:
2.1		 4j7xF-5fusA:
21.70
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.
5hjl TAGATOSE
1,6-DIPHOSPHATE
ALDOLASE

(Streptococcus
porcinus) 		PF01791
(DeoC) 		5 LEU A  51
PHE A  25
PRO A  43
ASP A  26
GLY A  29
 None
None
None
None
SO4  A 403 (-3.8A)
 1.36A 4j7xF-5hjlA:
undetectable		 4j7xF-5hjlA:
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.
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
 1.43A 4j7xF-5j4aA:
undetectable		 4j7xF-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.
5jwf ASP/GLU-SPECIFIC
DIPEPTIDYL-PEPTIDASE

(Porphyromonas
gingivalis) 		PF10459
(Peptidase_S46) 		5 LEU A 519
PHE A 510
PRO A 523
ASP A 508
GLY A 502
 None
 1.37A 4j7xF-5jwfA:
undetectable		 4j7xF-5jwfA:
17.78
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.
5ng6 CRISPR-ASSOCIATED
ENDONUCLEASE CPF1

(Francisella
tularensis) 		no annotation 5 LEU A1211
PHE A1112
PRO A1232
ASP A1113
ASP A1129
 None
 1.30A 4j7xF-5ng6A:
undetectable		 4j7xF-5ng6A:
13.04
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.
5oki DNA POLYMERASE
EPSILON CATALYTIC
SUBUNIT A

(Saccharomyces
cerevisiae) 		no annotation 5 LEU A 496
CYH A 497
PRO A 491
ASP A 421
MET A 420
 None
 1.15A 4j7xF-5okiA:
undetectable		 4j7xF-5okiA:
15.83
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.
5ols RHAMNOGALACTURONAN
LYASE

(Bacteroides
thetaiotaomicron) 		no annotation 5 PHE A 217
TYR A 199
ASP A 215
ASP A 250
GLY A 283
 None
None
CA  A 601 (-2.1A)
AQA  A 606 ( 3.1A)
None
 1.47A 4j7xF-5olsA:
undetectable		 4j7xF-5olsA:
19.51
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.
5tr0 SEED LINOLEATE
13S-LIPOXYGENASE-1

(Glycine max) 		no annotation 5 SER A 749
LEU A 748
TYR A 317
ASP A 291
ASP A 288
 None
 1.37A 4j7xF-5tr0A:
undetectable		 4j7xF-5tr0A:
17.65
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.
5vnx 8-AMINO-7-OXONONANOA
TE SYNTHASE

(Burkholderia
multivorans) 		PF00155
(Aminotran_1_2) 		5 SER A 285
LEU A 286
PHE A 213
ASP A 209
GLY A 217
 None
EDO  A 604 (-4.3A)
None
None
None
 1.28A 4j7xF-5vnxA:
undetectable		 4j7xF-5vnxA:
24.18
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.
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
 1.42A 4j7xF-5x3hA:
undetectable		 4j7xF-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
 1.19A 4j7xF-5xh9A:
undetectable		 4j7xF-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.
6au8 GOLGI TO ER TRAFFIC
PROTEIN 4 HOMOLOG
LARGE PROLINE-RICH
PROTEIN BAG6

(Homo sapiens) 		no annotation 5 SER C1038
LEU C1037
TYR A 182
GLN A 202
ASP A 193
 None
None
None
GOL  A 401 ( 3.3A)
None
 1.27A 4j7xF-6au8C:
undetectable		 4j7xF-6au8C:
8.03