SIMILAR PATTERNS OF AMINO ACIDS FOR 2PH9_A_GNTA301_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.
1aua PHOSPHATIDYLINOSITOL
TRANSFER PROTEIN
SEC14P

(Saccharomyces
cerevisiae) 		PF00650
(CRAL_TRIO)
PF03765
(CRAL_TRIO_N) 		4 TYR A 111
TRP A 285
GLN A 109
ILE A 282
 None
 1.34A 2ph9A-1auaA:
undetectable
2ph9B-1auaA:
undetectable		 2ph9A-1auaA:
23.05
2ph9B-1auaA:
23.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1fep FERRIC ENTEROBACTIN
RECEPTOR

(Escherichia
coli) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		4 GLN A 308
TYR A 289
TYR A 192
ILE A 233
 None
 1.34A 2ph9A-1fepA:
0.0
2ph9B-1fepA:
0.0		 2ph9A-1fepA:
14.62
2ph9B-1fepA:
14.62
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.
1i8t UDP-GALACTOPYRANOSE
MUTASE

(Escherichia
coli) 		PF03275
(GLF)
PF13450
(NAD_binding_8) 		4 TYR A 239
TYR A 246
TYR A 325
ILE A 233
 None
 1.10A 2ph9A-1i8tA:
0.0
2ph9B-1i8tA:
undetectable		 2ph9A-1i8tA:
22.31
2ph9B-1i8tA:
22.31
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.
1m9q ENDOTHELIAL
NITRIC-OXIDE
SYNTHASE

(Homo sapiens) 		PF02898
(NO_synthase) 		4 TYR A 251
TYR A 357
TYR A 373
ILE A 375
 None
5NI  A 907 (-4.6A)
None
None
 1.34A 2ph9A-1m9qA:
0.0
2ph9B-1m9qA:
0.0		 2ph9A-1m9qA:
21.82
2ph9B-1m9qA:
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.
1qw5 NITRIC OXIDE
SYNTHASE, INDUCIBLE

(Mus musculus) 		PF02898
(NO_synthase) 		4 TYR A 261
TYR A 367
TYR A 383
ILE A 385
 None
 1.30A 2ph9A-1qw5A:
undetectable
2ph9B-1qw5A:
0.0		 2ph9A-1qw5A:
19.80
2ph9B-1qw5A:
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.
1ukm EMS16 A CHAIN
EMS16 B CHAIN

(Echis
multisquamatus) 		PF00059
(Lectin_C) 		4 TYR B  86
TRP A 116
TYR A  11
ILE A  70
 None
 1.03A 2ph9A-1ukmB:
0.0
2ph9B-1ukmB:
0.0		 2ph9A-1ukmB:
18.11
2ph9B-1ukmB:
18.11
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.
1v32 HYPOTHETICAL PROTEIN
RAFL09-47-K03

(Arabidopsis
thaliana) 		PF02201
(SWIB) 		4 TYR A  83
GLN A  94
TYR A  90
ILE A  44
 None
 1.22A 2ph9A-1v32A:
undetectable
2ph9B-1v32A:
undetectable		 2ph9A-1v32A:
16.96
2ph9B-1v32A:
16.96
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.
1xfd DIPEPTIDYL
AMINOPEPTIDASE-LIKE
PROTEIN 6

(Homo sapiens) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		4 TRP A 291
GLN A 403
TYR A 382
TYR A 344
 None
 1.25A 2ph9A-1xfdA:
0.0
2ph9B-1xfdA:
0.0		 2ph9A-1xfdA:
15.31
2ph9B-1xfdA:
15.31
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.
1ya0 SMG-7 TRANSCRIPT
VARIANT 2

(Homo sapiens) 		PF10373
(EST1_DNA_bind)
PF10374
(EST1) 		4 TYR A 102
TRP A  61
GLN A  41
TYR A  40
 None
 1.33A 2ph9A-1ya0A:
undetectable
2ph9B-1ya0A:
undetectable		 2ph9A-1ya0A:
20.26
2ph9B-1ya0A:
20.26
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.
1ypx PUTATIVE VITAMIN-B12
INDEPENDENT
METHIONINE SYNTHASE
FAMILY PROTEIN

(Listeria
monocytogenes) 		PF01717
(Meth_synt_2) 		4 GLN A 170
TYR A 169
TYR A 154
ILE A 105
 None
 1.31A 2ph9A-1ypxA:
undetectable
2ph9B-1ypxA:
undetectable		 2ph9A-1ypxA:
18.62
2ph9B-1ypxA:
18.62
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.
2buc DIPEPTIDYL PEPTIDASE
IV

(Sus scrofa) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		4 TRP A 201
GLN A 320
TYR A 299
TYR A 256
 None
 1.30A 2ph9A-2bucA:
undetectable
2ph9B-2bucA:
undetectable		 2ph9A-2bucA:
15.28
2ph9B-2bucA:
15.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ddt SPHINGOMYELIN
PHOSPHODIESTERASE

(Bacillus cereus) 		PF03372
(Exo_endo_phos) 		4 TYR A 242
TRP A  28
GLN A 286
TYR A 290
 MES  A 313 (-4.0A)
MES  A 313 (-3.5A)
None
MES  A 313 (-4.6A)
 1.28A 2ph9A-2ddtA:
undetectable
2ph9B-2ddtA:
undetectable		 2ph9A-2ddtA:
20.75
2ph9B-2ddtA:
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.
2go0 REGENERATING
ISLET-DERIVED
PROTEIN 3 ALPHA

(Homo sapiens) 		PF00059
(Lectin_C) 		4 TYR A  92
TRP A 120
TYR A   9
ILE A  66
 None
 1.10A 2ph9A-2go0A:
undetectable
2ph9B-2go0A:
undetectable		 2ph9A-2go0A:
19.66
2ph9B-2go0A:
19.66
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.
2jnu REGULATOR OF
G-PROTEIN SIGNALING
14

(Homo sapiens) 		PF00615
(RGS) 		4 TYR A  69
TRP A  88
GLN A  76
ILE A  83
 None
 1.31A 2ph9A-2jnuA:
undetectable
2ph9B-2jnuA:
undetectable		 2ph9A-2jnuA:
20.69
2ph9B-2jnuA:
20.69
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.
2nz9 BOTULINUM NEUROTOXIN
TYPE A

(Clostridium
botulinum) 		PF01742
(Peptidase_M27)
PF07951
(Toxin_R_bind_C)
PF07952
(Toxin_trans)
PF07953
(Toxin_R_bind_N) 		4 GLN A1003
TYR A1001
TYR A 962
ILE A 964
 None
 1.06A 2ph9A-2nz9A:
undetectable
2ph9B-2nz9A:
undetectable		 2ph9A-2nz9A:
9.65
2ph9B-2nz9A:
9.65
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.
2ppw CONSERVED DOMAIN
PROTEIN

(Streptococcus
pneumoniae) 		PF02502
(LacAB_rpiB)
PF12408
(DUF3666) 		4 GLN A 104
TYR A 102
TYR A  31
ILE A   3
 None
 1.30A 2ph9A-2ppwA:
undetectable
2ph9B-2ppwA:
undetectable		 2ph9A-2ppwA:
22.98
2ph9B-2ppwA:
22.98
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.
2vdv TRNA
(GUANINE-N(7)-)-METH
YLTRANSFERASE

(Saccharomyces
cerevisiae) 		PF02390
(Methyltransf_4) 		4 GLN E 153
TYR E  85
TYR E  82
ILE E  99
 None
 1.24A 2ph9A-2vdvE:
undetectable
2ph9B-2vdvE:
undetectable		 2ph9A-2vdvE:
21.76
2ph9B-2vdvE:
21.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2whk MANNAN
ENDO-1,4-BETA-MANNOS
IDASE

(Bacillus
subtilis) 		PF02156
(Glyco_hydro_26) 		4 TYR A 125
TRP A 174
GLN A 193
TYR A 191
 None
 1.35A 2ph9A-2whkA:
undetectable
2ph9B-2whkA:
undetectable		 2ph9A-2whkA:
21.28
2ph9B-2whkA:
21.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yys PROLINE
IMINOPEPTIDASE-RELAT
ED PROTEIN

(Thermus
thermophilus) 		PF12697
(Abhydrolase_6) 		4 TRP A 258
TYR A  40
TYR A 256
ILE A 259
 None
 1.08A 2ph9A-2yysA:
undetectable
2ph9B-2yysA:
undetectable		 2ph9A-2yysA:
17.63
2ph9B-2yysA:
17.63
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.
2ztg ALANYL-TRNA
SYNTHETASE

(Archaeoglobus
fulgidus) 		PF01411
(tRNA-synt_2c)
PF07973
(tRNA_SAD) 		4 TRP A 252
TYR A 338
TYR A  48
ILE A  51
 None
 0.70A 2ph9A-2ztgA:
undetectable
2ph9B-2ztgA:
undetectable		 2ph9A-2ztgA:
14.01
2ph9B-2ztgA:
14.01
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.
2zzg ALANYL-TRNA
SYNTHETASE

(Pyrococcus
horikoshii) 		PF01411
(tRNA-synt_2c)
PF07973
(tRNA_SAD) 		4 TRP A 258
TYR A 339
TYR A  45
ILE A  48
 None
 0.77A 2ph9A-2zzgA:
undetectable
2ph9B-2zzgA:
undetectable		 2ph9A-2zzgA:
15.12
2ph9B-2zzgA:
15.12
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.
3acc HYPOXANTHINE-GUANINE
PHOSPHORIBOSYLTRANSF
ERASE

(Thermus
thermophilus) 		PF00156
(Pribosyltran) 		4 TYR A  73
GLN A 139
TYR A 113
ILE A  70
 None
 1.26A 2ph9A-3accA:
undetectable
2ph9B-3accA:
undetectable		 2ph9A-3accA:
22.69
2ph9B-3accA:
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.
3bg2 DGTP
TRIPHOSPHOHYDROLASE

(Leeuwenhoekiella
blandensis) 		PF01966
(HD) 		4 TYR A 210
GLN A 214
TYR A 413
ILE A 131
 None
 1.25A 2ph9A-3bg2A:
undetectable
2ph9B-3bg2A:
undetectable		 2ph9A-3bg2A:
20.40
2ph9B-3bg2A:
20.40
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.
3bjx HALOCARBOXYLIC ACID
DEHALOGENASE DEHI

(Pseudomonas
putida) 		PF10778
(DehI) 		4 GLN A  12
TYR A  23
TYR A 265
ILE A 121
 None
 1.30A 2ph9A-3bjxA:
undetectable
2ph9B-3bjxA:
undetectable		 2ph9A-3bjxA:
19.87
2ph9B-3bjxA:
19.87
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.
3cm1 SSGA-LIKE
SPORULATION-SPECIFIC
CELL DIVISION
PROTEIN

(Thermobifida
fusca) 		PF04686
(SsgA) 		4 TYR A 126
GLN A 122
TYR A  32
ILE A   8
 None
 1.23A 2ph9A-3cm1A:
undetectable
2ph9B-3cm1A:
undetectable		 2ph9A-3cm1A:
22.27
2ph9B-3cm1A:
22.27
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.
3cue TRANSPORT PROTEIN
PARTICLE 31 KDA
SUBUNIT

(Saccharomyces
cerevisiae) 		PF04051
(TRAPP) 		4 TRP B 188
GLN B 262
TYR B 266
ILE B 211
 None
 1.32A 2ph9A-3cueB:
undetectable
2ph9B-3cueB:
undetectable		 2ph9A-3cueB:
21.14
2ph9B-3cueB:
21.14
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.
3ddr HASR PROTEIN

(Serratia
marcescens) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		4 GLN A 191
TYR A 803
TYR A 170
ILE A 655
 None
 1.34A 2ph9A-3ddrA:
undetectable
2ph9B-3ddrA:
undetectable		 2ph9A-3ddrA:
14.70
2ph9B-3ddrA:
14.70
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.
3dsm UNCHARACTERIZED
PROTEIN BACUNI_02894

(Bacteroides
uniformis) 		no annotation 4 GLN A 305
TYR A 303
TYR A 283
ILE A 256
 None
 1.33A 2ph9A-3dsmA:
undetectable
2ph9B-3dsmA:
undetectable		 2ph9A-3dsmA:
22.35
2ph9B-3dsmA:
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.
3i4g SUSD-LIKE
CARBOHYDRATE BINDING
PROTEIN BF1063

(Bacteroides
fragilis) 		PF07980
(SusD_RagB)
PF14322
(SusD-like_3) 		4 TYR A 473
TRP A 531
TYR A 109
ILE A 106
 None
 1.28A 2ph9A-3i4gA:
undetectable
2ph9B-3i4gA:
undetectable		 2ph9A-3i4gA:
18.41
2ph9B-3i4gA:
18.41
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.
3keh GLUCOCEREBROSIDASE

(Homo sapiens) 		PF02055
(Glyco_hydro_30)
PF17189
(Glyco_hydro_30C) 		4 TRP A 378
TYR A 108
TYR A 363
ILE A 367
 None
 1.11A 2ph9A-3kehA:
undetectable
2ph9B-3kehA:
undetectable		 2ph9A-3kehA:
17.03
2ph9B-3kehA:
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.
3kxi GTP-BINDING PROTEIN
(HFLX)

(Sulfolobus
solfataricus) 		PF01926
(MMR_HSR1)
PF13167
(GTP-bdg_N)
PF16360
(GTP-bdg_M) 		4 GLN A 243
TYR A 114
TYR A  42
ILE A  62
 None
 1.35A 2ph9A-3kxiA:
undetectable
2ph9B-3kxiA:
undetectable		 2ph9A-3kxiA:
19.10
2ph9B-3kxiA:
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.
3ln3 DIHYDRODIOL
DEHYDROGENASE

(Mus musculus) 		PF00248
(Aldo_ket_red) 		4 GLN A  56
TYR A  55
TYR A 114
ILE A 115
 MLY  A 105 ( 3.6A)
NAD  A 327 ( 4.7A)
None
None
 1.15A 2ph9A-3ln3A:
undetectable
2ph9B-3ln3A:
undetectable		 2ph9A-3ln3A:
21.47
2ph9B-3ln3A:
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.
3o0d TRIACYLGLYCEROL
LIPASE

(Yarrowia
lipolytica) 		PF01764
(Lipase_3)
PF03893
(Lipase3_N) 		4 TYR A  82
GLN A 155
TYR A 154
ILE A  56
 None
 1.18A 2ph9A-3o0dA:
undetectable
2ph9B-3o0dA:
undetectable		 2ph9A-3o0dA:
23.66
2ph9B-3o0dA:
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.
3o0p SORTASE FAMILY
PROTEIN

(Streptococcus
agalactiae) 		PF04203
(Sortase) 		4 TYR A 213
GLN A 193
TYR A 189
ILE A 236
 None
 1.15A 2ph9A-3o0pA:
undetectable
2ph9B-3o0pA:
undetectable		 2ph9A-3o0pA:
20.58
2ph9B-3o0pA:
20.58
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.
3pps LACCASE

(Thielavia
arenaria) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 GLN A 132
TYR A  24
TYR A 133
ILE A 251
 None
 1.27A 2ph9A-3ppsA:
undetectable
2ph9B-3ppsA:
undetectable		 2ph9A-3ppsA:
17.57
2ph9B-3ppsA:
17.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rgh FILAMIN-A

(Homo sapiens) 		PF00630
(Filamin) 		4 TYR A 229
GLN A 248
TYR A 221
ILE A 222
 CME  A 198 (-4.4A)
None
None
None
 1.31A 2ph9A-3rghA:
2.9
2ph9B-3rghA:
2.3		 2ph9A-3rghA:
18.55
2ph9B-3rghA:
18.55
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.
3rsj BONT/F

(Clostridium
botulinum) 		PF07951
(Toxin_R_bind_C)
PF07953
(Toxin_R_bind_N) 		4 GLN A 997
TYR A 995
TYR A 955
ILE A 957
 None
 1.13A 2ph9A-3rsjA:
undetectable
2ph9B-3rsjA:
undetectable		 2ph9A-3rsjA:
19.95
2ph9B-3rsjA:
19.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3txa CELL WALL SURFACE
ANCHOR FAMILY
PROTEIN

(Streptococcus
agalactiae) 		PF00092
(VWA) 		4 GLN A 422
TYR A 519
TYR A 529
ILE A 379
 None
 0.77A 2ph9A-3txaA:
2.4
2ph9B-3txaA:
undetectable		 2ph9A-3txaA:
16.86
2ph9B-3txaA:
16.86
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.
3txa CELL WALL SURFACE
ANCHOR FAMILY
PROTEIN

(Streptococcus
agalactiae) 		PF00092
(VWA) 		4 GLN A 422
TYR A 519
TYR A 529
ILE A 531
 None
 1.14A 2ph9A-3txaA:
2.4
2ph9B-3txaA:
undetectable		 2ph9A-3txaA:
16.86
2ph9B-3txaA:
16.86
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.
3vsk PENICILLIN-BINDING
PROTEIN 3

(Staphylococcus
aureus) 		PF00905
(Transpeptidase)
PF03717
(PBP_dimer) 		4 TRP A 129
GLN A 145
TYR A 158
ILE A 166
 None
 1.33A 2ph9A-3vskA:
undetectable
2ph9B-3vskA:
undetectable		 2ph9A-3vskA:
18.15
2ph9B-3vskA:
18.15
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.
3wfa ALPHA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron) 		PF10566
(Glyco_hydro_97)
PF14508
(GH97_N)
PF14509
(GH97_C) 		4 TYR A 492
TYR A 470
TYR A 447
ILE A 502
 EDT  A 802 (-4.8A)
None
None
None
 1.35A 2ph9A-3wfaA:
undetectable
2ph9B-3wfaA:
undetectable		 2ph9A-3wfaA:
15.66
2ph9B-3wfaA:
15.66
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.
3wqy ALANINE--TRNA LIGASE

(Archaeoglobus
fulgidus) 		PF01411
(tRNA-synt_2c)
PF02272
(DHHA1)
PF07973
(tRNA_SAD) 		4 TRP A 252
TYR A 338
TYR A  48
ILE A  51
 None
 0.91A 2ph9A-3wqyA:
undetectable
2ph9B-3wqyA:
undetectable		 2ph9A-3wqyA:
12.50
2ph9B-3wqyA:
12.50
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.
3ziz GH5
ENDO-BETA-1,4-MANNAN
ASE

(Podospora
anserina) 		PF00150
(Cellulase) 		4 GLN A 143
TYR A 123
TYR A 190
ILE A 191
 None
 1.23A 2ph9A-3zizA:
undetectable
2ph9B-3zizA:
undetectable		 2ph9A-3zizA:
20.98
2ph9B-3zizA:
20.98
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.
3ziz GH5
ENDO-BETA-1,4-MANNAN
ASE

(Podospora
anserina) 		PF00150
(Cellulase) 		4 GLN A 143
TYR A 147
TYR A 190
ILE A 191
 None
 1.20A 2ph9A-3zizA:
undetectable
2ph9B-3zizA:
undetectable		 2ph9A-3zizA:
20.98
2ph9B-3zizA:
20.98
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.
4b9y ALPHA-GLUCOSIDASE,
PUTATIVE, ADG31B

(Cellvibrio
japonicus) 		PF01055
(Glyco_hydro_31)
PF13802
(Gal_mutarotas_2)
PF16338
(DUF4968)
PF17137
(DUF5110) 		4 GLN A 534
TYR A 530
TYR A 181
ILE A 161
 None
 1.08A 2ph9A-4b9yA:
undetectable
2ph9B-4b9yA:
undetectable		 2ph9A-4b9yA:
15.69
2ph9B-4b9yA:
15.69
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.
4bed HEMOCYANIN KLH1

(Megathura
crenulata) 		PF00264
(Tyrosinase)
PF14830
(Haemocyan_bet_s) 		4 TRP B2698
TYR B2621
TYR B2535
ILE B2538
 None
 1.34A 2ph9A-4bedB:
undetectable
2ph9B-4bedB:
undetectable		 2ph9A-4bedB:
9.03
2ph9B-4bedB:
9.03
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.
4bfc 3-DEOXY-D-MANNO-OCTU
LOSONIC-ACID
TRANSFERASE

(Acinetobacter
baumannii) 		no annotation 4 TRP A 320
GLN A 231
TYR A 309
ILE A 270
 None
 1.00A 2ph9A-4bfcA:
undetectable
2ph9B-4bfcA:
undetectable		 2ph9A-4bfcA:
21.03
2ph9B-4bfcA:
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.
4cc1 PROTEIN JAGGED-1

(Homo sapiens) 		PF00008
(EGF)
PF01414
(DSL)
PF07657
(MNNL) 		4 TRP A 128
GLN A  83
TYR A  82
ILE A 161
 None
 1.21A 2ph9A-4cc1A:
undetectable
2ph9B-4cc1A:
undetectable		 2ph9A-4cc1A:
20.86
2ph9B-4cc1A:
20.86
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.
4d01 NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
ALPHA-9

(Homo sapiens) 		PF02931
(Neur_chan_LBD) 		4 TYR A  95
TRP A 151
TYR A 192
TYR A 199
 EDO  A1220 ( 4.1A)
None
None
EDO  A1220 (-3.8A)
 0.59A 2ph9A-4d01A:
21.3
2ph9B-4d01A:
22.7		 2ph9A-4d01A:
26.47
2ph9B-4d01A:
26.47
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.
4d4l 6-PHOSPHOFRUCTO-2-KI
NASE/FRUCTOSE-2,6-BI
SPHOSPHATASE 3

(Homo sapiens) 		PF00300
(His_Phos_1)
PF01591
(6PF2K) 		4 TYR A 333
TYR A 408
TYR A 356
ILE A 323
 F6P  A1448 (-4.8A)
None
None
None
 1.19A 2ph9A-4d4lA:
undetectable
2ph9B-4d4lA:
undetectable		 2ph9A-4d4lA:
18.67
2ph9B-4d4lA:
18.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ecf ABC-TYPE PHOSPHATE
TRANSPORT SYSTEM,
PERIPLASMIC
COMPONENT

(Lactobacillus
brevis) 		PF12849
(PBP_like_2) 		4 GLN A  53
TYR A 255
TYR A  54
ILE A  84
 None
 1.35A 2ph9A-4ecfA:
undetectable
2ph9B-4ecfA:
undetectable		 2ph9A-4ecfA:
20.85
2ph9B-4ecfA:
20.85
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.
4en8 HEMAGGLUTININ
COMPONENTS
HA-22/23/53

(Clostridium
botulinum) 		PF03505
(Clenterotox) 		4 TYR B 454
TYR B 613
TYR B 214
ILE B 369
 None
 1.20A 2ph9A-4en8B:
undetectable
2ph9B-4en8B:
undetectable		 2ph9A-4en8B:
20.62
2ph9B-4en8B:
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.
4f0j PROBABLE HYDROLYTIC
ENZYME

(Pseudomonas
aeruginosa) 		PF00561
(Abhydrolase_1) 		4 GLN A 202
TYR A 206
TYR A 242
ILE A 245
 None
SO4  A 402 ( 4.3A)
None
None
 1.14A 2ph9A-4f0jA:
undetectable
2ph9B-4f0jA:
undetectable		 2ph9A-4f0jA:
19.20
2ph9B-4f0jA:
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.
4f5x RNA-DIRECTED RNA
POLYMERASE

(Rotavirus A) 		PF02123
(RdRP_4)
PF12289
(Rotavirus_VP1) 		4 TYR W 775
TYR W1004
TYR W1036
ILE W1032
 None
 1.25A 2ph9A-4f5xW:
undetectable
2ph9B-4f5xW:
undetectable		 2ph9A-4f5xW:
13.38
2ph9B-4f5xW:
13.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gk9 AGGLUTININ (BOA)

(Burkholderia
oklahomensis) 		no annotation 4 TYR A 128
GLN A 107
TYR A  79
ILE A 113
 None
 1.07A 2ph9A-4gk9A:
undetectable
2ph9B-4gk9A:
undetectable		 2ph9A-4gk9A:
21.65
2ph9B-4gk9A:
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.
4gpn 6-PHOSPHO-BETA-D-GLU
COSIDASE

(Streptococcus
mutans) 		PF00232
(Glyco_hydro_1) 		4 TYR A 264
TYR A 358
TYR A 367
ILE A 308
 None
 1.31A 2ph9A-4gpnA:
undetectable
2ph9B-4gpnA:
undetectable		 2ph9A-4gpnA:
18.63
2ph9B-4gpnA:
18.63
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.
4h2x AMINO
ACID--[ACYL-CARRIER-
PROTEIN] LIGASE 1

(Agrobacterium
fabrum;
Bradyrhizobium
diazoefficiens) 		no annotation 4 GLN B 229
TYR B 256
TYR B 135
ILE B 180
 None
 1.19A 2ph9A-4h2xB:
undetectable
2ph9B-4h2xB:
undetectable		 2ph9A-4h2xB:
20.74
2ph9B-4h2xB:
20.74
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.
4i59 CYCLOHEXYLAMINE
OXIDASE

(Microbacterium
oxydans) 		PF01593
(Amino_oxidase) 		4 TRP A 456
TYR A 211
TYR A 214
TYR A 459
 None
None
None
FAD  A 501 (-4.4A)
 1.10A 2ph9A-4i59A:
undetectable
2ph9B-4i59A:
undetectable		 2ph9A-4i59A:
19.46
2ph9B-4i59A:
19.46
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.
4ifa EXTRACELLULAR
PROTEIN CONTAINING A
SCP DOMAIN

(Bacillus
anthracis) 		PF00188
(CAP)
PF14504
(CAP_assoc_N) 		4 GLN A 172
TYR A 110
TYR A 337
ILE A 229
 None
 1.26A 2ph9A-4ifaA:
undetectable
2ph9B-4ifaA:
undetectable		 2ph9A-4ifaA:
18.57
2ph9B-4ifaA:
18.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ifa EXTRACELLULAR
PROTEIN CONTAINING A
SCP DOMAIN

(Bacillus
anthracis) 		PF00188
(CAP)
PF14504
(CAP_assoc_N) 		4 TYR A 174
TYR A 110
TYR A 337
ILE A 229
 None
 0.87A 2ph9A-4ifaA:
undetectable
2ph9B-4ifaA:
undetectable		 2ph9A-4ifaA:
18.57
2ph9B-4ifaA:
18.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jjj CELLULOSE
1,4-BETA-CELLOBIOSID
ASE

(Thermobifida
fusca) 		PF02011
(Glyco_hydro_48) 		4 TYR A 105
GLN A 109
TYR A 115
ILE A 317
 None
None
None
CE6  A 703 (-4.8A)
 1.30A 2ph9A-4jjjA:
undetectable
2ph9B-4jjjA:
undetectable		 2ph9A-4jjjA:
16.64
2ph9B-4jjjA:
16.64
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.
4kqb PROTEIN H03A11.1

(Caenorhabditis
elegans) 		PF06702
(Fam20C) 		4 TYR A 343
TYR A 332
TYR A 313
ILE A 411
 None
 1.26A 2ph9A-4kqbA:
undetectable
2ph9B-4kqbA:
undetectable		 2ph9A-4kqbA:
19.71
2ph9B-4kqbA:
19.71
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.
4mo2 UDP-GALACTOPYRANOSE
MUTASE

(Campylobacter
jejuni) 		no annotation 4 TYR B 238
TYR B 245
TYR B 324
ILE B 232
 None
 1.06A 2ph9A-4mo2B:
undetectable
2ph9B-4mo2B:
undetectable		 2ph9A-4mo2B:
20.00
2ph9B-4mo2B:
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.
4n8g TRAP DICARBOXYLATE
TRANSPORTER, DCTP
SUBUNIT

(Chromohalobacter
salexigens) 		PF03480
(DctP) 		4 TRP A 131
GLN A 239
TYR A 240
TYR A 130
 None
 1.15A 2ph9A-4n8gA:
undetectable
2ph9B-4n8gA:
undetectable		 2ph9A-4n8gA:
21.23
2ph9B-4n8gA:
21.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4p13 MEDIUM-CHAIN
SPECIFIC ACYL-COA
DEHYDROGENASE,
MITOCHONDRIAL

(Homo sapiens) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		4 TYR A 375
GLN A  95
TYR A 133
ILE A 167
 FAD  A 401 (-4.9A)
None
FAD  A 401 (-3.6A)
FAD  A 401 (-4.3A)
 1.33A 2ph9A-4p13A:
undetectable
2ph9B-4p13A:
undetectable		 2ph9A-4p13A:
20.98
2ph9B-4p13A:
20.98
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.
4q3l MGS-M2

(unidentified) 		PF00561
(Abhydrolase_1) 		4 GLN A  72
TYR A  70
TYR A  55
ILE A  11
 None
 1.35A 2ph9A-4q3lA:
undetectable
2ph9B-4q3lA:
undetectable		 2ph9A-4q3lA:
20.63
2ph9B-4q3lA:
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.
4qdi UDP-N-ACETYLMURAMOYL
-TRIPEPTIDE--D-ALANY
L-D-ALANINE LIGASE

(Acinetobacter
baumannii) 		PF01225
(Mur_ligase)
PF02875
(Mur_ligase_C)
PF08245
(Mur_ligase_M) 		4 TYR A 106
TRP A  14
GLN A  24
ILE A  40
 EDO  A 505 ( 4.8A)
EDO  A 505 (-4.1A)
None
None
 1.13A 2ph9A-4qdiA:
undetectable
2ph9B-4qdiA:
undetectable		 2ph9A-4qdiA:
18.26
2ph9B-4qdiA:
18.26
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.
4utt PUTATIVE
N-ACETYLMANNOSAMINE-
6-PHOSPHATE
2-EPIMERASE

(Clostridium
perfringens) 		PF04131
(NanE) 		4 GLN A 157
TYR A 154
TYR A  75
ILE A  74
 None
None
ACT  A1223 (-4.6A)
None
 1.32A 2ph9A-4uttA:
undetectable
2ph9B-4uttA:
undetectable		 2ph9A-4uttA:
19.28
2ph9B-4uttA:
19.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4w91 AMINOTRANSFERASE

(Brucella suis) 		PF00266
(Aminotran_5) 		4 GLN A  42
TYR A 393
TYR A 236
ILE A 342
 None
None
LLP  A 234 ( 4.3A)
None
 1.27A 2ph9A-4w91A:
undetectable
2ph9B-4w91A:
undetectable		 2ph9A-4w91A:
19.13
2ph9B-4w91A:
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.
4xbm DELTA-LIKE PROTEIN 1

(Homo sapiens) 		PF01414
(DSL)
PF07657
(MNNL) 		4 TYR A  79
TRP A 116
GLN A  68
TYR A  67
 None
 1.19A 2ph9A-4xbmA:
undetectable
2ph9B-4xbmA:
undetectable		 2ph9A-4xbmA:
17.57
2ph9B-4xbmA:
17.57
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4zjs ACETYLCHOLINE
RECEPTOR SUBUNIT
ALPHA,SOLUBLE
ACETYLCHOLINE
RECEPTOR,ACETYLCHOLI
NE RECEPTOR SUBUNIT
ALPHA,SOLUBLE
ACETYLCHOLINE
RECEPTOR

(Aplysia
californica;
Homo sapiens) 		PF02931
(Neur_chan_LBD) 		5 TYR A  93
TRP A 147
GLN A 186
TYR A 188
TYR A 195
 None
 0.97A 2ph9A-4zjsA:
28.1
2ph9B-4zjsA:
29.2		 2ph9A-4zjsA:
82.33
2ph9B-4zjsA:
82.33
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.
4zmh UNCHARACTERIZED
PROTEIN

(Saccharophagus
degradans) 		PF15979
(Glyco_hydro_115) 		4 GLN A 580
TYR A 634
TYR A 579
TYR A 524
 None
 1.27A 2ph9A-4zmhA:
undetectable
2ph9B-4zmhA:
undetectable		 2ph9A-4zmhA:
14.88
2ph9B-4zmhA:
14.88
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.
5a2a APO FORM OF
ANOXYBACILLUS
ALPHA-AMYLASES

(Anoxybacillus
ayderensis) 		PF00128
(Alpha-amylase) 		4 TYR A 286
TYR A 300
TYR A 335
ILE A 418
 None
 1.27A 2ph9A-5a2aA:
undetectable
2ph9B-5a2aA:
undetectable		 2ph9A-5a2aA:
18.93
2ph9B-5a2aA:
18.93
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.
5axi E3 UBIQUITIN-PROTEIN
LIGASE CBL-B

(Mus musculus) 		PF02262
(Cbl_N)
PF02761
(Cbl_N2)
PF02762
(Cbl_N3) 		4 GLN A  83
TYR A  82
TYR A 110
ILE A 111
 None
 1.08A 2ph9A-5axiA:
undetectable
2ph9B-5axiA:
undetectable		 2ph9A-5axiA:
24.21
2ph9B-5axiA:
24.21
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.
5chc DMSO REDUCTASE
FAMILY TYPE II
ENZYME,
MOLYBDOPTERIN
SUBUNIT

(Azospira oryzae) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding) 		4 TYR A 457
TRP A 191
GLN A 425
ILE A 197
 None
 1.34A 2ph9A-5chcA:
undetectable
2ph9B-5chcA:
undetectable		 2ph9A-5chcA:
13.11
2ph9B-5chcA:
13.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5cpc SECRETED EFFECTOR
PROTEIN SOPD

(Salmonella
enterica) 		PF11047
(SopD) 		4 GLN A 235
TYR A 234
TYR A 281
ILE A 218
 None
 1.32A 2ph9A-5cpcA:
undetectable
2ph9B-5cpcA:
undetectable		 2ph9A-5cpcA:
19.75
2ph9B-5cpcA:
19.75
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.
5gx8 EXTRACELLULAR
SOLUTE-BINDING
PROTEIN FAMILY 1

(Streptobacillus
moniliformis) 		PF13416
(SBP_bac_8) 		4 TRP A 329
TYR A 399
TYR A 344
ILE A  86
 None
 1.29A 2ph9A-5gx8A:
undetectable
2ph9B-5gx8A:
undetectable		 2ph9A-5gx8A:
20.48
2ph9B-5gx8A:
20.48
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.
5h64 SERINE/THREONINE-PRO
TEIN KINASE MTOR

(Homo sapiens) 		PF00454
(PI3_PI4_kinase)
PF02259
(FAT)
PF02260
(FATC)
PF08771
(FRB_dom)
PF11865
(DUF3385) 		4 GLN A1774
TYR A1775
TYR A1776
ILE A1764
 None
 1.34A 2ph9A-5h64A:
undetectable
2ph9B-5h64A:
undetectable		 2ph9A-5h64A:
6.22
2ph9B-5h64A:
6.22
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.
5hp6 EXTRACELLULAR
ARABINANASE

(Geobacillus
stearothermophilus) 		PF04616
(Glyco_hydro_43)
PF13385
(Laminin_G_3)
PF16369
(GH43_C) 		4 TYR A 290
TYR A 228
TYR A 253
ILE A 161
 None
 1.34A 2ph9A-5hp6A:
undetectable
2ph9B-5hp6A:
undetectable		 2ph9A-5hp6A:
13.33
2ph9B-5hp6A:
13.33
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.
5htk 6-PHOSPHOFRUCTO-2-KI
NASE/FRUCTOSE-2,6-BI
SPHOSPHATASE 2

(Homo sapiens) 		PF00300
(His_Phos_1)
PF01591
(6PF2K) 		4 TYR A 337
TYR A 412
TYR A 360
ILE A 327
 F6P  A 604 (-4.6A)
None
None
F6P  A 604 ( 4.4A)
 1.13A 2ph9A-5htkA:
undetectable
2ph9B-5htkA:
undetectable		 2ph9A-5htkA:
19.04
2ph9B-5htkA:
19.04
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.
5i2g DIOL DEHYDRATASE

(Roseburia
inulinivorans) 		PF01228
(Gly_radical)
PF02901
(PFL-like) 		4 GLN A 690
TYR A 689
TYR A 159
ILE A 514
 None
 1.02A 2ph9A-5i2gA:
undetectable
2ph9B-5i2gA:
undetectable		 2ph9A-5i2gA:
14.35
2ph9B-5i2gA:
14.35
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.
5kdx METALLOPEPTIDASE

(Pseudomonas
aeruginosa) 		PF13402
(Peptidase_M60) 		4 TYR A 497
GLN A 419
TYR A 522
ILE A 486
 None
 1.33A 2ph9A-5kdxA:
undetectable
2ph9B-5kdxA:
undetectable		 2ph9A-5kdxA:
12.54
2ph9B-5kdxA:
12.54
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.
5mw7 PROTEIN JAGGED-2

(Homo sapiens) 		PF00008
(EGF)
PF01414
(DSL)
PF07657
(MNNL) 		4 TYR A  90
TRP A 138
GLN A  79
ILE A 172
 None
 1.28A 2ph9A-5mw7A:
undetectable
2ph9B-5mw7A:
undetectable		 2ph9A-5mw7A:
19.65
2ph9B-5mw7A:
19.65
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.
5ndz LYSOZYME,PROTEINASE-
ACTIVATED RECEPTOR
2,SOLUBLE CYTOCHROME
B562,PROTEINASE-ACTI
VATED RECEPTOR 2

(Escherichia
coli;
Escherichia
virus T4;
Homo sapiens) 		PF00001
(7tm_1)
PF00959
(Phage_lysozyme)
PF07361
(Cytochrom_B562) 		4 GLN A 214
TYR A 210
TYR A 160
ILE A 202
 None
8UN  A2201 (-3.9A)
None
8UN  A2201 ( 4.6A)
 1.05A 2ph9A-5ndzA:
undetectable
2ph9B-5ndzA:
undetectable		 2ph9A-5ndzA:
16.19
2ph9B-5ndzA:
16.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ndz LYSOZYME,PROTEINASE-
ACTIVATED RECEPTOR
2,SOLUBLE CYTOCHROME
B562,PROTEINASE-ACTI
VATED RECEPTOR 2

(Escherichia
coli;
Escherichia
virus T4;
Homo sapiens) 		PF00001
(7tm_1)
PF00959
(Phage_lysozyme)
PF07361
(Cytochrom_B562) 		4 TYR A 242
GLN A 214
TYR A 160
ILE A 202
 None
None
None
8UN  A2201 ( 4.6A)
 1.21A 2ph9A-5ndzA:
undetectable
2ph9B-5ndzA:
undetectable		 2ph9A-5ndzA:
16.19
2ph9B-5ndzA:
16.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5nj6 PROTEINASE-ACTIVATED
RECEPTOR 2,SOLUBLE
CYTOCHROME
B562,PROTEINASE-ACTI
VATED RECEPTOR 2

(Escherichia
coli;
Homo sapiens) 		PF00001
(7tm_1)
PF07361
(Cytochrom_B562) 		4 TYR A 242
GLN A 214
TYR A 160
ILE A 202
 None
 1.25A 2ph9A-5nj6A:
undetectable
2ph9B-5nj6A:
undetectable		 2ph9A-5nj6A:
17.50
2ph9B-5nj6A:
17.50
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.
5olj DIPEPTIDYL PEPTIDASE
IV

(Porphyromonas
gingivalis) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		4 TRP A 191
GLN A 299
TYR A 277
TYR A 243
 None
 1.28A 2ph9A-5oljA:
undetectable
2ph9B-5oljA:
undetectable		 2ph9A-5oljA:
14.27
2ph9B-5oljA:
14.27
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.
5t1p ABC TRANSPORTER,
PERIPLASMIC
SUBSTRATE-BINDING
PROTEIN

(Campylobacter
jejuni) 		PF13343
(SBP_bac_6) 		4 GLN A 315
TYR A 316
TYR A 291
ILE A 306
 None
 1.21A 2ph9A-5t1pA:
undetectable
2ph9B-5t1pA:
undetectable		 2ph9A-5t1pA:
19.89
2ph9B-5t1pA:
19.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5tr0 SEED LINOLEATE
13S-LIPOXYGENASE-1

(Glycine max) 		no annotation 4 TYR A 698
GLN A 334
TYR A 293
ILE A 704
 None
 1.05A 2ph9A-5tr0A:
undetectable
2ph9B-5tr0A:
undetectable		 2ph9A-5tr0A:
15.44
2ph9B-5tr0A:
15.44
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.
5u02 GLYCOSYL TRANSFERASE

(Staphylococcus
aureus) 		no annotation 4 GLN A 323
TYR A 324
TYR A 383
ILE A 437
 None
 1.34A 2ph9A-5u02A:
undetectable
2ph9B-5u02A:
undetectable		 2ph9A-5u02A:
18.75
2ph9B-5u02A:
18.75
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.
5v38 HCHA

(Clostridium
botulinum) 		PF07951
(Toxin_R_bind_C)
PF07953
(Toxin_R_bind_N) 		4 GLN A 995
TYR A 993
TYR A 950
ILE A 952
 None
 1.28A 2ph9A-5v38A:
undetectable
2ph9B-5v38A:
undetectable		 2ph9A-5v38A:
18.12
2ph9B-5v38A:
18.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5vzj EXOSOME COMPLEX
EXONUCLEASE RRP6

(Saccharomyces
cerevisiae) 		PF00570
(HRDC)
PF01612
(DNA_pol_A_exo1) 		4 GLN J 345
TYR J 361
TYR J 344
ILE J 351
 A  M  17 ( 3.6A)
None
None
None
 1.34A 2ph9A-5vzjJ:
undetectable
2ph9B-5vzjJ:
undetectable		 2ph9A-5vzjJ:
16.99
2ph9B-5vzjJ:
16.99
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.
5x6a ENDOGLUCANASE,
PUTATIVE

(Aspergillus
fumigatus) 		no annotation 4 GLN A  21
TYR A  22
TYR A  13
ILE A   7
 None
 1.14A 2ph9A-5x6aA:
undetectable
2ph9B-5x6aA:
undetectable		 2ph9A-5x6aA:
16.74
2ph9B-5x6aA:
16.74
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5xgl SOLUBLE
ACETYLCHOLINE
RECEPTOR

(Aplysia
californica) 		no annotation 4 TRP A 145
GLN A 184
TYR A 186
TYR A 193
 None
 1.06A 2ph9A-5xglA:
31.0
2ph9B-5xglA:
31.2		 2ph9A-5xglA:
98.75
2ph9B-5xglA:
98.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5xgl SOLUBLE
ACETYLCHOLINE
RECEPTOR

(Aplysia
californica) 		no annotation 4 TYR A  91
TRP A 145
TYR A 186
TYR A 193
 None
 0.39A 2ph9A-5xglA:
31.0
2ph9B-5xglA:
31.2		 2ph9A-5xglA:
98.75
2ph9B-5xglA:
98.75
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.
5y3r DNA-DEPENDENT
PROTEIN KINASE
CATALYTIC SUBUNIT

(Homo sapiens) 		PF00454
(PI3_PI4_kinase)
PF02259
(FAT)
PF02260
(FATC)
PF08163
(NUC194) 		4 TYR C 408
GLN C 399
TYR C 366
ILE C 363
 None
 1.21A 2ph9A-5y3rC:
undetectable
2ph9B-5y3rC:
undetectable		 2ph9A-5y3rC:
4.74
2ph9B-5y3rC:
4.74
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.
5z06 BDI_3064 PROTEIN

(Parabacteroides
distasonis) 		no annotation 4 GLN A 249
TYR A 248
TYR A 261
ILE A 224
 None
 1.23A 2ph9A-5z06A:
undetectable
2ph9B-5z06A:
undetectable		 2ph9A-5z06A:
21.63
2ph9B-5z06A:
21.63
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.
5z06 BDI_3064 PROTEIN

(Parabacteroides
distasonis) 		no annotation 4 TYR A 573
TRP A 480
TYR A 504
TYR A 570
 None
 1.32A 2ph9A-5z06A:
undetectable
2ph9B-5z06A:
undetectable		 2ph9A-5z06A:
21.63
2ph9B-5z06A:
21.63
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.
6bwf -

(-) 		no annotation 4 TYR A 517
TYR A 524
TYR A 550
ILE A 586
 None
 1.26A 2ph9A-6bwfA:
undetectable
2ph9B-6bwfA:
undetectable		 2ph9A-6bwfA:
undetectable
2ph9B-6bwfA:
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.
6cv0 SPIKE GLYCOPROTEIN

(Avian
coronavirus) 		no annotation 4 TYR A 258
GLN A 410
TYR A 423
ILE A 426
 None
 1.21A 2ph9A-6cv0A:
undetectable
2ph9B-6cv0A:
undetectable		 2ph9A-6cv0A:
16.59
2ph9B-6cv0A:
16.59