SIMILAR PATTERNS OF AMINO ACIDS FOR 1AV2_D_DVAD6_0

List of similar pattern of amino acids derived from ASSAM search

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

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

(Trimeresurus
stejnegeri) 		PF00089
(Trypsin) 		3 TRP A 215
ALA A  55
VAL A  99
 None
None
0GJ  A   1 ( 4.2A)
 0.77A 1av2C-1bqyA:
undetectable
1av2D-1bqyA:
undetectable		 1av2C-1bqyA:
7.01
1av2D-1bqyA:
7.01
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.
1d6m DNA TOPOISOMERASE
III

(Escherichia
coli) 		PF01131
(Topoisom_bac)
PF01751
(Toprim) 		3 TRP A 240
ALA A 238
VAL A 224
 None
 0.76A 1av2C-1d6mA:
undetectable
1av2D-1d6mA:
undetectable		 1av2C-1d6mA:
3.41
1av2D-1d6mA:
3.41
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.
1hkt HEAT-SHOCK
TRANSCRIPTION FACTOR

(Drosophila
melanogaster) 		PF00447
(HSF_DNA-bind) 		3 TRP A  68
ALA A  60
VAL A  57
 None
 0.94A 1av2C-1hktA:
undetectable
1av2D-1hktA:
undetectable		 1av2C-1hktA:
17.02
1av2D-1hktA:
17.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1hzv NITRITE REDUCTASE

(Pseudomonas
aeruginosa) 		PF02239
(Cytochrom_D1)
PF13442
(Cytochrome_CBB3) 		3 TRP A 246
ALA A  48
VAL A  53
 None
 0.81A 1av2C-1hzvA:
undetectable
1av2D-1hzvA:
undetectable		 1av2C-1hzvA:
4.44
1av2D-1hzvA:
4.44
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.
1ile ISOLEUCYL-TRNA
SYNTHETASE

(Thermus
thermophilus) 		PF00133
(tRNA-synt_1)
PF08264
(Anticodon_1) 		3 TRP A 679
ALA A 797
VAL A 799
 None
 0.99A 1av2C-1ileA:
undetectable
1av2D-1ileA:
undetectable		 1av2C-1ileA:
1.97
1av2D-1ileA:
1.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1im8 YECO

(Haemophilus
influenzae) 		PF13649
(Methyltransf_25) 		3 TRP A 228
ALA A 239
VAL A 160
 None
 0.99A 1av2C-1im8A:
undetectable
1av2D-1im8A:
undetectable		 1av2C-1im8A:
4.82
1av2D-1im8A:
4.82
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.
1j5s URONATE ISOMERASE

(Thermotoga
maritima) 		PF02614
(UxaC) 		3 TRP A  44
ALA A  53
VAL A  50
 None
 0.93A 1av2C-1j5sA:
undetectable
1av2D-1j5sA:
undetectable		 1av2C-1j5sA:
5.24
1av2D-1j5sA:
5.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1kfw CHITINASE B

(Arthrobacter
sp. TAD20) 		PF00704
(Glyco_hydro_18) 		3 TRP A 378
ALA A 335
VAL A 338
 None
 0.85A 1av2C-1kfwA:
undetectable
1av2D-1kfwA:
undetectable		 1av2C-1kfwA:
3.19
1av2D-1kfwA:
3.19
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.
1odo PUTATIVE CYTOCHROME
P450 154A1

(Streptomyces
coelicolor) 		PF00067
(p450) 		3 TRP A  81
ALA A 184
VAL A 174
 PIM  A1408 (-4.6A)
None
None
 0.61A 1av2C-1odoA:
undetectable
1av2D-1odoA:
undetectable		 1av2C-1odoA:
14.86
1av2D-1odoA:
14.86
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.
1pgu ACTIN INTERACTING
PROTEIN 1

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		3 TRP A  95
ALA A  41
VAL A  57
 None
 0.96A 1av2C-1pguA:
undetectable
1av2D-1pguA:
undetectable		 1av2C-1pguA:
2.83
1av2D-1pguA:
2.83
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.
1ppr PERIDININ-CHLOROPHYL
L PROTEIN

(Amphidinium
carterae) 		PF02429
(PCP) 		3 TRP M 186
ALA M 238
VAL M 241
 PID  M 624 ( 3.6A)
None
PID  M 624 (-4.2A)
 0.94A 1av2C-1pprM:
undetectable
1av2D-1pprM:
undetectable		 1av2C-1pprM:
7.10
1av2D-1pprM:
7.10
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.
1qfc PROTEIN (PURPLE ACID
PHOSPHATASE)

(Rattus
norvegicus) 		PF00149
(Metallophos) 		3 TRP A  15
ALA A 241
VAL A  12
 None
 0.91A 1av2C-1qfcA:
undetectable
1av2D-1qfcA:
undetectable		 1av2C-1qfcA:
5.00
1av2D-1qfcA:
5.00
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.
1qhq PROTEIN (AURACYANIN)

(Chloroflexus
aurantiacus) 		PF00127
(Copper-bind) 		3 TRP A  59
ALA A  23
VAL A  21
 None
 0.82A 1av2C-1qhqA:
undetectable
1av2D-1qhqA:
undetectable		 1av2C-1qhqA:
6.43
1av2D-1qhqA:
6.43
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.
1to3 PUTATIVE ALDOLASE
YIHT

(Salmonella
enterica) 		PF01791
(DeoC) 		3 TRP A 256
ALA A 274
VAL A 255
 None
 0.93A 1av2C-1to3A:
undetectable
1av2D-1to3A:
undetectable		 1av2C-1to3A:
6.40
1av2D-1to3A:
6.40
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.
1u7g PROBABLE AMMONIUM
TRANSPORTER

(Escherichia
coli) 		PF00909
(Ammonium_transp) 		3 TRP A 365
ALA A 174
VAL A 369
 None
 0.82A 1av2C-1u7gA:
undetectable
1av2D-1u7gA:
undetectable		 1av2C-1u7gA:
5.19
1av2D-1u7gA:
5.19
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.
1up2 CELA1 PROTEIN

(Mycobacterium
tuberculosis) 		PF01341
(Glyco_hydro_6) 		3 TRP A 186
ALA A 137
VAL A 139
 None
 0.79A 1av2C-1up2A:
undetectable
1av2D-1up2A:
undetectable		 1av2C-1up2A:
6.25
1av2D-1up2A:
6.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wcg THIOGLUCOSIDASE

(Brevicoryne
brassicae) 		PF00232
(Glyco_hydro_1) 		3 TRP A 135
ALA A 181
VAL A 171
 None
 0.97A 1av2C-1wcgA:
undetectable
1av2D-1wcgA:
undetectable		 1av2C-1wcgA:
3.35
1av2D-1wcgA:
3.35
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.
1y43 ASPERGILLOPEPSIN II
HEAVY CHAIN

(Aspergillus
niger) 		PF01828
(Peptidase_A4) 		3 TRP B 107
ALA B   9
VAL B  11
 None
 0.57A 1av2C-1y43B:
undetectable
1av2D-1y43B:
undetectable		 1av2C-1y43B:
6.13
1av2D-1y43B:
6.13
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.
1z2i MALATE DEHYDROGENASE

(Agrobacterium
tumefaciens) 		PF02615
(Ldh_2) 		3 TRP A 180
ALA A 174
VAL A 172
 None
 0.96A 1av2C-1z2iA:
undetectable
1av2D-1z2iA:
undetectable		 1av2C-1z2iA:
4.05
1av2D-1z2iA:
4.05
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.
2a7w PHOSPHORIBOSYL-ATP
PYROPHOSPHATASE

(Chromobacterium
violaceum) 		PF01503
(PRA-PH) 		3 TRP A  68
ALA A  45
VAL A  64
 None
 0.68A 1av2C-2a7wA:
undetectable
1av2D-2a7wA:
undetectable		 1av2C-2a7wA:
8.04
1av2D-2a7wA:
8.04
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.
2btd PTS-DEPENDENT
DIHYDROXYACETONE
KINASE

(Escherichia
coli) 		PF02734
(Dak2) 		3 TRP A 134
ALA A 123
VAL A 117
 None
ADP  A1211 ( 4.4A)
None
 0.88A 1av2C-2btdA:
undetectable
1av2D-2btdA:
undetectable		 1av2C-2btdA:
7.52
1av2D-2btdA:
7.52
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.
2co6 PUTATIVE FIMBRIAE
ASSEMBLY CHAPERONE

(Salmonella
enterica) 		PF00345
(PapD_N)
PF02753
(PapD_C) 		3 TRP B 203
ALA B 168
VAL B 170
 None
 0.85A 1av2C-2co6B:
undetectable
1av2D-2co6B:
undetectable		 1av2C-2co6B:
8.05
1av2D-2co6B:
8.05
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.
2d3y URACIL-DNA
GLYCOSYLASE

(Thermus
thermophilus) 		PF03167
(UDG) 		3 TRP A  39
ALA A 116
VAL A  43
 None
 0.79A 1av2C-2d3yA:
undetectable
1av2D-2d3yA:
undetectable		 1av2C-2d3yA:
8.73
1av2D-2d3yA:
8.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2d4w GLYCEROL KINASE

(Cellulomonas
sp.) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		3 TRP A 102
ALA A  85
VAL A 101
 MPD  A   1 ( 3.9A)
None
None
 0.91A 1av2C-2d4wA:
undetectable
1av2D-2d4wA:
undetectable		 1av2C-2d4wA:
4.98
1av2D-2d4wA:
4.98
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.
2j7c BETA-GLUCOSIDASE A

(Thermotoga
maritima) 		PF00232
(Glyco_hydro_1) 		3 TRP A 134
ALA A 181
VAL A 170
 None
 0.95A 1av2C-2j7cA:
undetectable
1av2D-2j7cA:
undetectable		 1av2C-2j7cA:
2.35
1av2D-2j7cA:
2.35
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.
2nvn HYPOTHETICAL PROTEIN

(Synechococcus
elongatus) 		PF08848
(DUF1818) 		3 TRP A 103
ALA A 106
VAL A 108
 None
 0.96A 1av2C-2nvnA:
undetectable
1av2D-2nvnA:
undetectable		 1av2C-2nvnA:
10.48
1av2D-2nvnA:
10.48
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.
2vtc CEL61B

(Trichoderma
reesei) 		PF03443
(Glyco_hydro_61) 		3 TRP A 228
ALA A 226
VAL A 116
 None
 0.80A 1av2C-2vtcA:
undetectable
1av2D-2vtcA:
undetectable		 1av2C-2vtcA:
4.84
1av2D-2vtcA:
4.84
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.
2vx4 CELLVIBRIO JAPONICUS
MANNANASE CJMAN26C

(Cellvibrio
japonicus) 		PF02156
(Glyco_hydro_26) 		3 TRP A 243
ALA A 287
VAL A 289
 None
 0.90A 1av2C-2vx4A:
undetectable
1av2D-2vx4A:
undetectable		 1av2C-2vx4A:
2.86
1av2D-2vx4A:
2.86
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.
3axx 458AA LONG
HYPOTHETICAL
ENDO-1,4-BETA-GLUCAN
ASE

(Pyrococcus
horikoshii) 		PF00150
(Cellulase) 		3 TRP A 323
ALA A 271
VAL A 298
 None
 0.75A 1av2C-3axxA:
undetectable
1av2D-3axxA:
undetectable		 1av2C-3axxA:
3.23
1av2D-3axxA:
3.23
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.
3e2s PROLINE
DEHYDROGENASE

(Escherichia
coli) 		PF01619
(Pro_dh)
PF14850
(Pro_dh-DNA_bdg) 		3 TRP A 438
ALA A 405
VAL A 455
 FAD  A2001 (-3.6A)
None
None
 0.94A 1av2C-3e2sA:
undetectable
1av2D-3e2sA:
undetectable		 1av2C-3e2sA:
1.86
1av2D-3e2sA:
1.86
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.
3fld PROTEIN TRAI

(Escherichia
coli) 		PF07057
(TraI) 		3 TRP A1542
ALA A1569
VAL A1572
 None
 0.96A 1av2C-3fldA:
undetectable
1av2D-3fldA:
undetectable		 1av2C-3fldA:
6.67
1av2D-3fldA:
6.67
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.
3kl9 GLUTAMYL
AMINOPEPTIDASE

(Streptococcus
pneumoniae) 		PF05343
(Peptidase_M42) 		3 TRP A 180
ALA A 240
VAL A 312
 None
 0.95A 1av2C-3kl9A:
undetectable
1av2D-3kl9A:
undetectable		 1av2C-3kl9A:
3.49
1av2D-3kl9A:
3.49
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.
3l49 ABC SUGAR (RIBOSE)
TRANSPORTER,
PERIPLASMIC
SUBSTRATE-BINDING
SUBUNIT

(Rhodobacter
sphaeroides) 		PF13407
(Peripla_BP_4) 		3 TRP A 222
ALA A 220
VAL A 156
 None
 0.99A 1av2C-3l49A:
undetectable
1av2D-3l49A:
undetectable		 1av2C-3l49A:
10.11
1av2D-3l49A:
10.11
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.
3l8h PUTATIVE HALOACID
DEHALOGENASE-LIKE
HYDROLASE

(Bordetella
bronchiseptica) 		PF13242
(Hydrolase_like) 		3 TRP A 142
ALA A 134
VAL A 124
 None
 1.00A 1av2C-3l8hA:
undetectable
1av2D-3l8hA:
undetectable		 1av2C-3l8hA:
9.68
1av2D-3l8hA:
9.68
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.
3njb ENOYL-COA HYDRATASE

(Mycolicibacterium
smegmatis) 		PF00378
(ECH_1) 		3 TRP A 177
ALA A 281
VAL A 283
 None
 0.73A 1av2C-3njbA:
undetectable
1av2D-3njbA:
undetectable		 1av2C-3njbA:
6.80
1av2D-3njbA:
6.80
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.
3oft CYTOCHROME P450

(Novosphingobium
aromaticivorans) 		PF00067
(p450) 		3 TRP A  61
ALA A 342
VAL A 340
 HEM  A 417 (-4.1A)
None
None
 0.50A 1av2C-3oftA:
undetectable
1av2D-3oftA:
undetectable		 1av2C-3oftA:
19.64
1av2D-3oftA:
19.64
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.
3riq TAILSPIKE PROTEIN

(Salmonella
virus 9NA) 		PF09251
(PhageP22-tail) 		3 TRP A 457
ALA A 414
VAL A 412
 None
 0.93A 1av2C-3riqA:
undetectable
1av2D-3riqA:
undetectable		 1av2C-3riqA:
2.24
1av2D-3riqA:
2.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3s0m OXALATE
DECARBOXYLASE OXDC

(Bacillus
subtilis) 		PF00190
(Cupin_1) 		3 TRP A 102
ALA A 100
VAL A 154
 None
 0.88A 1av2C-3s0mA:
undetectable
1av2D-3s0mA:
undetectable		 1av2C-3s0mA:
4.42
1av2D-3s0mA:
4.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ut2 CATALASE-PEROXIDASE
2

(Magnaporthe
oryzae) 		PF00141
(peroxidase) 		3 TRP A 365
ALA A 418
VAL A 363
 None
 0.79A 1av2C-3ut2A:
undetectable
1av2D-3ut2A:
undetectable		 1av2C-3ut2A:
3.08
1av2D-3ut2A:
3.08
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.
3vcn MANNONATE
DEHYDRATASE

(Caulobacter
vibrioides) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 TRP A 269
ALA A 266
VAL A 268
 None
 0.94A 1av2C-3vcnA:
undetectable
1av2D-3vcnA:
undetectable		 1av2C-3vcnA:
5.02
1av2D-3vcnA:
5.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3w36 NAPH1

(Streptomyces
sp. CNQ525) 		no annotation 3 TRP A 146
ALA A 186
VAL A  98
 None
 0.99A 1av2C-3w36A:
undetectable
1av2D-3w36A:
undetectable		 1av2C-3w36A:
4.62
1av2D-3w36A:
4.62
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.
3w6m 458AA LONG
HYPOTHETICAL
ENDO-1,4-BETA-GLUCAN
ASE

(Pyrococcus
horikoshii) 		PF00150
(Cellulase) 		3 TRP A 323
ALA A 271
VAL A 298
 None
 0.74A 1av2C-3w6mA:
undetectable
1av2D-3w6mA:
undetectable		 1av2C-3w6mA:
3.53
1av2D-3w6mA:
3.53
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.
4akk NITRATE REGULATORY
PROTEIN

(Klebsiella
oxytoca) 		PF03861
(ANTAR)
PF08376
(NIT) 		3 TRP A  56
ALA A 125
VAL A 118
 None
 0.97A 1av2C-4akkA:
undetectable
1av2D-4akkA:
undetectable		 1av2C-4akkA:
3.24
1av2D-4akkA:
3.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4cs6 AMINOGLYCOSIDE
ADENYLTRANSFERASE

(Salmonella
enterica) 		PF01909
(NTP_transf_2)
PF13427
(DUF4111) 		3 TRP A 173
ALA A 177
VAL A 179
 None
 0.96A 1av2C-4cs6A:
undetectable
1av2D-4cs6A:
undetectable		 1av2C-4cs6A:
8.55
1av2D-4cs6A:
8.55
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.
4dcc PUTATIVE HALOACID
DEHALOGENASE-LIKE
HYDROLASE

(Bacteroides
thetaiotaomicron) 		PF13419
(HAD_2) 		3 TRP A 200
ALA A 196
VAL A  16
 None
 0.88A 1av2C-4dccA:
undetectable
1av2D-4dccA:
undetectable		 1av2C-4dccA:
5.63
1av2D-4dccA:
5.63
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.
4di1 ENOYL-COA HYDRATASE
ECHA17

(Mycobacterium
marinum) 		PF00378
(ECH_1) 		3 TRP A 192
ALA A  49
VAL A  98
 None
 0.80A 1av2C-4di1A:
undetectable
1av2D-4di1A:
undetectable		 1av2C-4di1A:
17.39
1av2D-4di1A:
17.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4epa PESTICIN RECEPTOR

(Yersinia pestis) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		3 TRP A 513
ALA A 468
VAL A 470
 None
 0.86A 1av2C-4epaA:
undetectable
1av2D-4epaA:
undetectable		 1av2C-4epaA:
2.15
1av2D-4epaA:
2.15
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.
4fcs VERSATILE PEROXIDASE
VPL2

(Pleurotus
eryngii) 		PF00141
(peroxidase)
PF11895
(Peroxidase_ext) 		3 TRP A 164
ALA A 167
VAL A 163
 None
 0.95A 1av2C-4fcsA:
undetectable
1av2D-4fcsA:
undetectable		 1av2C-4fcsA:
6.25
1av2D-4fcsA:
6.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ftd UNCHARACTERIZED
PROTEIN

(Bacteroides
eggerthii) 		PF15416
(DUF4623) 		3 TRP A 334
ALA A 362
VAL A 323
 None
 0.90A 1av2C-4ftdA:
undetectable
1av2D-4ftdA:
undetectable		 1av2C-4ftdA:
2.43
1av2D-4ftdA:
2.43
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.
4hi4 AEROTAXIS TRANSDUCER
AER2

(Pseudomonas
aeruginosa) 		PF13188
(PAS_8) 		3 TRP A 283
ALA A 184
VAL A 202
 None
 0.60A 1av2C-4hi4A:
undetectable
1av2D-4hi4A:
undetectable		 1av2C-4hi4A:
8.74
1av2D-4hi4A:
8.74
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) 		3 TRP A 237
ALA A 242
VAL A 244
 None
 0.93A 1av2C-4i59A:
undetectable
1av2D-4i59A:
undetectable		 1av2C-4i59A:
5.66
1av2D-4i59A:
5.66
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.
4i9r CELLULAR RETINOIC
ACID-BINDING PROTEIN
2

(Homo sapiens) 		PF00061
(Lipocalin) 		3 TRP A  32
ALA A  35
VAL A  33
 RET  A 201 (-4.5A)
None
None
 0.98A 1av2C-4i9rA:
undetectable
1av2D-4i9rA:
undetectable		 1av2C-4i9rA:
10.48
1av2D-4i9rA:
10.48
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.
4j0x RIBOSOMAL
RNA-PROCESSING
PROTEIN 9

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		3 TRP A 492
ALA A 559
VAL A 520
 None
 0.98A 1av2C-4j0xA:
undetectable
1av2D-4j0xA:
undetectable		 1av2C-4j0xA:
4.73
1av2D-4j0xA:
4.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4j4j DNA DC->DU-EDITING
ENZYME APOBEC-3F

(Homo sapiens) 		PF08210
(APOBEC_N) 		3 TRP A 277
ALA A 250
VAL A 242
 None
 0.86A 1av2C-4j4jA:
undetectable
1av2D-4j4jA:
undetectable		 1av2C-4j4jA:
5.67
1av2D-4j4jA:
5.67
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.
4m2j AMINOTRANSFERASE

(Streptomyces
lavendulae) 		PF00155
(Aminotran_1_2) 		3 TRP A 236
ALA A 239
VAL A  85
 None
 0.95A 1av2C-4m2jA:
undetectable
1av2D-4m2jA:
undetectable		 1av2C-4m2jA:
3.69
1av2D-4m2jA:
3.69
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.
4m7r ANAMORSIN

(Homo sapiens) 		PF08241
(Methyltransf_11) 		3 TRP A  40
ALA A  37
VAL A  68
 None
 0.98A 1av2C-4m7rA:
undetectable
1av2D-4m7rA:
undetectable		 1av2C-4m7rA:
9.91
1av2D-4m7rA:
9.91
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.
4mpt PUTATIVE
LEU/ILE/VAL-BINDING
PROTEIN

(Bordetella
pertussis) 		PF13458
(Peripla_BP_6) 		3 TRP A 285
ALA A 298
VAL A 301
 None
 0.90A 1av2C-4mptA:
undetectable
1av2D-4mptA:
undetectable		 1av2C-4mptA:
5.63
1av2D-4mptA:
5.63
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.
4nme PROLINE
DEHYDROGENASE AND
DELTA-1-PYRROLINE-5-
CARBOXYLATE
DEHYDROGENASE

(Geobacter
sulfurreducens) 		PF00171
(Aldedh)
PF01619
(Pro_dh) 		3 TRP A 310
ALA A 277
VAL A 326
 P5F  A1101 (-3.6A)
None
None
 0.84A 1av2C-4nmeA:
undetectable
1av2D-4nmeA:
undetectable		 1av2C-4nmeA:
2.23
1av2D-4nmeA:
2.23
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.
4o8a BIFUNCTIONAL PROTEIN
PUTA

(Escherichia
coli) 		PF01619
(Pro_dh)
PF14850
(Pro_dh-DNA_bdg) 		3 TRP A 438
ALA A 405
VAL A 455
 FAD  A2001 (-3.5A)
None
None
 0.93A 1av2C-4o8aA:
undetectable
1av2D-4o8aA:
undetectable		 1av2C-4o8aA:
3.02
1av2D-4o8aA:
3.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4og1 ENOYL-COA
HYDRATASE/ISOMERASE

(Novosphingobium
aromaticivorans) 		PF00378
(ECH_1) 		3 TRP A 103
ALA A 154
VAL A 125
 None
 0.96A 1av2C-4og1A:
undetectable
1av2D-4og1A:
undetectable		 1av2C-4og1A:
7.56
1av2D-4og1A:
7.56
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.
4ojz PUTATIVE ALGINATE
LYASE

(Saccharophagus
degradans) 		PF05426
(Alginate_lyase)
PF07940
(Hepar_II_III) 		3 TRP A  47
ALA A  41
VAL A 105
 None
 0.87A 1av2C-4ojzA:
undetectable
1av2D-4ojzA:
undetectable		 1av2C-4ojzA:
3.59
1av2D-4ojzA:
3.59
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.
4oqr CYP105AS1

(Amycolatopsis
orientalis) 		PF00067
(p450) 		3 TRP A  48
ALA A 290
VAL A 308
 None
 0.95A 1av2C-4oqrA:
undetectable
1av2D-4oqrA:
undetectable		 1av2C-4oqrA:
3.20
1av2D-4oqrA:
3.20
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.
4oqs CYP105AS1

(Amycolatopsis
orientalis) 		PF00067
(p450) 		3 TRP A  48
ALA A 290
VAL A 308
 None
 0.96A 1av2C-4oqsA:
undetectable
1av2D-4oqsA:
undetectable		 1av2C-4oqsA:
3.20
1av2D-4oqsA:
3.20
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.
4pvi GH62 HYDROLASE

(Mycothermus
thermophilus) 		PF03664
(Glyco_hydro_62) 		3 TRP A  34
ALA A 288
VAL A 290
 None
 0.76A 1av2C-4pviA:
undetectable
1av2D-4pviA:
undetectable		 1av2C-4pviA:
3.27
1av2D-4pviA:
3.27
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.
4q73 PROLINE
DEHYDROGENASE

(Bradyrhizobium
diazoefficiens) 		PF00171
(Aldedh)
PF01619
(Pro_dh)
PF14850
(Pro_dh-DNA_bdg) 		3 TRP A 346
ALA A 313
VAL A 363
 FAD  A2001 (-3.6A)
None
None
 0.91A 1av2C-4q73A:
undetectable
1av2D-4q73A:
undetectable		 1av2C-4q73A:
2.58
1av2D-4q73A:
2.58
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.
4q9b NOVEL ANTIGEN
RECEPTOR

(Ginglymostoma
cirratum) 		PF07654
(C1-set) 		3 TRP A 258
ALA A 263
VAL A 254
 None
 0.98A 1av2C-4q9bA:
undetectable
1av2D-4q9bA:
undetectable		 1av2C-4q9bA:
10.39
1av2D-4q9bA:
10.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qt9 PUTATIVE
GLUCOAMYLASE

(Bacteroides
caccae) 		PF10091
(Glycoamylase) 		3 TRP A 143
ALA A  75
VAL A  92
 None
 0.99A 1av2C-4qt9A:
undetectable
1av2D-4qt9A:
undetectable		 1av2C-4qt9A:
3.38
1av2D-4qt9A:
3.38
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.
4ruw ENDONUCLEASE/EXONUCL
EASE/PHOSPHATASE

(Beutenbergia
cavernae) 		PF03372
(Exo_endo_phos) 		3 TRP A 124
ALA A 195
VAL A 181
 None
 0.85A 1av2C-4ruwA:
undetectable
1av2D-4ruwA:
undetectable		 1av2C-4ruwA:
3.08
1av2D-4ruwA:
3.08
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.
4wt7 ABC TRANSPORTER
SUBSTRATE BINDING
PROTEIN (RIBOSE)

(Agrobacterium
vitis) 		PF13407
(Peripla_BP_4) 		3 TRP A 240
ALA A 238
VAL A 174
 None
 0.98A 1av2C-4wt7A:
undetectable
1av2D-4wt7A:
undetectable		 1av2C-4wt7A:
5.50
1av2D-4wt7A:
5.50
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.
4ymk ACYL-COA DESATURASE
1

(Mus musculus) 		PF00487
(FA_desaturase) 		3 TRP A 119
ALA A 203
VAL A 207
 None
 0.96A 1av2C-4ymkA:
undetectable
1av2D-4ymkA:
undetectable		 1av2C-4ymkA:
8.89
1av2D-4ymkA:
8.89
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.
4zyo ACYL-COA DESATURASE

(Homo sapiens) 		no annotation 3 TRP A 123
ALA A 207
VAL A 211
 None
 0.95A 1av2C-4zyoA:
undetectable
1av2D-4zyoA:
undetectable		 1av2C-4zyoA:
4.47
1av2D-4zyoA:
4.47
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.
5a7m BETA-XYLOSIDASE

(Trichoderma
reesei) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		3 TRP A 501
ALA A 578
VAL A 529
 None
 0.54A 1av2C-5a7mA:
undetectable
1av2D-5a7mA:
undetectable		 1av2C-5a7mA:
1.95
1av2D-5a7mA:
1.95
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.
5a8r METHYL-COENZYME M
REDUCTASE II SUBUNIT
ALPHA

(Methanothermobacter
marburgensis) 		PF02249
(MCR_alpha)
PF02745
(MCR_alpha_N) 		3 TRP A 229
ALA A 166
VAL A 213
 None
 0.79A 1av2C-5a8rA:
undetectable
1av2D-5a8rA:
undetectable		 1av2C-5a8rA:
4.08
1av2D-5a8rA:
4.08
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.
5afu DYNACTIN

(Sus scrofa) 		PF00022
(Actin) 		3 TRP J 387
ALA J 121
VAL J  95
 None
 0.84A 1av2C-5afuJ:
undetectable
1av2D-5afuJ:
undetectable		 1av2C-5afuJ:
2.93
1av2D-5afuJ:
2.93
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.
5cju ISOBUTYRYL-COA
MUTASE FUSED

(Cupriavidus
metallidurans) 		PF01642
(MM_CoA_mutase)
PF02310
(B12-binding)
PF03308
(ArgK) 		3 TRP A 368
ALA A 355
VAL A 391
 None
 0.86A 1av2C-5cjuA:
undetectable
1av2D-5cjuA:
undetectable		 1av2C-5cjuA:
2.13
1av2D-5cjuA:
2.13
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.
5dji 3'-PHOSPHOADENOSINE
5'-PHOSPHATE
PHOSPHATASE

(Mycobacterium
tuberculosis) 		PF00459
(Inositol_P) 		3 TRP A 114
ALA A 112
VAL A  87
 None
 0.94A 1av2C-5djiA:
undetectable
1av2D-5djiA:
undetectable		 1av2C-5djiA:
4.17
1av2D-5djiA:
4.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5e7l CONTACTIN-2

(Mus musculus) 		PF00041
(fn3) 		3 TRP A 835
ALA A 819
VAL A 821
 None
 0.88A 1av2C-5e7lA:
undetectable
1av2D-5e7lA:
undetectable		 1av2C-5e7lA:
10.67
1av2D-5e7lA:
10.67
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.
5ewn STRUCTURAL PROTEIN

(Mamastrovirus 1) 		PF03115
(Astro_capsid_N) 		3 TRP A 351
ALA A 376
VAL A 369
 None
 0.90A 1av2C-5ewnA:
undetectable
1av2D-5ewnA:
undetectable		 1av2C-5ewnA:
6.37
1av2D-5ewnA:
6.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fav CHOLINE
TRIMETHYLAMINE-LYASE

(Desulfovibrio
alaskensis) 		PF01228
(Gly_radical)
PF02901
(PFL-like) 		3 TRP A 314
ALA A 319
VAL A 301
 None
 0.98A 1av2C-5favA:
undetectable
1av2D-5favA:
undetectable		 1av2C-5favA:
1.58
1av2D-5favA:
1.58
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.
5g06 EXOSOME COMPLEX
COMPONENT RRP4

(Saccharomyces
cerevisiae) 		PF14382
(ECR1_N)
PF15985
(KH_6) 		3 TRP H 124
ALA H 117
VAL H 119
 None
 0.76A 1av2C-5g06H:
undetectable
1av2D-5g06H:
undetectable		 1av2C-5g06H:
4.71
1av2D-5g06H:
4.71
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.
5gn5 GLYCEROL KINASE

(Trypanosoma
brucei) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		3 TRP A 465
ALA A 473
VAL A 471
 None
 0.97A 1av2C-5gn5A:
undetectable
1av2D-5gn5A:
undetectable		 1av2C-5gn5A:
2.16
1av2D-5gn5A:
2.16
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.
5idi 1,4-BETA-D-GLUCAN
GLUCOHYDROLASE

(Thermotoga
neapolitana) 		PF00232
(Glyco_hydro_1) 		3 TRP A 132
ALA A 179
VAL A 168
 None
 0.98A 1av2C-5idiA:
undetectable
1av2D-5idiA:
undetectable		 1av2C-5idiA:
3.05
1av2D-5idiA:
3.05
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.
5kf7 BIFUNCTIONAL PROTEIN
PUTA

(Sinorhizobium
meliloti) 		PF00171
(Aldedh)
PF01619
(Pro_dh)
PF14850
(Pro_dh-DNA_bdg) 		3 TRP A 374
ALA A 341
VAL A 391
 FAD  A2001 (-3.6A)
None
None
 0.94A 1av2C-5kf7A:
undetectable
1av2D-5kf7A:
undetectable		 1av2C-5kf7A:
1.64
1av2D-5kf7A:
1.64
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.
5koh NITROGENASE FEMO
BETA SUBUNIT PROTEIN
NIFK

(Gluconacetobacter
diazotrophicus) 		PF00148
(Oxidored_nitro)
PF11844
(DUF3364) 		3 TRP B 473
ALA B 478
VAL B 472
 None
 0.69A 1av2C-5kohB:
undetectable
1av2D-5kohB:
undetectable		 1av2C-5kohB:
3.10
1av2D-5kohB:
3.10
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.
5lnl HSF

(Haemophilus
influenzae) 		PF15401
(TAA-Trp-ring) 		3 TRP A1691
ALA A1689
VAL A1708
 None
 0.75A 1av2C-5lnlA:
undetectable
1av2D-5lnlA:
undetectable		 1av2C-5lnlA:
11.84
1av2D-5lnlA:
11.84
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.
5lpe KALLIKREIN-10

(Homo sapiens) 		PF00089
(Trypsin) 		3 TRP A  29
ALA A  43
VAL A  45
 None
 0.90A 1av2C-5lpeA:
undetectable
1av2D-5lpeA:
undetectable		 1av2C-5lpeA:
11.25
1av2D-5lpeA:
11.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5lv9 THERMOPHILIC
TRYPTOPHAN
HALOGENASE

(Streptomyces
violaceusniger) 		PF04820
(Trp_halogenase) 		3 TRP A 284
ALA A 301
VAL A 299
 None
 0.94A 1av2C-5lv9A:
undetectable
1av2D-5lv9A:
undetectable		 1av2C-5lv9A:
4.63
1av2D-5lv9A:
4.63
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.
5n28 METHYL-COENZYME M
REDUCTASE SUBUNIT
ALPHA

(Methanotorris
formicicus) 		PF02249
(MCR_alpha)
PF02745
(MCR_alpha_N) 		3 TRP A 229
ALA A 166
VAL A 213
 None
 0.77A 1av2C-5n28A:
undetectable
1av2D-5n28A:
undetectable		 1av2C-5n28A:
2.32
1av2D-5n28A:
2.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ndx GLYCOSYL HYDROLASE

(Rhizobium
leguminosarum) 		no annotation 3 TRP A 116
ALA A 168
VAL A 120
 None
 0.90A 1av2C-5ndxA:
undetectable
1av2D-5ndxA:
undetectable		 1av2C-5ndxA:
undetectable
1av2D-5ndxA:
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.
5o82 INTRACELLULAR
EXO-ALPHA-(1->5)-L-A
RABINOFURANOSIDASE

(Chaetomium
thermophilum) 		no annotation 3 TRP A 224
ALA A 226
VAL A 228
 None
 0.97A 1av2C-5o82A:
undetectable
1av2D-5o82A:
undetectable		 1av2C-5o82A:
undetectable
1av2D-5o82A:
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.
5okz EXOSOME COMPLEX
COMPONENT RRP4

(Saccharomyces
cerevisiae) 		PF14382
(ECR1_N)
PF15985
(KH_6) 		3 TRP H 124
ALA H 117
VAL H 119
 None
 0.84A 1av2C-5okzH:
undetectable
1av2D-5okzH:
undetectable		 1av2C-5okzH:
5.08
1av2D-5okzH:
5.08
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.
5sv0 BIOPOLYMER TRANSPORT
PROTEIN EXBB

(Escherichia
coli) 		no annotation 3 TRP B 150
ALA B  19
VAL B  22
 None
 0.89A 1av2C-5sv0B:
undetectable
1av2D-5sv0B:
undetectable		 1av2C-5sv0B:
8.73
1av2D-5sv0B:
8.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5tkm DNA DC->DU-EDITING
ENZYME APOBEC-3B

(Homo sapiens) 		PF08210
(APOBEC_N) 		3 TRP A  94
ALA A  67
VAL A  59
 None
 0.76A 1av2C-5tkmA:
undetectable
1av2D-5tkmA:
undetectable		 1av2C-5tkmA:
6.54
1av2D-5tkmA:
6.54
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.
5uld TRANSPORTER, NADC
FAMILY

(Vibrio cholerae) 		PF00939
(Na_sulph_symp) 		3 TRP A  59
ALA A  63
VAL A  66
 None
 0.84A 1av2C-5uldA:
undetectable
1av2D-5uldA:
undetectable		 1av2C-5uldA:
2.97
1av2D-5uldA:
2.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ur2 BIFUNCTIONAL PROTEIN
PUTA

(Bdellovibrio
bacteriovorus) 		PF00171
(Aldedh)
PF01619
(Pro_dh) 		3 TRP A 305
ALA A 272
VAL A 321
 P5F  A1001 (-3.7A)
None
None
 0.91A 1av2C-5ur2A:
undetectable
1av2D-5ur2A:
undetectable		 1av2C-5ur2A:
2.82
1av2D-5ur2A:
2.82
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.
5van BETA-KLOTHO

(Homo sapiens) 		no annotation 3 TRP A 209
ALA A 256
VAL A 245
 None
 0.99A 1av2C-5vanA:
undetectable
1av2D-5vanA:
undetectable		 1av2C-5vanA:
undetectable
1av2D-5vanA:
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.
5vf4 UNCHARACTERIZED
PROTEIN

(Thermus
aquaticus) 		PF03781
(FGE-sulfatase) 		3 TRP A 201
ALA A  90
VAL A 373
 None
 0.73A 1av2C-5vf4A:
undetectable
1av2D-5vf4A:
undetectable		 1av2C-5vf4A:
6.06
1av2D-5vf4A:
6.06
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.
5xsx CHITINASE

(Thermococcus
chitonophagus) 		no annotation 3 TRP A 682
ALA A 646
VAL A 680
 None
 0.85A 1av2C-5xsxA:
undetectable
1av2D-5xsxA:
undetectable		 1av2C-5xsxA:
undetectable
1av2D-5xsxA:
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.
6d35 SMOOTHENED,SOLUBLE
CYTOCHROME
B562,SMOOTHENED

(Escherichia
coli;
Xenopus laevis) 		no annotation 3 TRP A 254
ALA A 249
VAL A 294
 None
 0.97A 1av2C-6d35A:
undetectable
1av2D-6d35A:
undetectable		 1av2C-6d35A:
undetectable
1av2D-6d35A:
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.
6ehs HYDROGENASE-2 LARGE
CHAIN

(Escherichia
coli) 		no annotation 3 TRP L 504
ALA L 550
VAL L 499
 None
CSO  L 546 ( 3.5A)
None
 0.99A 1av2C-6ehsL:
undetectable
1av2D-6ehsL:
undetectable		 1av2C-6ehsL:
undetectable
1av2D-6ehsL:
undetectable