SIMILAR PATTERNS OF AMINO ACIDS FOR 1W5U_B_DVAB6

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)
 0.76A 1w5uA-1bqyA:
undetectable
1w5uB-1bqyA:
undetectable		 1w5uA-1bqyA:
7.01
1w5uB-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
 0.90A 1w5uA-1d6mA:
undetectable
1w5uB-1d6mA:
undetectable		 1w5uA-1d6mA:
3.41
1w5uB-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.
1fon PROCARBOXYPEPTIDASE
A-S6

(Bos taurus) 		PF00089
(Trypsin) 		3 TRP A  12
ALA A 112
VAL A 109
 None
 0.97A 1w5uA-1fonA:
undetectable
1w5uB-1fonA:
undetectable		 1w5uA-1fonA:
6.10
1w5uB-1fonA:
6.10
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.
1hkt HEAT-SHOCK
TRANSCRIPTION FACTOR

(Drosophila
melanogaster) 		PF00447
(HSF_DNA-bind) 		3 TRP A  68
ALA A  60
VAL A  57
 None
 0.97A 1w5uA-1hktA:
undetectable
1w5uB-1hktA:
undetectable		 1w5uA-1hktA:
17.02
1w5uB-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
 0.91A 1w5uA-1hzvA:
undetectable
1w5uB-1hzvA:
undetectable		 1w5uA-1hzvA:
4.44
1w5uB-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
 1.00A 1w5uA-1ileA:
undetectable
1w5uB-1ileA:
undetectable		 1w5uA-1ileA:
1.97
1w5uB-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.
1j5s URONATE ISOMERASE

(Thermotoga
maritima) 		PF02614
(UxaC) 		3 TRP A  44
ALA A  53
VAL A  50
 None
 0.97A 1w5uA-1j5sA:
undetectable
1w5uB-1j5sA:
undetectable		 1w5uA-1j5sA:
5.24
1w5uB-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 1w5uA-1kfwA:
undetectable
1w5uB-1kfwA:
undetectable		 1w5uA-1kfwA:
3.19
1w5uB-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.
1l1l RIBONUCLEOSIDE
TRIPHOSPHATE
REDUCTASE

(Lactobacillus
leichmannii) 		PF02867
(Ribonuc_red_lgC) 		3 TRP A 120
ALA A 321
VAL A 163
 None
 0.96A 1w5uA-1l1lA:
undetectable
1w5uB-1l1lA:
undetectable		 1w5uA-1l1lA:
2.70
1w5uB-1l1lA:
2.70
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.
1l1l RIBONUCLEOSIDE
TRIPHOSPHATE
REDUCTASE

(Lactobacillus
leichmannii) 		PF02867
(Ribonuc_red_lgC) 		3 TRP A 642
ALA A 646
VAL A 547
 None
 0.92A 1w5uA-1l1lA:
undetectable
1w5uB-1l1lA:
undetectable		 1w5uA-1l1lA:
2.70
1w5uB-1l1lA:
2.70
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.
1n7u ADSORPTION PROTEIN
P2

(Salmonella
virus PRD1) 		PF09214
(Prd1-P2) 		3 TRP A 501
ALA A 499
VAL A   6
 None
 0.99A 1w5uA-1n7uA:
undetectable
1w5uB-1n7uA:
undetectable		 1w5uA-1n7uA:
2.71
1w5uB-1n7uA:
2.71
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.
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
 0.74A 1w5uA-1odoA:
undetectable
1w5uB-1odoA:
undetectable		 1w5uA-1odoA:
14.86
1w5uB-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.
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)
 0.90A 1w5uA-1pprM:
undetectable
1w5uB-1pprM:
undetectable		 1w5uA-1pprM:
7.10
1w5uB-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
 0.90A 1w5uA-1qfcA:
undetectable
1w5uB-1qfcA:
undetectable		 1w5uA-1qfcA:
5.00
1w5uB-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
 0.85A 1w5uA-1qhqA:
undetectable
1w5uB-1qhqA:
undetectable		 1w5uA-1qhqA:
6.43
1w5uB-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.
1rbl RIBULOSE 1,5
BISPHOSPHATE
CARBOXYLASE/OXYGENAS
E (LARGE CHAIN)

(Synechococcus
elongatus) 		PF00016
(RuBisCO_large)
PF02788
(RuBisCO_large_N) 		3 TRP A  70
ALA A  15
VAL A  69
 None
 0.90A 1w5uA-1rblA:
undetectable
1w5uB-1rblA:
undetectable		 1w5uA-1rblA:
4.08
1w5uB-1rblA:
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.
1to3 PUTATIVE ALDOLASE
YIHT

(Salmonella
enterica) 		PF01791
(DeoC) 		3 TRP A 256
ALA A 274
VAL A 255
 None
 0.86A 1w5uA-1to3A:
undetectable
1w5uB-1to3A:
undetectable		 1w5uA-1to3A:
6.40
1w5uB-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.
1u5w HYPOTHETICAL UPF0244
PROTEIN YJJX

(Escherichia
coli) 		PF01931
(NTPase_I-T) 		3 TRP A  75
ALA A  77
VAL A   8
 None
 0.92A 1w5uA-1u5wA:
undetectable
1w5uB-1u5wA:
undetectable		 1w5uA-1u5wA:
6.18
1w5uB-1u5wA:
6.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1u7g PROBABLE AMMONIUM
TRANSPORTER

(Escherichia
coli) 		PF00909
(Ammonium_transp) 		3 TRP A 365
ALA A 174
VAL A 369
 None
 0.83A 1w5uA-1u7gA:
undetectable
1w5uB-1u7gA:
undetectable		 1w5uA-1u7gA:
5.19
1w5uB-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
 0.88A 1w5uA-1up2A:
undetectable
1w5uB-1up2A:
undetectable		 1w5uA-1up2A:
6.25
1w5uB-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.
1y43 ASPERGILLOPEPSIN II
HEAVY CHAIN

(Aspergillus
niger) 		PF01828
(Peptidase_A4) 		3 TRP B 107
ALA B   9
VAL B  11
 None
 0.47A 1w5uA-1y43B:
undetectable
1w5uB-1y43B:
undetectable		 1w5uA-1y43B:
6.13
1w5uB-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.
2a7w PHOSPHORIBOSYL-ATP
PYROPHOSPHATASE

(Chromobacterium
violaceum) 		PF01503
(PRA-PH) 		3 TRP A  68
ALA A  45
VAL A  64
 None
 0.75A 1w5uA-2a7wA:
undetectable
1w5uB-2a7wA:
undetectable		 1w5uA-2a7wA:
8.04
1w5uB-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
 0.92A 1w5uA-2btdA:
undetectable
1w5uB-2btdA:
undetectable		 1w5uA-2btdA:
7.52
1w5uB-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.
2cwf DELTA1-PIPERIDEINE-2
-CARBOXYLATE
REDUCTASE

(Pseudomonas
syringae group
genomosp. 3) 		PF02615
(Ldh_2) 		3 TRP A  70
ALA A  67
VAL A  71
 None
 0.92A 1w5uA-2cwfA:
undetectable
1w5uB-2cwfA:
undetectable		 1w5uA-2cwfA:
6.22
1w5uB-2cwfA:
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.
2d3y URACIL-DNA
GLYCOSYLASE

(Thermus
thermophilus) 		PF03167
(UDG) 		3 TRP A  39
ALA A 116
VAL A  43
 None
 0.76A 1w5uA-2d3yA:
undetectable
1w5uB-2d3yA:
undetectable		 1w5uA-2d3yA:
8.73
1w5uB-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
 0.88A 1w5uA-2d4wA:
undetectable
1w5uB-2d4wA:
undetectable		 1w5uA-2d4wA:
4.98
1w5uB-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.
2ffi 2-PYRONE-4,6-DICARBO
XYLIC ACID
HYDROLASE, PUTATIVE

(Pseudomonas
putida) 		PF04909
(Amidohydro_2) 		3 TRP A 233
ALA A 215
VAL A 198
 None
 0.97A 1w5uA-2ffiA:
undetectable
1w5uB-2ffiA:
undetectable		 1w5uA-2ffiA:
5.68
1w5uB-2ffiA:
5.68
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.
2lpu KMATG10

(Kluyveromyces
marxianus) 		PF03987
(Autophagy_act_C) 		3 TRP A 133
ALA A 120
VAL A 122
 None
 1.00A 1w5uA-2lpuA:
undetectable
1w5uB-2lpuA:
undetectable		 1w5uA-2lpuA:
8.26
1w5uB-2lpuA:
8.26
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.
2wk8 CAI-1 AUTOINDUCER
SYNTHASE

(Vibrio cholerae) 		PF00155
(Aminotran_1_2) 		3 TRP A 109
ALA A 111
VAL A 113
 None
 0.99A 1w5uA-2wk8A:
undetectable
1w5uB-2wk8A:
undetectable		 1w5uA-2wk8A:
5.56
1w5uB-2wk8A:
5.56
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.
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
 0.78A 1w5uA-3axxA:
undetectable
1w5uB-3axxA:
undetectable		 1w5uA-3axxA:
3.23
1w5uB-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
 0.84A 1w5uA-3e2sA:
undetectable
1w5uB-3e2sA:
undetectable		 1w5uA-3e2sA:
1.86
1w5uB-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.
3fsc QDTC

(Thermoanaerobacterium
thermosaccharolyticum) 		PF00132
(Hexapep) 		3 TRP A 239
ALA A 195
VAL A 178
 None
 0.98A 1w5uA-3fscA:
undetectable
1w5uB-3fscA:
undetectable		 1w5uA-3fscA:
13.89
1w5uB-3fscA:
13.89
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.
3i2t EPIDERMAL GROWTH
FACTOR RECEPTOR,
ISOFORM A

(Drosophila
melanogaster) 		PF00757
(Furin-like)
PF01030
(Recep_L_domain)
PF14843
(GF_recep_IV) 		3 TRP A 457
ALA A 405
VAL A 430
 None
 0.91A 1w5uA-3i2tA:
undetectable
1w5uB-3i2tA:
undetectable		 1w5uA-3i2tA:
3.28
1w5uB-3i2tA:
3.28
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.
3njb ENOYL-COA HYDRATASE

(Mycolicibacterium
smegmatis) 		PF00378
(ECH_1) 		3 TRP A 177
ALA A 281
VAL A 283
 None
 0.84A 1w5uA-3njbA:
undetectable
1w5uB-3njbA:
undetectable		 1w5uA-3njbA:
6.80
1w5uB-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
 0.46A 1w5uA-3oftA:
undetectable
1w5uB-3oftA:
undetectable		 1w5uA-3oftA:
19.64
1w5uB-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.
3oq3 INTERFERON ALPHA-5

(Mus musculus) 		PF00143
(Interferon) 		3 TRP A 149
ALA A  14
VAL A  19
 None
 0.97A 1w5uA-3oq3A:
undetectable
1w5uB-3oq3A:
undetectable		 1w5uA-3oq3A:
9.02
1w5uB-3oq3A:
9.02
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.
3usc HYDROGENASE-1 LARGE
CHAIN

(Escherichia
coli) 		PF00374
(NiFeSe_Hases) 		3 TRP L 515
ALA L 517
VAL L 502
 None
 0.93A 1w5uA-3uscL:
undetectable
1w5uB-3uscL:
undetectable		 1w5uA-3uscL:
5.26
1w5uB-3uscL:
5.26
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.
3ut2 CATALASE-PEROXIDASE
2

(Magnaporthe
oryzae) 		PF00141
(peroxidase) 		3 TRP A 365
ALA A 418
VAL A 363
 None
 0.87A 1w5uA-3ut2A:
undetectable
1w5uB-3ut2A:
undetectable		 1w5uA-3ut2A:
3.08
1w5uB-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.
3w36 NAPH1

(Streptomyces
sp. CNQ525) 		no annotation 3 TRP A 146
ALA A 186
VAL A  98
 None
 0.96A 1w5uA-3w36A:
undetectable
1w5uB-3w36A:
undetectable		 1w5uA-3w36A:
4.62
1w5uB-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
 0.77A 1w5uA-3w6mA:
undetectable
1w5uB-3w6mA:
undetectable		 1w5uA-3w6mA:
3.53
1w5uB-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.
3wwe OXIDIZED POLYVINYL
ALCOHOL HYDROLASE

(Pseudomonas sp.
VM15C) 		no annotation 3 TRP A  60
ALA A  50
VAL A  92
 None
 0.98A 1w5uA-3wweA:
undetectable
1w5uB-3wweA:
undetectable		 1w5uA-3wweA:
4.60
1w5uB-3wweA:
4.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4akk NITRATE REGULATORY
PROTEIN

(Klebsiella
oxytoca) 		PF03861
(ANTAR)
PF08376
(NIT) 		3 TRP A  56
ALA A 124
VAL A 118
 None
 0.95A 1w5uA-4akkA:
undetectable
1w5uB-4akkA:
undetectable		 1w5uA-4akkA:
3.24
1w5uB-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.
4akk NITRATE REGULATORY
PROTEIN

(Klebsiella
oxytoca) 		PF03861
(ANTAR)
PF08376
(NIT) 		3 TRP A  56
ALA A 125
VAL A 118
 None
 0.86A 1w5uA-4akkA:
undetectable
1w5uB-4akkA:
undetectable		 1w5uA-4akkA:
3.24
1w5uB-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
 0.99A 1w5uA-4cs6A:
undetectable
1w5uB-4cs6A:
undetectable		 1w5uA-4cs6A:
8.55
1w5uB-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
 0.97A 1w5uA-4dccA:
undetectable
1w5uB-4dccA:
undetectable		 1w5uA-4dccA:
5.63
1w5uB-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
 0.86A 1w5uA-4di1A:
undetectable
1w5uB-4di1A:
undetectable		 1w5uA-4di1A:
17.39
1w5uB-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.
4eb0 LCC

(uncultured
bacterium) 		PF12695
(Abhydrolase_5) 		3 TRP A 259
ALA A 160
VAL A 185
 None
 1.00A 1w5uA-4eb0A:
undetectable
1w5uB-4eb0A:
undetectable		 1w5uA-4eb0A:
16.67
1w5uB-4eb0A:
16.67
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.
4epa PESTICIN RECEPTOR

(Yersinia pestis) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		3 TRP A 513
ALA A 468
VAL A 470
 None
 0.81A 1w5uA-4epaA:
undetectable
1w5uB-4epaA:
undetectable		 1w5uA-4epaA:
2.15
1w5uB-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.
4fom POLIOVIRUS
RECEPTOR-RELATED
PROTEIN 3

(Homo sapiens) 		PF07686
(V-set)
PF08205
(C2-set_2) 		3 TRP A  70
ALA A  68
VAL A 168
 NAG  A 415 ( 4.1A)
None
NAG  A 415 ( 4.6A)
 0.93A 1w5uA-4fomA:
undetectable
1w5uB-4fomA:
undetectable		 1w5uA-4fomA:
4.86
1w5uB-4fomA:
4.86
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.
4ftd UNCHARACTERIZED
PROTEIN

(Bacteroides
eggerthii) 		PF15416
(DUF4623) 		3 TRP A 334
ALA A 362
VAL A 323
 None
 0.87A 1w5uA-4ftdA:
undetectable
1w5uB-4ftdA:
undetectable		 1w5uA-4ftdA:
2.43
1w5uB-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
 0.58A 1w5uA-4hi4A:
undetectable
1w5uB-4hi4A:
undetectable		 1w5uA-4hi4A:
8.74
1w5uB-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.
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
 0.93A 1w5uA-4i9rA:
undetectable
1w5uB-4i9rA:
undetectable		 1w5uA-4i9rA:
10.48
1w5uB-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.
4j4j DNA DC->DU-EDITING
ENZYME APOBEC-3F

(Homo sapiens) 		PF08210
(APOBEC_N) 		3 TRP A 277
ALA A 250
VAL A 242
 None
 0.83A 1w5uA-4j4jA:
undetectable
1w5uB-4j4jA:
undetectable		 1w5uA-4j4jA:
5.67
1w5uB-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.
4jpq UNCHARACTERIZED
PROTEIN

(Bacteroides
uniformis) 		PF16011
(CBM9_2) 		3 TRP A 185
ALA A 101
VAL A 103
 None
 0.94A 1w5uA-4jpqA:
undetectable
1w5uB-4jpqA:
undetectable		 1w5uA-4jpqA:
8.11
1w5uB-4jpqA:
8.11
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.
4m2j AMINOTRANSFERASE

(Streptomyces
lavendulae) 		PF00155
(Aminotran_1_2) 		3 TRP A 236
ALA A 239
VAL A  85
 None
 0.97A 1w5uA-4m2jA:
undetectable
1w5uB-4m2jA:
undetectable		 1w5uA-4m2jA:
3.69
1w5uB-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
 0.93A 1w5uA-4m7rA:
undetectable
1w5uB-4m7rA:
undetectable		 1w5uA-4m7rA:
9.91
1w5uB-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.
4mkv RIBULOSE
BISPHOSPHATE
CARBOXYLASE LARGE
CHAIN

(Pisum sativum) 		PF00016
(RuBisCO_large)
PF02788
(RuBisCO_large_N) 		3 TRP A  70
ALA A  15
VAL A  69
 None
 0.85A 1w5uA-4mkvA:
undetectable
1w5uB-4mkvA:
undetectable		 1w5uA-4mkvA:
3.79
1w5uB-4mkvA:
3.79
Potential target for repurposing, i.e. matched protein structure has less than 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
 0.94A 1w5uA-4mptA:
undetectable
1w5uB-4mptA:
undetectable		 1w5uA-4mptA:
5.63
1w5uB-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
 0.76A 1w5uA-4nmeA:
undetectable
1w5uB-4nmeA:
undetectable		 1w5uA-4nmeA:
2.23
1w5uB-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
 0.82A 1w5uA-4o8aA:
undetectable
1w5uB-4o8aA:
undetectable		 1w5uA-4o8aA:
3.02
1w5uB-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
 0.93A 1w5uA-4og1A:
undetectable
1w5uB-4og1A:
undetectable		 1w5uA-4og1A:
7.56
1w5uB-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
 0.94A 1w5uA-4ojzA:
undetectable
1w5uB-4ojzA:
undetectable		 1w5uA-4ojzA:
3.59
1w5uB-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
 0.93A 1w5uA-4oqrA:
undetectable
1w5uB-4oqrA:
undetectable		 1w5uA-4oqrA:
3.20
1w5uB-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
 0.93A 1w5uA-4oqsA:
undetectable
1w5uB-4oqsA:
undetectable		 1w5uA-4oqsA:
3.20
1w5uB-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
 0.74A 1w5uA-4pviA:
undetectable
1w5uB-4pviA:
undetectable		 1w5uA-4pviA:
3.27
1w5uB-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
 0.82A 1w5uA-4q73A:
undetectable
1w5uB-4q73A:
undetectable		 1w5uA-4q73A:
2.58
1w5uB-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
 0.97A 1w5uA-4q9bA:
undetectable
1w5uB-4q9bA:
undetectable		 1w5uA-4q9bA:
10.39
1w5uB-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.
4r12 PUTATIVE
UNCHARACTERIZED
PROTEIN

(Dictyostelium
purpureum) 		PF05450
(Nicastrin) 		3 TRP A 291
ALA A 566
VAL A 213
 None
 0.95A 1w5uA-4r12A:
undetectable
1w5uB-4r12A:
undetectable		 1w5uA-4r12A:
2.43
1w5uB-4r12A:
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.
4tz5 PUTATIVE SECRETED
PROTEIN

(Streptomyces
sp. SirexAA-E) 		no annotation 3 TRP A 170
ALA A 190
VAL A 172
 None
 0.98A 1w5uA-4tz5A:
undetectable
1w5uB-4tz5A:
undetectable		 1w5uA-4tz5A:
3.34
1w5uB-4tz5A:
3.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zyo ACYL-COA DESATURASE

(Homo sapiens) 		no annotation 3 TRP A 123
ALA A 207
VAL A 211
 None
 1.00A 1w5uA-4zyoA:
undetectable
1w5uB-4zyoA:
undetectable		 1w5uA-4zyoA:
4.47
1w5uB-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
 0.63A 1w5uA-5a7mA:
undetectable
1w5uB-5a7mA:
undetectable		 1w5uA-5a7mA:
1.95
1w5uB-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
 0.72A 1w5uA-5a8rA:
undetectable
1w5uB-5a8rA:
undetectable		 1w5uA-5a8rA:
4.08
1w5uB-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.
5aca VP1

(Foot-and-mouth
disease virus) 		PF00073
(Rhv) 		3 TRP 1  89
ALA 1  50
VAL 1 173
 None
 0.96A 1w5uA-5aca1:
undetectable
1w5uB-5aca1:
undetectable		 1w5uA-5aca1:
10.61
1w5uB-5aca1:
10.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5afu DYNACTIN

(Sus scrofa) 		PF00022
(Actin) 		3 TRP J 387
ALA J 121
VAL J  95
 None
 0.98A 1w5uA-5afuJ:
undetectable
1w5uB-5afuJ:
undetectable		 1w5uA-5afuJ:
2.93
1w5uB-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
 0.85A 1w5uA-5cjuA:
undetectable
1w5uB-5cjuA:
undetectable		 1w5uA-5cjuA:
2.13
1w5uB-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.
5clw 1,4-ALPHA-GLUCAN-BRA
NCHING ENZYME

(Homo sapiens) 		PF00128
(Alpha-amylase)
PF02806
(Alpha-amylase_C)
PF02922
(CBM_48) 		3 TRP A 548
ALA A 483
VAL A 485
 None
 0.95A 1w5uA-5clwA:
undetectable
1w5uB-5clwA:
undetectable		 1w5uA-5clwA:
2.52
1w5uB-5clwA:
2.52
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.
5e7l CONTACTIN-2

(Mus musculus) 		PF00041
(fn3) 		3 TRP A 835
ALA A 819
VAL A 821
 None
 1.00A 1w5uA-5e7lA:
undetectable
1w5uB-5e7lA:
undetectable		 1w5uA-5e7lA:
10.67
1w5uB-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.
5ebb ACID
SPHINGOMYELINASE-LIK
E PHOSPHODIESTERASE
3A

(Homo sapiens) 		PF00149
(Metallophos) 		3 TRP A 107
ALA A 318
VAL A  43
 None
 0.99A 1w5uA-5ebbA:
undetectable
1w5uB-5ebbA:
undetectable		 1w5uA-5ebbA:
3.98
1w5uB-5ebbA:
3.98
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.
5ewn STRUCTURAL PROTEIN

(Mamastrovirus 1) 		PF03115
(Astro_capsid_N) 		3 TRP A 351
ALA A 376
VAL A 369
 None
 0.87A 1w5uA-5ewnA:
undetectable
1w5uB-5ewnA:
undetectable		 1w5uA-5ewnA:
6.37
1w5uB-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.
5fca ACID
SPHINGOMYELINASE-LIK
E PHOSPHODIESTERASE
3A

(Mus musculus) 		PF00149
(Metallophos) 		3 TRP A 104
ALA A 315
VAL A  40
 None
 1.00A 1w5uA-5fcaA:
undetectable
1w5uB-5fcaA:
undetectable		 1w5uA-5fcaA:
5.50
1w5uB-5fcaA:
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.
5g06 EXOSOME COMPLEX
COMPONENT RRP4

(Saccharomyces
cerevisiae) 		PF14382
(ECR1_N)
PF15985
(KH_6) 		3 TRP H 124
ALA H 117
VAL H 119
 None
 0.71A 1w5uA-5g06H:
undetectable
1w5uB-5g06H:
undetectable		 1w5uA-5g06H:
4.71
1w5uB-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.
5gzh ENDO-BETA-1,2-GLUCAN
ASE

(Chitinophaga
pinensis) 		PF10091
(Glycoamylase) 		3 TRP A 120
ALA A  52
VAL A  69
 None
None
IOD  A 506 ( 4.7A)
 1.00A 1w5uA-5gzhA:
undetectable
1w5uB-5gzhA:
undetectable		 1w5uA-5gzhA:
3.11
1w5uB-5gzhA:
3.11
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.
5ibv CAPSID POLYPROTEIN
VP90

(Mamastrovirus 1) 		PF03115
(Astro_capsid_N) 		3 TRP A 351
ALA A 376
VAL A 369
 None
 0.97A 1w5uA-5ibvA:
undetectable
1w5uB-5ibvA:
undetectable		 1w5uA-5ibvA:
6.86
1w5uB-5ibvA:
6.86
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.
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
 0.83A 1w5uA-5kf7A:
undetectable
1w5uB-5kf7A:
undetectable		 1w5uA-5kf7A:
1.64
1w5uB-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
 0.64A 1w5uA-5kohB:
undetectable
1w5uB-5kohB:
undetectable		 1w5uA-5kohB:
3.10
1w5uB-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.
5lpe KALLIKREIN-10

(Homo sapiens) 		PF00089
(Trypsin) 		3 TRP A  29
ALA A  43
VAL A  45
 None
 0.84A 1w5uA-5lpeA:
undetectable
1w5uB-5lpeA:
undetectable		 1w5uA-5lpeA:
11.25
1w5uB-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.
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
 0.69A 1w5uA-5n28A:
undetectable
1w5uB-5n28A:
undetectable		 1w5uA-5n28A:
2.32
1w5uB-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
 0.97A 1w5uA-5ndxA:
undetectable
1w5uB-5ndxA:
undetectable		 1w5uA-5ndxA:
undetectable
1w5uB-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.
5o7g ALPHA/BETA HYDROLASE
FAMILY PROTEIN

(Bacillus
coagulans) 		no annotation 3 TRP A  80
ALA A  71
VAL A  65
 None
 0.94A 1w5uA-5o7gA:
undetectable
1w5uB-5o7gA:
undetectable		 1w5uA-5o7gA:
undetectable
1w5uB-5o7gA:
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 1w5uA-5o82A:
undetectable
1w5uB-5o82A:
undetectable		 1w5uA-5o82A:
undetectable
1w5uB-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
 0.78A 1w5uA-5okzH:
undetectable
1w5uB-5okzH:
undetectable		 1w5uA-5okzH:
5.08
1w5uB-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
 0.92A 1w5uA-5sv0B:
undetectable
1w5uB-5sv0B:
undetectable		 1w5uA-5sv0B:
8.73
1w5uB-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
 0.80A 1w5uA-5tkmA:
undetectable
1w5uB-5tkmA:
undetectable		 1w5uA-5tkmA:
6.54
1w5uB-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.
5ui3 DIHYDRODIPICOLINATE
SYNTHASE

(Chlamydomonas
reinhardtii) 		no annotation 3 TRP D 201
ALA D 211
VAL D 218
 None
 0.99A 1w5uA-5ui3D:
undetectable
1w5uB-5ui3D:
undetectable		 1w5uA-5ui3D:
undetectable
1w5uB-5ui3D:
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.
5uld TRANSPORTER, NADC
FAMILY

(Vibrio cholerae) 		PF00939
(Na_sulph_symp) 		3 TRP A  59
ALA A  63
VAL A  66
 None
 0.71A 1w5uA-5uldA:
undetectable
1w5uB-5uldA:
undetectable		 1w5uA-5uldA:
2.97
1w5uB-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
 0.84A 1w5uA-5ur2A:
undetectable
1w5uB-5ur2A:
undetectable		 1w5uA-5ur2A:
2.82
1w5uB-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.
5vf4 UNCHARACTERIZED
PROTEIN

(Thermus
aquaticus) 		PF03781
(FGE-sulfatase) 		3 TRP A 201
ALA A  90
VAL A 373
 None
 0.83A 1w5uA-5vf4A:
undetectable
1w5uB-5vf4A:
undetectable		 1w5uA-5vf4A:
6.06
1w5uB-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
 0.87A 1w5uA-5xsxA:
undetectable
1w5uB-5xsxA:
undetectable		 1w5uA-5xsxA:
undetectable
1w5uB-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.
5yim SDEA

(Legionella
pneumophila) 		no annotation 3 TRP A 394
ALA A 399
VAL A 401
 None
 0.82A 1w5uA-5yimA:
undetectable
1w5uB-5yimA:
undetectable		 1w5uA-5yimA:
undetectable
1w5uB-5yimA:
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.
6a2f -

(-) 		no annotation 3 TRP A 324
ALA A 326
VAL A 330
 None
 0.94A 1w5uA-6a2fA:
undetectable
1w5uB-6a2fA:
undetectable		 1w5uA-6a2fA:
undetectable
1w5uB-6a2fA:
undetectable