SIMILAR PATTERNS OF AMINO ACIDS FOR 5IY5_W_CHDW101_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.
1flo FLP RECOMBINASE

(Saccharomyces
cerevisiae) 		PF03930
(Flp_N)
PF05202
(Flp_C) 		5 ILE A 350
ARG A 308
MET A 311
THR A 312
LEU A 315
 None
 0.97A 5iy5N-1floA:
0.0
5iy5W-1floA:
0.0		 5iy5N-1floA:
21.78
5iy5W-1floA:
8.98
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.
1jed SULFATE
ADENYLYLTRANSFERASE

(Saccharomyces
cerevisiae) 		PF01747
(ATP-sulfurylase)
PF14306
(PUA_2) 		4 ILE A  48
ARG A  40
THR A  38
LEU A  37
 None
 0.94A 5iy5N-1jedA:
0.0
5iy5W-1jedA:
0.0		 5iy5N-1jedA:
21.17
5iy5W-1jedA:
8.28
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.
1ksx REPLICATION PROTEIN
E1

(Bovine
papillomavirus) 		PF00519
(PPV_E1_C) 		5 ILE A 235
PHE A 237
ARG A 247
MET A 250
LEU A 254
 None
 1.37A 5iy5N-1ksxA:
0.0
5iy5W-1ksxA:
0.0		 5iy5N-1ksxA:
14.35
5iy5W-1ksxA:
20.16
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.
1kt8 BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE,
MITOCHONDRIAL

(Homo sapiens) 		PF01063
(Aminotran_4) 		4 ILE A 332
MET A 293
THR A 292
LEU A 235
 None
 0.89A 5iy5N-1kt8A:
0.0
5iy5W-1kt8A:
0.0		 5iy5N-1kt8A:
22.71
5iy5W-1kt8A:
12.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1l2m REP PROTEIN

(Tomato yellow
leaf curl
Sardinia virus) 		PF00799
(Gemini_AL1) 		4 ILE A   9
PHE A   7
THR A  17
LEU A  16
 None
 0.86A 5iy5N-1l2mA:
0.0
5iy5W-1l2mA:
undetectable		 5iy5N-1l2mA:
10.72
5iy5W-1l2mA:
20.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1lrw METHANOL
DEHYDROGENASE
SUBUNIT 1

(Paracoccus
denitrificans) 		PF01011
(PQQ)
PF13360
(PQQ_2) 		4 ARG A 383
MET A 416
THR A 437
LEU A 436
 None
 0.88A 5iy5N-1lrwA:
undetectable
5iy5W-1lrwA:
undetectable		 5iy5N-1lrwA:
21.34
5iy5W-1lrwA:
6.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1mow CHIMERA OF HOMING
ENDONUCLEASE I-DMOI
AND DNA ENDONUCLEASE
I-CREI

(Desulfurococcus
mucosus;
Chlamydomonas
reinhardtii) 		PF00961
(LAGLIDADG_1)
PF14528
(LAGLIDADG_3) 		4 ILE A  18
PHE A  91
ARG A  55
MET A  56
 None
None
SO4  A 271 (-3.1A)
None
 0.89A 5iy5N-1mowA:
0.0
5iy5W-1mowA:
0.0		 5iy5N-1mowA:
18.60
5iy5W-1mowA:
11.37
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.
1odo PUTATIVE CYTOCHROME
P450 154A1

(Streptomyces
coelicolor) 		PF00067
(p450) 		4 PHE A 106
MET A 210
THR A 211
LEU A 214
 HEM  A1407 (-4.5A)
None
None
None
 0.93A 5iy5N-1odoA:
0.0
5iy5W-1odoA:
0.0		 5iy5N-1odoA:
23.13
5iy5W-1odoA:
10.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qf7 PROTEIN (CATALASE
HPII)

(Escherichia
coli) 		PF00199
(Catalase)
PF06628
(Catalase-rel) 		4 ILE A 666
MET A 736
THR A 734
LEU A 733
 None
 0.93A 5iy5N-1qf7A:
0.0
5iy5W-1qf7A:
0.0		 5iy5N-1qf7A:
21.37
5iy5W-1qf7A:
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.
1r6x ATP:SULFATE
ADENYLYLTRANSFERASE

(Saccharomyces
cerevisiae) 		PF01747
(ATP-sulfurylase)
PF14306
(PUA_2) 		4 ILE A  48
ARG A  40
THR A  38
LEU A  37
 None
 0.93A 5iy5N-1r6xA:
0.0
5iy5W-1r6xA:
undetectable		 5iy5N-1r6xA:
21.48
5iy5W-1r6xA:
11.52
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.
1v43 SUGAR-BINDING
TRANSPORT
ATP-BINDING PROTEIN

(Pyrococcus
horikoshii) 		PF00005
(ABC_tran)
PF08402
(TOBE_2) 		5 ILE A 361
PHE A 287
ARG A 310
MET A 294
THR A 295
 None
 1.34A 5iy5N-1v43A:
undetectable
5iy5W-1v43A:
undetectable		 5iy5N-1v43A:
21.39
5iy5W-1v43A:
9.73
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.
1vqt OROTIDINE
5'-PHOSPHATE
DECARBOXYLASE

(Thermotoga
maritima) 		PF00215
(OMPdecase) 		4 ILE A 143
ARG A 118
MET A 116
LEU A 112
 None
 0.91A 5iy5N-1vqtA:
undetectable
5iy5W-1vqtA:
undetectable		 5iy5N-1vqtA:
17.18
5iy5W-1vqtA:
16.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2bhv COMB10

(Helicobacter
pylori) 		PF03743
(TrbI) 		4 ILE A 212
PHE A 362
ARG A 239
LEU A 282
 None
 0.90A 5iy5N-2bhvA:
undetectable
5iy5W-2bhvA:
undetectable		 5iy5N-2bhvA:
19.84
5iy5W-2bhvA:
12.20
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.
2bwg GMP REDUCTASE I

(Homo sapiens) 		PF00478
(IMPDH) 		4 ILE A 154
MET A 113
THR A 114
LEU A 117
 None
 0.89A 5iy5N-2bwgA:
undetectable
5iy5W-2bwgA:
undetectable		 5iy5N-2bwgA:
21.02
5iy5W-2bwgA:
10.19
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.
2c6w PENICILLIN-BINDING
PROTEIN 1A

(Streptococcus
pneumoniae) 		PF00905
(Transpeptidase) 		4 TYR B 618
ARG B 619
MET B 622
THR B 623
 None
 0.91A 5iy5N-2c6wB:
undetectable
5iy5W-2c6wB:
undetectable		 5iy5N-2c6wB:
21.23
5iy5W-2c6wB:
8.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fc9 NCL PROTEIN

(Homo sapiens) 		PF00076
(RRM_1) 		4 ILE A  58
PHE A  36
ARG A  84
LEU A  23
 None
 0.84A 5iy5N-2fc9A:
undetectable
5iy5W-2fc9A:
undetectable		 5iy5N-2fc9A:
10.27
5iy5W-2fc9A:
20.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fe8 REPLICASE
POLYPROTEIN 1AB

(Severe acute
respiratory
syndrome-related
coronavirus) 		PF08715
(Viral_protease) 		4 ARG A 167
MET A 170
THR A 171
LEU A 174
 None
 0.78A 5iy5N-2fe8A:
undetectable
5iy5W-2fe8A:
undetectable		 5iy5N-2fe8A:
19.88
5iy5W-2fe8A:
13.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2kxw CALMODULIN

(Paramecium
tetraurelia) 		PF13499
(EF-hand_7) 		4 PHE A  89
MET A 109
THR A 110
LEU A 116
 None
 0.91A 5iy5N-2kxwA:
undetectable
5iy5W-2kxwA:
undetectable		 5iy5N-2kxwA:
8.77
5iy5W-2kxwA:
20.55
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.
2lez SECRETED EFFECTOR
PROTEIN PIPB2

(Salmonella
enterica) 		no annotation 4 PHE A 124
MET A  61
THR A  60
LEU A  57
 None
 0.91A 5iy5N-2lezA:
undetectable
5iy5W-2lezA:
undetectable		 5iy5N-2lezA:
13.68
5iy5W-2lezA:
16.55
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.
2o6q VARIABLE LYMPHOCYTE
RECEPTOR A

(Eptatretus
burgeri) 		PF13855
(LRR_8) 		4 ILE A  53
PHE A  79
THR A  97
LEU A  95
 None
 0.94A 5iy5N-2o6qA:
undetectable
5iy5W-2o6qA:
undetectable		 5iy5N-2o6qA:
18.29
5iy5W-2o6qA:
12.69
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.
2p3g MAP KINASE-ACTIVATED
PROTEIN KINASE 2

(Homo sapiens) 		PF00069
(Pkinase) 		4 ILE X 252
MET X 356
THR X 357
LEU X 360
 None
 0.80A 5iy5N-2p3gX:
undetectable
5iy5W-2p3gX:
undetectable		 5iy5N-2p3gX:
19.81
5iy5W-2p3gX:
13.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2py6 METHYLTRANSFERASE
FKBM

(Methylobacillus
flagellatus) 		PF05050
(Methyltransf_21) 		4 ILE A 170
PHE A  22
THR A 373
LEU A 376
 None
 0.94A 5iy5N-2py6A:
undetectable
5iy5W-2py6A:
undetectable		 5iy5N-2py6A:
20.60
5iy5W-2py6A:
9.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2q7s N-FORMYLGLUTAMATE
AMIDOHYDROLASE

(Cupriavidus
pinatubonensis) 		PF05013
(FGase) 		4 ILE A 250
PHE A 192
ARG A 272
THR A 275
 None
 0.87A 5iy5N-2q7sA:
undetectable
5iy5W-2q7sA:
undetectable		 5iy5N-2q7sA:
19.19
5iy5W-2q7sA:
12.66
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.
2qk4 TRIFUNCTIONAL PURINE
BIOSYNTHETIC PROTEIN
ADENOSINE-3

(Homo sapiens) 		PF01071
(GARS_A)
PF02843
(GARS_C)
PF02844
(GARS_N) 		4 ILE A 272
PHE A 203
THR A  16
LEU A  17
 None
 0.88A 5iy5N-2qk4A:
undetectable
5iy5W-2qk4A:
undetectable		 5iy5N-2qk4A:
22.52
5iy5W-2qk4A:
10.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qqo NEUROPILIN-2

(Homo sapiens) 		PF00431
(CUB)
PF00754
(F5_F8_type_C) 		4 ILE A 566
PHE A 563
ARG A 572
LEU A 492
 None
 0.86A 5iy5N-2qqoA:
undetectable
5iy5W-2qqoA:
undetectable		 5iy5N-2qqoA:
20.44
5iy5W-2qqoA:
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.
2uvf EXOPOLYGALACTURONASE

(Yersinia
enterocolitica) 		PF00295
(Glyco_hydro_28)
PF12708
(Pectate_lyase_3) 		4 PHE A 347
MET A 334
THR A 335
LEU A 336
 None
 0.87A 5iy5N-2uvfA:
undetectable
5iy5W-2uvfA:
undetectable		 5iy5N-2uvfA:
22.56
5iy5W-2uvfA:
9.24
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.
2y69 CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1

(Bos taurus) 		PF02238
(COX7a) 		5 TYR J  32
ARG J  33
MET J  36
THR J  37
LEU J  40
 None
 0.30A 5iy5N-2y69J:
undetectable
5iy5W-2y69J:
7.8		 5iy5N-2y69J:
10.31
5iy5W-2y69J:
100.00
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.
2yhe SEC-ALKYL SULFATASE

(Pseudomonas sp.
DSM 6611) 		PF00753
(Lactamase_B)
PF14863
(Alkyl_sulf_dimr)
PF14864
(Alkyl_sulf_C) 		4 ILE A 617
PHE A 646
THR A 606
LEU A 635
 None
 0.84A 5iy5N-2yheA:
undetectable
5iy5W-2yheA:
undetectable		 5iy5N-2yheA:
20.41
5iy5W-2yheA:
7.39
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.
2yrf METHYLTHIORIBOSE-1-P
HOSPHATE ISOMERASE

(Bacillus
subtilis) 		PF01008
(IF-2B) 		4 ILE A 242
PHE A 277
MET A 335
THR A 336
 None
 0.92A 5iy5N-2yrfA:
undetectable
5iy5W-2yrfA:
undetectable		 5iy5N-2yrfA:
20.95
5iy5W-2yrfA:
11.89
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.
2zgk ANTI-TUMOR LECTIN

(Agrocybe
aegerita) 		PF00337
(Gal-bind_lectin) 		4 ILE A 115
PHE A  93
THR A  46
LEU A  47
 None
 0.91A 5iy5N-2zgkA:
undetectable
5iy5W-2zgkA:
undetectable		 5iy5N-2zgkA:
15.56
5iy5W-2zgkA:
12.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ziu MUS81 PROTEIN

(Danio rerio) 		PF02732
(ERCC4) 		4 TYR A 471
MET A 475
THR A 476
LEU A 479
 None
 0.71A 5iy5N-2ziuA:
undetectable
5iy5W-2ziuA:
undetectable		 5iy5N-2ziuA:
18.55
5iy5W-2ziuA:
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.
2zsg AMINOPEPTIDASE P,
PUTATIVE

(Thermotoga
maritima) 		PF00557
(Peptidase_M24)
PF01321
(Creatinase_N) 		4 ILE A 230
MET A 177
THR A 176
LEU A 173
 None
 0.94A 5iy5N-2zsgA:
undetectable
5iy5W-2zsgA:
undetectable		 5iy5N-2zsgA:
20.79
5iy5W-2zsgA:
10.58
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.
2zts PUTATIVE
UNCHARACTERIZED
PROTEIN PH0186

(Pyrococcus
horikoshii) 		PF06745
(ATPase) 		4 ILE A 127
PHE A 123
THR A 178
LEU A 177
 None
 0.70A 5iy5N-2ztsA:
undetectable
5iy5W-2ztsA:
undetectable		 5iy5N-2ztsA:
17.81
5iy5W-2ztsA:
11.55
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.
3b7y E3 UBIQUITIN-PROTEIN
LIGASE NEDD4

(Homo sapiens) 		PF00168
(C2) 		5 PHE A 189
ARG A 124
MET A 248
THR A 249
LEU A 213
 None
 1.37A 5iy5N-3b7yA:
undetectable
5iy5W-3b7yA:
undetectable		 5iy5N-3b7yA:
13.39
5iy5W-3b7yA:
21.71
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.
3bn1 PEROSAMINE
SYNTHETASE

(Caulobacter
vibrioides) 		PF01041
(DegT_DnrJ_EryC1) 		4 ILE A 312
TYR A 261
THR A 289
LEU A 346
 None
 0.94A 5iy5N-3bn1A:
undetectable
5iy5W-3bn1A:
undetectable		 5iy5N-3bn1A:
21.12
5iy5W-3bn1A:
11.24
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.
3e0s UNCHARACTERIZED
PROTEIN

(Chlorobaculum
tepidum) 		PF05235
(CHAD) 		4 PHE A 255
TYR A 347
MET A 351
THR A 352
 None
 0.94A 5iy5N-3e0sA:
2.2
5iy5W-3e0sA:
undetectable		 5iy5N-3e0sA:
19.13
5iy5W-3e0sA:
10.53
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.
3f95 BETA-GLUCOSIDASE

(Pseudoalteromonas
sp. BB1) 		no annotation 5 ILE A 784
PHE A 747
ARG A 721
MET A 720
LEU A 718
 None
 1.33A 5iy5N-3f95A:
undetectable
5iy5W-3f95A:
undetectable		 5iy5N-3f95A:
17.88
5iy5W-3f95A:
16.15
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.
3fg4 ALLENE OXIDE
SYNTHASE-LIPOXYGENAS
E PROTEIN

(Plexaura
homomalla) 		PF00305
(Lipoxygenase)
PF01477
(PLAT) 		4 ILE A 462
ARG A 397
THR A 395
LEU A 410
 None
 0.88A 5iy5N-3fg4A:
1.8
5iy5W-3fg4A:
undetectable		 5iy5N-3fg4A:
20.56
5iy5W-3fg4A:
8.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gju PUTATIVE
AMINOTRANSFERASE

(Mesorhizobium
japonicum) 		PF00202
(Aminotran_3) 		4 ILE A 131
MET A 159
THR A 160
LEU A 163
 None
 0.88A 5iy5N-3gjuA:
undetectable
5iy5W-3gjuA:
undetectable		 5iy5N-3gjuA:
22.26
5iy5W-3gjuA:
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.
3h7a SHORT CHAIN
DEHYDROGENASE

(Rhodopseudomonas
palustris) 		PF00106
(adh_short) 		4 ILE A 135
PHE A 137
THR A  70
LEU A  73
 ILE  A 135 ( 0.6A)
PHE  A 137 ( 1.3A)
THR  A  70 ( 0.8A)
LEU  A  73 ( 0.5A)
 0.91A 5iy5N-3h7aA:
undetectable
5iy5W-3h7aA:
undetectable		 5iy5N-3h7aA:
18.89
5iy5W-3h7aA:
11.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3h7n NUCLEOPORIN NUP120

(Saccharomyces
cerevisiae) 		PF11715
(Nup160) 		4 ILE A  95
PHE A  81
THR A 109
LEU A 108
 None
 0.92A 5iy5N-3h7nA:
3.8
5iy5W-3h7nA:
undetectable		 5iy5N-3h7nA:
21.45
5iy5W-3h7nA:
6.84
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.
3hn5 PUTATIVE EXPORTED
PROTEIN BF0290

(Bacteroides
fragilis) 		PF12866
(DUF3823) 		4 ILE A 105
ARG A  36
THR A  34
LEU A  33
 None
 0.84A 5iy5N-3hn5A:
undetectable
5iy5W-3hn5A:
undetectable		 5iy5N-3hn5A:
17.12
5iy5W-3hn5A:
14.42
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.
3k13 5-METHYLTETRAHYDROFO
LATE-HOMOCYSTEINE
METHYLTRANSFERASE

(Bacteroides
thetaiotaomicron) 		PF00809
(Pterin_bind) 		4 ARG A 407
MET A 410
THR A 411
LEU A 414
 None
 0.78A 5iy5N-3k13A:
undetectable
5iy5W-3k13A:
undetectable		 5iy5N-3k13A:
20.20
5iy5W-3k13A:
11.50
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.
3kuq RHO
GTPASE-ACTIVATING
PROTEIN 7

(Homo sapiens) 		PF00620
(RhoGAP) 		4 ILE A1186
PHE A1170
ARG A1198
LEU A1205
 None
 0.91A 5iy5N-3kuqA:
undetectable
5iy5W-3kuqA:
undetectable		 5iy5N-3kuqA:
17.51
5iy5W-3kuqA:
14.16
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.
3kyj CHEY6 PROTEIN

(Rhodobacter
sphaeroides) 		PF00072
(Response_reg) 		4 ILE B   7
MET B 128
THR B 127
LEU B 124
 None
 0.93A 5iy5N-3kyjB:
undetectable
5iy5W-3kyjB:
undetectable		 5iy5N-3kyjB:
15.09
5iy5W-3kyjB:
18.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3muu STRUCTURAL
POLYPROTEIN

(Sindbis virus) 		PF00943
(Alpha_E2_glycop)
PF01589
(Alpha_E1_glycop) 		4 ILE A 283
ARG A 298
THR A 296
LEU A 295
 None
 0.75A 5iy5N-3muuA:
undetectable
5iy5W-3muuA:
undetectable		 5iy5N-3muuA:
21.45
5iy5W-3muuA:
6.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nws CELL DIVISION
CONTROL PROTEIN 13

(Saccharomyces
cerevisiae) 		PF16853
(CDC13_N) 		4 ILE A  89
ARG A 116
THR A  42
LEU A  41
 None
 0.88A 5iy5N-3nwsA:
undetectable
5iy5W-3nwsA:
undetectable		 5iy5N-3nwsA:
15.67
5iy5W-3nwsA:
13.70
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.
3owt DNA-BINDING PROTEIN
RAP1

(Saccharomyces
cerevisiae) 		PF11626
(Rap1_C) 		4 ILE A 746
PHE A 769
THR A 756
LEU A 755
 None
 0.86A 5iy5N-3owtA:
undetectable
5iy5W-3owtA:
undetectable		 5iy5N-3owtA:
13.87
5iy5W-3owtA:
14.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3se7 VANA

(-) 		PF01820
(Dala_Dala_lig_N)
PF07478
(Dala_Dala_lig_C) 		4 TYR A 315
MET A 319
THR A 320
LEU A 324
 None
 0.92A 5iy5N-3se7A:
undetectable
5iy5W-3se7A:
undetectable		 5iy5N-3se7A:
21.97
5iy5W-3se7A:
10.15
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.
3u15 PROTEIN MDM4

(Homo sapiens) 		PF02201
(SWIB) 		4 ILE A  36
ARG A  87
MET A 101
LEU A 102
 None
 0.83A 5iy5N-3u15A:
undetectable
5iy5W-3u15A:
undetectable		 5iy5N-3u15A:
11.22
5iy5W-3u15A:
26.74
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.
3wg1 GALACTOSIDE-BINDING
LECTIN

(Agrocybe
aegerita) 		PF00337
(Gal-bind_lectin) 		4 ILE A 118
PHE A  96
ARG A  66
LEU A  50
 None
None
LAT  A 201 (-3.0A)
None
 0.92A 5iy5N-3wg1A:
undetectable
5iy5W-3wg1A:
undetectable		 5iy5N-3wg1A:
15.15
5iy5W-3wg1A:
13.64
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.
3zxs CRYPTOCHROME B

(Rhodobacter
sphaeroides) 		PF04244
(DPRP) 		5 PHE A 498
TYR A 439
ARG A 343
MET A 344
LEU A 347
 None
None
None
SF4  A1510 (-4.5A)
None
 1.32A 5iy5N-3zxsA:
undetectable
5iy5W-3zxsA:
undetectable		 5iy5N-3zxsA:
22.32
5iy5W-3zxsA:
8.49
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.
4a3x EPA1P

([Candida]
glabrata) 		PF10528
(GLEYA) 		4 PHE A 111
MET A 138
THR A 137
LEU A 136
 None
 0.84A 5iy5N-4a3xA:
undetectable
5iy5W-4a3xA:
undetectable		 5iy5N-4a3xA:
17.93
5iy5W-4a3xA:
13.02
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.
4bjt DNA-BINDING PROTEIN
RAP1

(Saccharomyces
cerevisiae) 		PF11626
(Rap1_C) 		4 ILE A 746
PHE A 769
THR A 756
LEU A 755
 None
 0.94A 5iy5N-4bjtA:
undetectable
5iy5W-4bjtA:
undetectable		 5iy5N-4bjtA:
18.11
5iy5W-4bjtA:
14.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bla MALTOSE-BINDING
PERIPLASMIC PROTEIN,
SUPPRESSOR OF FUSED
HOMOLOG

(Escherichia
coli;
Homo sapiens) 		PF05076
(SUFU)
PF12470
(SUFU_C)
PF13416
(SBP_bac_8) 		4 ILE A  60
PHE A  62
THR A 287
LEU A 286
 None
 0.93A 5iy5N-4blaA:
undetectable
5iy5W-4blaA:
undetectable		 5iy5N-4blaA:
21.39
5iy5W-4blaA:
5.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bob ERPP PROTEIN

(Borreliella
burgdorferi) 		PF02471
(OspE) 		4 PHE A  78
MET A  92
THR A  93
LEU A 160
 None
 0.70A 5iy5N-4bobA:
undetectable
5iy5W-4bobA:
undetectable		 5iy5N-4bobA:
15.65
5iy5W-4bobA:
16.97
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.
4bxm ERPC

(Borreliella
burgdorferi) 		PF02471
(OspE) 		4 PHE A  73
MET A  87
THR A  88
LEU A 153
 None
 0.74A 5iy5N-4bxmA:
undetectable
5iy5W-4bxmA:
undetectable		 5iy5N-4bxmA:
15.42
5iy5W-4bxmA:
19.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4coy EPITHELIAL ADHESIN 6

([Candida]
glabrata) 		PF10528
(GLEYA) 		4 PHE A 111
MET A 138
THR A 137
LEU A 136
 None
 0.78A 5iy5N-4coyA:
undetectable
5iy5W-4coyA:
undetectable		 5iy5N-4coyA:
19.30
5iy5W-4coyA:
12.60
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.
4cp6 CHOLINE BINDING
PROTEIN PCPA

(Streptococcus
pneumoniae) 		PF13306
(LRR_5) 		4 ILE A 331
PHE A 354
THR A 369
LEU A 368
 None
 0.84A 5iy5N-4cp6A:
undetectable
5iy5W-4cp6A:
undetectable		 5iy5N-4cp6A:
20.91
5iy5W-4cp6A:
9.40
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.
4du5 PFKB

(Polaromonas sp.
JS666) 		PF00294
(PfkB) 		4 ILE A 208
PHE A 189
THR A 169
LEU A 170
 None
 0.93A 5iy5N-4du5A:
undetectable
5iy5W-4du5A:
undetectable		 5iy5N-4du5A:
21.04
5iy5W-4du5A:
10.15
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.
4fix UDP-GALACTOFURANOSYL
TRANSFERASE GLFT2

(Mycobacterium
tuberculosis) 		PF13641
(Glyco_tranf_2_3) 		4 ILE A 137
PHE A 135
THR A  44
LEU A  14
 None
 0.94A 5iy5N-4fixA:
undetectable
5iy5W-4fixA:
undetectable		 5iy5N-4fixA:
22.47
5iy5W-4fixA:
7.83
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.
4gfj TOPOISOMERASE V

(Methanopyrus
kandleri) 		PF13412
(HTH_24)
PF14520
(HHH_5) 		4 ILE A 285
ARG A 276
THR A 274
LEU A 273
 None
 0.89A 5iy5N-4gfjA:
2.4
5iy5W-4gfjA:
undetectable		 5iy5N-4gfjA:
20.06
5iy5W-4gfjA:
5.61
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.
4hka TRYPTOPHAN
2,3-DIOXYGENASE

(Drosophila
melanogaster) 		PF03301
(Trp_dioxygenase) 		4 PHE A 127
MET A 119
THR A 118
LEU A 116
 None
None
None
HEM  A 401 (-4.7A)
 0.87A 5iy5N-4hkaA:
1.0
5iy5W-4hkaA:
undetectable		 5iy5N-4hkaA:
19.34
5iy5W-4hkaA:
10.79
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.
4j38 OUTER SURFACE
PROTEIN E

(Borreliella
burgdorferi) 		PF02471
(OspE) 		4 PHE A  86
MET A 100
THR A 101
LEU A 166
 None
 0.76A 5iy5N-4j38A:
undetectable
5iy5W-4j38A:
undetectable		 5iy5N-4j38A:
13.32
5iy5W-4j38A:
17.53
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.
4jis RIBITOL-5-PHOSPHATE
CYTIDYLYLTRANSFERASE

(Bacillus
subtilis) 		PF01128
(IspD) 		4 ILE A 108
PHE A  46
THR A 118
LEU A 117
 None
 0.78A 5iy5N-4jisA:
undetectable
5iy5W-4jisA:
undetectable		 5iy5N-4jisA:
18.13
5iy5W-4jisA:
12.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4lxr PROTEIN TOLL

(Drosophila
melanogaster) 		PF00560
(LRR_1)
PF01462
(LRRNT)
PF13306
(LRR_5)
PF13855
(LRR_8) 		4 PHE A 410
ARG A 396
MET A 421
LEU A 445
 None
 0.94A 5iy5N-4lxrA:
undetectable
5iy5W-4lxrA:
undetectable		 5iy5N-4lxrA:
20.28
5iy5W-4lxrA:
5.74
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.
4m1a HYPOTHETICAL PROTEIN

(Sebaldella
termitidis) 		PF08921
(DUF1904) 		4 ILE A  73
PHE A  77
ARG A   5
THR A  37
 None
 0.75A 5iy5N-4m1aA:
undetectable
5iy5W-4m1aA:
undetectable		 5iy5N-4m1aA:
12.03
5iy5W-4m1aA:
20.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4oqf PROTEIN RECA

(Mycobacterium
tuberculosis) 		PF00154
(RecA) 		4 ILE A 144
MET A 179
THR A 180
LEU A 183
 None
 0.79A 5iy5N-4oqfA:
undetectable
5iy5W-4oqfA:
undetectable		 5iy5N-4oqfA:
20.15
5iy5W-4oqfA:
11.80
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.
4pdb 30S RIBOSOMAL
PROTEIN S8

(Bacillus
anthracis) 		PF00410
(Ribosomal_S8) 		4 ILE A  69
ARG A  36
THR A  35
LEU A 100
 None
 0.93A 5iy5N-4pdbA:
undetectable
5iy5W-4pdbA:
undetectable		 5iy5N-4pdbA:
14.48
5iy5W-4pdbA:
17.42
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.
4rk9 CARBOHYDRATE ABC
TRANSPORTER
SUBSTRATE-BINDING
PROTEIN MSME

(Bacillus
licheniformis) 		PF01547
(SBP_bac_1) 		4 ILE A 338
ARG A 307
MET A  40
THR A  39
 None
GLA  A 503 (-2.8A)
None
GLA  A 502 ( 3.8A)
 0.89A 5iy5N-4rk9A:
undetectable
5iy5W-4rk9A:
undetectable		 5iy5N-4rk9A:
21.64
5iy5W-4rk9A:
7.37
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.
4rrp ANTIGEN ASF1P

(Saccharomyces
cerevisiae) 		PF04729
(ASF1_hist_chap) 		4 ILE M   9
ARG M 108
THR M  43
LEU M  42
 None
 0.82A 5iy5N-4rrpM:
undetectable
5iy5W-4rrpM:
undetectable		 5iy5N-4rrpM:
13.87
5iy5W-4rrpM:
18.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rw3 PHOSPHOLIPASE D
LISICTOX-ALPHAIA1BII

(Loxosceles
intermedia) 		no annotation 4 ILE A 130
PHE A  91
ARG A  72
LEU A  86
 None
 0.91A 5iy5N-4rw3A:
undetectable
5iy5W-4rw3A:
undetectable		 5iy5N-4rw3A:
20.23
5iy5W-4rw3A:
13.18
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.
4ww3 RHODOPSIN

(Todarodes
pacificus) 		PF00001
(7tm_1) 		4 ILE A 314
ARG A 133
MET A 126
LEU A  76
 None
BOG  A 405 (-3.6A)
None
None
 0.89A 5iy5N-4ww3A:
1.8
5iy5W-4ww3A:
undetectable		 5iy5N-4ww3A:
20.70
5iy5W-4ww3A:
9.59
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.
4xmm NUCLEOPORIN NUP120

(Saccharomyces
cerevisiae) 		no annotation 4 ILE E  95
PHE E  81
THR E 109
LEU E 108
 None
 0.94A 5iy5N-4xmmE:
0.8
5iy5W-4xmmE:
undetectable		 5iy5N-4xmmE:
18.96
5iy5W-4xmmE:
4.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yb9 SOLUTE CARRIER
FAMILY 2,
FACILITATED GLUCOSE
TRANSPORTER MEMBER 5

(Bos taurus) 		PF00083
(Sugar_tr) 		4 TYR D 149
ARG D  98
THR D 101
LEU D 103
 None
 0.91A 5iy5N-4yb9D:
undetectable
5iy5W-4yb9D:
undetectable		 5iy5N-4yb9D:
24.01
5iy5W-4yb9D:
7.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yzk TRYPTOPHAN
DIMETHYLALLYLTRANSFE
RASE

(Streptomyces
blastmyceticus) 		PF11991
(Trp_DMAT) 		4 ILE A 369
PHE A 379
ARG A 331
LEU A 383
 None
 0.94A 5iy5N-4yzkA:
undetectable
5iy5W-4yzkA:
undetectable		 5iy5N-4yzkA:
21.92
5iy5W-4yzkA:
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.
4zi6 CYTOSOL
AMINOPEPTIDASE

(Helicobacter
pylori) 		PF00883
(Peptidase_M17)
PF02789
(Peptidase_M17_N) 		4 TYR A 166
MET A 170
THR A 171
LEU A 174
 None
 0.42A 5iy5N-4zi6A:
0.3
5iy5W-4zi6A:
undetectable		 5iy5N-4zi6A:
22.57
5iy5W-4zi6A:
9.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zo0 PROTEIN REP68

(Adeno-associated
dependoparvovirus
A) 		PF08724
(Rep_N) 		4 ILE A   9
PHE A 132
ARG A 119
THR A  65
 None
 0.80A 5iy5N-4zo0A:
undetectable
5iy5W-4zo0A:
undetectable		 5iy5N-4zo0A:
16.50
5iy5W-4zo0A:
17.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5cxp POSSIBLE XYLAN
DEGRADATION ENZYME
(GLYCOSYL HYDROLASE
FAMILY 30-LIKE
DOMAIN AND RICIN
B-LIKE DOMAIN)

(Clostridium
acetobutylicum) 		PF02055
(Glyco_hydro_30) 		4 ILE A 294
PHE A  20
MET A 252
THR A 253
 None
 0.85A 5iy5N-5cxpA:
undetectable
5iy5W-5cxpA:
undetectable		 5iy5N-5cxpA:
22.05
5iy5W-5cxpA:
10.80
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.
5dkx ALPHA
GLUCOSIDASE-LIKE
PROTEIN

(Chaetomium
thermophilum) 		PF01055
(Glyco_hydro_31)
PF13802
(Gal_mutarotas_2)
PF17137
(DUF5110) 		4 PHE A 186
ARG A 109
THR A  99
LEU A  98
 None
 0.82A 5iy5N-5dkxA:
undetectable
5iy5W-5dkxA:
undetectable		 5iy5N-5dkxA:
18.91
5iy5W-5dkxA:
5.44
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.
5dtc RIBOSOME BIOGENESIS
PROTEIN YTM1

(Saccharomyces
cerevisiae) 		PF08154
(NLE) 		4 ILE A  42
PHE A  12
ARG A  36
LEU A  68
 None
 0.90A 5iy5N-5dtcA:
undetectable
5iy5W-5dtcA:
undetectable		 5iy5N-5dtcA:
9.94
5iy5W-5dtcA:
28.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5edj FRPC OPERON PROTEIN

(Neisseria
meningitidis) 		PF06901
(FrpC) 		4 ILE A  72
PHE A  63
ARG A  79
THR A  81
 None
 0.84A 5iy5N-5edjA:
undetectable
5iy5W-5edjA:
undetectable		 5iy5N-5edjA:
16.42
5iy5W-5edjA:
11.68
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.
5ezr CGMP-DEPENDENT
PROTEIN KINASE,
PUTATIVE

(Plasmodium
vivax) 		PF00027
(cNMP_binding)
PF00069
(Pkinase) 		4 ARG A 276
MET A 279
THR A 280
LEU A 283
 None
 0.90A 5iy5N-5ezrA:
undetectable
5iy5W-5ezrA:
undetectable		 5iy5N-5ezrA:
20.35
5iy5W-5ezrA:
5.47
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.
5fgc ANTI-HCV E2 FAB
HC33.8 LIGHT CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		4 ILE B  57
ARG B  75
THR B  73
LEU B  72
 None
 0.93A 5iy5N-5fgcB:
undetectable
5iy5W-5fgcB:
undetectable		 5iy5N-5fgcB:
16.80
5iy5W-5fgcB:
12.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5gnc AVH146

(Phytophthora
sojae) 		no annotation 4 TYR A 232
MET A 228
THR A 227
LEU A 224
 None
 0.91A 5iy5N-5gncA:
2.0
5iy5W-5gncA:
undetectable		 5iy5N-5gncA:
21.10
5iy5W-5gncA:
9.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5gzy (R)-2-HALOACID
DEHALOGENASE

(Pseudomonas
putida) 		PF10778
(DehI) 		4 ILE A 126
PHE A 127
ARG A 211
MET A 176
 None
 0.85A 5iy5N-5gzyA:
1.2
5iy5W-5gzyA:
undetectable		 5iy5N-5gzyA:
20.49
5iy5W-5gzyA:
10.63
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.
5iig VACUOLAR TRANSPORTER
CHAPERONE 4

(Saccharomyces
cerevisiae) 		PF03105
(SPX)
PF09359
(VTC) 		4 ARG A 356
MET A 382
THR A 381
LEU A 380
 None
 0.94A 5iy5N-5iigA:
3.5
5iy5W-5iigA:
undetectable		 5iy5N-5iigA:
20.84
5iy5W-5iigA:
9.05
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.
5jj4 MALTOSE-BINDING
PERIPLASMIC
PROTEIN,SINGLE-STRAN
DED DNA CYTOSINE
DEAMINASE

(Escherichia
coli;
Homo sapiens) 		no annotation 4 ILE C1065
PHE C1061
ARG C1077
LEU C1098
 None
 0.90A 5iy5N-5jj4C:
undetectable
5iy5W-5jj4C:
undetectable		 5iy5N-5jj4C:
21.78
5iy5W-5jj4C:
7.84
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.
5l73 NEUROPILIN-1

(Homo sapiens) 		PF00629
(MAM) 		4 ILE A 798
PHE A 781
ARG A 767
LEU A 770
 None
 0.94A 5iy5N-5l73A:
undetectable
5iy5W-5l73A:
undetectable		 5iy5N-5l73A:
14.03
5iy5W-5l73A:
13.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5lh9 OMEGA TRANSAMINASE

(Pseudomonas sp.) 		PF00202
(Aminotran_3) 		4 ILE A 286
PHE A 261
THR A  98
LEU A 297
 None
 0.93A 5iy5N-5lh9A:
undetectable
5iy5W-5lh9A:
undetectable		 5iy5N-5lh9A:
20.77
5iy5W-5lh9A:
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.
5lki TCDA1

(Photorhabdus
luminescens) 		PF03538
(VRP1) 		5 PHE A1136
ARG A1602
MET A1596
THR A1585
LEU A1584
 None
 1.32A 5iy5N-5lkiA:
4.4
5iy5W-5lkiA:
1.4		 5iy5N-5lkiA:
11.55
5iy5W-5lkiA:
2.20
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.
5mew LACCASE 2

(Steccherinum
murashkinskyi) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 PHE A  82
TYR A 491
THR A  60
LEU A  59
 None
 0.85A 5iy5N-5mewA:
undetectable
5iy5W-5mewA:
undetectable		 5iy5N-5mewA:
23.09
5iy5W-5mewA:
8.54
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.
5mwl INOSITOL-PENTAKISPHO
SPHATE 2-KINASE

(Mus musculus) 		PF06090
(Ins_P5_2-kin) 		4 TYR A 392
ARG A 393
MET A 396
THR A 397
 None
 0.83A 5iy5N-5mwlA:
undetectable
5iy5W-5mwlA:
undetectable		 5iy5N-5mwlA:
19.60
5iy5W-5mwlA:
9.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5nbq OUTER SURFACE
PROTEIN E

(Borreliella
burgdorferi) 		no annotation 4 PHE G  86
MET G 100
THR G 101
LEU G 166
 None
 0.78A 5iy5N-5nbqG:
undetectable
5iy5W-5nbqG:
undetectable		 5iy5N-5nbqG:
undetectable
5iy5W-5nbqG:
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.
5nm7 PEPTIDOGLYCAN-BINDIN
G DOMAIN 1

(Burkholderia) 		no annotation 4 TYR G 117
ARG G 119
MET G 122
LEU G 126
 None
 0.78A 5iy5N-5nm7G:
undetectable
5iy5W-5nm7G:
undetectable		 5iy5N-5nm7G:
undetectable
5iy5W-5nm7G:
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.
5ny0 L. REUTERIS SRRP
BINDING REGION

(Lactobacillus
reuteri) 		no annotation 4 ILE A 427
MET A 477
THR A 476
LEU A 475
 None
 0.80A 5iy5N-5ny0A:
undetectable
5iy5W-5ny0A:
undetectable		 5iy5N-5ny0A:
undetectable
5iy5W-5ny0A:
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.
5td2 TYROSINE-PROTEIN
KINASE MER

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		4 ILE A 695
MET A 735
THR A 736
LEU A 731
 None
 0.93A 5iy5N-5td2A:
undetectable
5iy5W-5td2A:
undetectable		 5iy5N-5td2A:
20.72
5iy5W-5td2A:
15.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5tpw GLUTAMATE RECEPTOR
IONOTROPIC, NMDA 2A

(Rattus
norvegicus) 		PF01094
(ANF_receptor) 		4 ILE B 127
PHE B 147
THR B 300
LEU B 299
 None
 0.86A 5iy5N-5tpwB:
undetectable
5iy5W-5tpwB:
undetectable		 5iy5N-5tpwB:
20.58
5iy5W-5tpwB:
10.28
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.
5uc2 DOMAIN OF UNKNOWN
FUNCTION DUF1849

(Brucella
abortus) 		PF08904
(DUF1849) 		5 TYR A 235
ARG A 236
MET A 252
THR A 251
LEU A 250
 None
 1.45A 5iy5N-5uc2A:
undetectable
5iy5W-5uc2A:
undetectable		 5iy5N-5uc2A:
18.71
5iy5W-5uc2A:
14.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6gsa -

(-) 		no annotation 4 ILE D 320
MET D 361
THR D 360
LEU D 359
 None
 0.81A 5iy5N-6gsaD:
undetectable
5iy5W-6gsaD:
undetectable		 5iy5N-6gsaD:
undetectable
5iy5W-6gsaD:
undetectable