SIMILAR PATTERNS OF AMINO ACIDS FOR 2J9C_A_ACTA1121

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.
1czf POLYGALACTURONASE II

(Aspergillus
niger) 		PF00295
(Glyco_hydro_28) 		4 VAL A 190
SER A 208
VAL A 238
SER A 187
 None
 1.40A 2j9cA-1czfA:
undetectable
2j9cB-1czfA:
undetectable
2j9cC-1czfA:
0.0		 2j9cA-1czfA:
13.64
2j9cB-1czfA:
13.64
2j9cC-1czfA:
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.
1d9z EXCINUCLEASE UVRABC
COMPONENT UVRB

([Bacillus]
caldotenax) 		PF00271
(Helicase_C)
PF04851
(ResIII)
PF12344
(UvrB) 		4 SER A 141
VAL A  90
VAL A 142
SER A  91
 None
 1.32A 2j9cA-1d9zA:
0.0
2j9cB-1d9zA:
0.0
2j9cC-1d9zA:
0.0		 2j9cA-1d9zA:
10.96
2j9cB-1d9zA:
10.96
2j9cC-1d9zA:
10.96
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.
1elk TARGET OF MYB1

(Homo sapiens) 		PF00790
(VHS) 		4 VAL A  98
SER A  91
VAL A  89
SER A  97
 None
 1.35A 2j9cA-1elkA:
0.0
2j9cB-1elkA:
0.0
2j9cC-1elkA:
0.0		 2j9cA-1elkA:
20.99
2j9cB-1elkA:
20.99
2j9cC-1elkA:
20.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1eyy ALDEHYDE
DEHYDROGENASE

(Vibrio harveyi) 		PF00171
(Aldedh) 		4 SER A 358
VAL A 356
SER A 318
SER A 320
 None
 1.37A 2j9cA-1eyyA:
0.0
2j9cB-1eyyA:
0.0
2j9cC-1eyyA:
0.0		 2j9cA-1eyyA:
11.85
2j9cB-1eyyA:
11.85
2j9cC-1eyyA:
11.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1fnf FIBRONECTIN

(Homo sapiens) 		PF00041
(fn3) 		4 SER A1272
VAL A1280
SER A1306
VAL A1304
 None
 1.32A 2j9cA-1fnfA:
undetectable
2j9cB-1fnfA:
undetectable
2j9cC-1fnfA:
0.0		 2j9cA-1fnfA:
15.76
2j9cB-1fnfA:
15.76
2j9cC-1fnfA:
15.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1l1l RIBONUCLEOSIDE
TRIPHOSPHATE
REDUCTASE

(Lactobacillus
leichmannii) 		PF02867
(Ribonuc_red_lgC) 		4 SER A 674
SER A 353
VAL A 379
SER A 676
 None
 1.14A 2j9cA-1l1lA:
0.0
2j9cB-1l1lA:
0.0
2j9cC-1l1lA:
0.0		 2j9cA-1l1lA:
10.55
2j9cB-1l1lA:
10.55
2j9cC-1l1lA:
10.55
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.
1m6s L-ALLO-THREONINE
ALDOLASE

(Thermotoga
maritima) 		PF01212
(Beta_elim_lyase) 		4 VAL A  64
SER A 192
VAL A 210
SER A  65
 None
 1.31A 2j9cA-1m6sA:
0.0
2j9cB-1m6sA:
undetectable
2j9cC-1m6sA:
0.0		 2j9cA-1m6sA:
16.43
2j9cB-1m6sA:
16.43
2j9cC-1m6sA:
16.43
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.
1pk6 COMPLEMENT C1Q
SUBCOMPONENT, A
CHAIN PRECURSOR
COMPLEMENT C1Q
SUBCOMPONENT, B
CHAIN PRECURSOR
COMPLEMENT C1Q
SUBCOMPONENT, C
CHAIN PRECURSOR

(Homo sapiens;
Homo sapiens;
Homo sapiens) 		PF00386
(C1q)
PF00386
(C1q)
PF00386
(C1q) 		4 VAL B 180
SER A 180
VAL A 178
SER C 176
 None
 1.29A 2j9cA-1pk6B:
0.0
2j9cB-1pk6B:
0.0
2j9cC-1pk6B:
0.0		 2j9cA-1pk6B:
19.33
2j9cB-1pk6B:
19.33
2j9cC-1pk6B:
19.33
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.
1poi GLUTACONATE COENZYME
A-TRANSFERASE

(Acidaminococcus
fermentans) 		PF01144
(CoA_trans) 		4 SER B 119
VAL B 117
SER B 135
SER B 167
 None
 0.95A 2j9cA-1poiB:
undetectable
2j9cB-1poiB:
undetectable
2j9cC-1poiB:
undetectable		 2j9cA-1poiB:
17.21
2j9cB-1poiB:
17.21
2j9cC-1poiB:
17.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1poi GLUTACONATE COENZYME
A-TRANSFERASE

(Acidaminococcus
fermentans) 		PF01144
(CoA_trans) 		4 SER B 167
SER B 119
VAL B 117
SER B 135
 None
 0.96A 2j9cA-1poiB:
undetectable
2j9cB-1poiB:
undetectable
2j9cC-1poiB:
undetectable		 2j9cA-1poiB:
17.21
2j9cB-1poiB:
17.21
2j9cC-1poiB:
17.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qu7 METHYL-ACCEPTING
CHEMOTAXIS PROTEIN I

(Escherichia
coli) 		PF00015
(MCPsignal) 		4 SER A 432
VAL A 348
SER A 355
VAL A 428
 None
 1.10A 2j9cA-1qu7A:
undetectable
2j9cB-1qu7A:
undetectable
2j9cC-1qu7A:
undetectable		 2j9cA-1qu7A:
20.27
2j9cB-1qu7A:
20.27
2j9cC-1qu7A:
20.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1r8o KUNITZ TRYPSIN
INHIBITOR
KUNITZ TRYPSIN
INHIBITOR

(Copaifera
langsdorffii;
Copaifera
langsdorffii) 		PF00197
(Kunitz_legume)
PF00197
(Kunitz_legume) 		4 VAL B 152
SER A  43
VAL A  45
SER B 101
 None
 0.92A 2j9cA-1r8oB:
undetectable
2j9cB-1r8oB:
undetectable
2j9cC-1r8oB:
undetectable		 2j9cA-1r8oB:
28.21
2j9cB-1r8oB:
28.21
2j9cC-1r8oB:
28.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1smk MALATE
DEHYDROGENASE,
GLYOXYSOMAL

(Citrullus
lanatus) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		4 SER A 310
VAL A 217
SER A 300
VAL A 322
 None
 1.33A 2j9cA-1smkA:
undetectable
2j9cB-1smkA:
undetectable
2j9cC-1smkA:
undetectable		 2j9cA-1smkA:
18.52
2j9cB-1smkA:
18.52
2j9cC-1smkA:
18.52
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.
1uxo YDEN PROTEIN

(Bacillus
subtilis) 		PF06821
(Ser_hydrolase) 		4 VAL A  96
SER A 134
VAL A 159
SER A  97
 None
 1.11A 2j9cA-1uxoA:
undetectable
2j9cB-1uxoA:
undetectable
2j9cC-1uxoA:
undetectable		 2j9cA-1uxoA:
18.75
2j9cB-1uxoA:
18.75
2j9cC-1uxoA:
18.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1v5c CHITOSANASE

(Bacillus sp.
(in: Bacteria)) 		PF01270
(Glyco_hydro_8) 		4 SER A 321
VAL A 323
VAL A 379
SER A 246
 None
 1.20A 2j9cA-1v5cA:
undetectable
2j9cB-1v5cA:
undetectable
2j9cC-1v5cA:
undetectable		 2j9cA-1v5cA:
15.96
2j9cB-1v5cA:
15.96
2j9cC-1v5cA:
15.96
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.
1v6c ALKALINE SERINE
PROTEASE

(Pseudoalteromonas
sp. AS-11) 		PF00082
(Peptidase_S8)
PF02225
(PA) 		4 SER A 335
VAL A 232
SER A 310
VAL A 308
 None
 1.32A 2j9cA-1v6cA:
undetectable
2j9cB-1v6cA:
undetectable
2j9cC-1v6cA:
undetectable		 2j9cA-1v6cA:
12.84
2j9cB-1v6cA:
12.84
2j9cC-1v6cA:
12.84
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.
1wuu GALACTOKINASE

(Homo sapiens) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C)
PF10509
(GalKase_gal_bdg) 		4 SER A 132
VAL A 130
SER A 144
VAL A 133
 None
 1.34A 2j9cA-1wuuA:
4.3
2j9cB-1wuuA:
4.2
2j9cC-1wuuA:
3.6		 2j9cA-1wuuA:
15.87
2j9cB-1wuuA:
15.87
2j9cC-1wuuA:
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.
1xax HYPOTHETICAL UPF0054
PROTEIN HI0004

(Haemophilus
influenzae) 		PF02130
(UPF0054) 		4 VAL A 112
SER A  69
VAL A  87
SER A 116
 None
 1.36A 2j9cA-1xaxA:
undetectable
2j9cB-1xaxA:
undetectable
2j9cC-1xaxA:
undetectable		 2j9cA-1xaxA:
20.00
2j9cB-1xaxA:
20.00
2j9cC-1xaxA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2agm POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE 4

(Azotobacter
vinelandii) 		PF00353
(HemolysinCabind)
PF08548
(Peptidase_M10_C) 		4 VAL A  53
SER A  85
VAL A 143
SER A  55
 None
 1.13A 2j9cA-2agmA:
undetectable
2j9cB-2agmA:
undetectable
2j9cC-2agmA:
undetectable		 2j9cA-2agmA:
18.12
2j9cB-2agmA:
18.12
2j9cC-2agmA:
18.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2bf4 NADPH-CYTOCHROME
P450 REDUCTASE

(Saccharomyces
cerevisiae) 		PF00175
(NAD_binding_1)
PF00258
(Flavodoxin_1)
PF00667
(FAD_binding_1) 		4 SER A 458
VAL A 456
VAL A 460
SER A 290
 None
 1.08A 2j9cA-2bf4A:
undetectable
2j9cB-2bf4A:
undetectable
2j9cC-2bf4A:
undetectable		 2j9cA-2bf4A:
11.88
2j9cB-2bf4A:
11.88
2j9cC-2bf4A:
11.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2bsx PURINE NUCLEOSIDE
PHOSPHORYLASE

(Plasmodium
falciparum) 		PF01048
(PNP_UDP_1) 		4 SER A 118
VAL A 190
SER A  68
VAL A 117
 None
 1.36A 2j9cA-2bsxA:
undetectable
2j9cB-2bsxA:
undetectable
2j9cC-2bsxA:
1.1		 2j9cA-2bsxA:
19.92
2j9cB-2bsxA:
19.92
2j9cC-2bsxA:
19.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2d2i GLYCERALDEHYDE
3-PHOSPHATE
DEHYDROGENASE

(Synechococcus
sp.) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		4 SER A 183
VAL A 237
SER A 285
VAL A 242
 None
 1.37A 2j9cA-2d2iA:
2.0
2j9cB-2d2iA:
1.6
2j9cC-2d2iA:
1.9		 2j9cA-2d2iA:
16.90
2j9cB-2d2iA:
16.90
2j9cC-2d2iA:
16.90
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.
2dvz PUTATIVE EXPORTED
PROTEIN

(Bordetella
pertussis) 		PF03401
(TctC) 		4 SER A 200
VAL A 118
SER A 178
VAL A 182
 None
None
GLU  A1055 (-3.8A)
None
 1.40A 2j9cA-2dvzA:
1.9
2j9cB-2dvzA:
1.7
2j9cC-2dvzA:
1.5		 2j9cA-2dvzA:
15.71
2j9cB-2dvzA:
15.71
2j9cC-2dvzA:
15.71
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.
2ntb PECTINESTERASE A

(Dickeya
dadantii) 		PF01095
(Pectinesterase) 		4 SER A 195
VAL A 215
SER A 172
VAL A 174
 None
 1.29A 2j9cA-2ntbA:
undetectable
2j9cB-2ntbA:
undetectable
2j9cC-2ntbA:
undetectable		 2j9cA-2ntbA:
16.88
2j9cB-2ntbA:
16.88
2j9cC-2ntbA:
16.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2p2m ACETYL-COENZYME A
SYNTHETASE

(Salmonella
enterica) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C)
PF16177
(ACAS_N) 		4 SER A 180
VAL A 183
SER A 160
VAL A 134
 None
 1.03A 2j9cA-2p2mA:
undetectable
2j9cB-2p2mA:
undetectable
2j9cC-2p2mA:
2.6		 2j9cA-2p2mA:
10.97
2j9cB-2p2mA:
10.97
2j9cC-2p2mA:
10.97
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.
2psf RENILLA-LUCIFERIN
2-MONOOXYGENASE

(Renilla
reniformis) 		PF00561
(Abhydrolase_1) 		4 VAL A 147
SER A 263
VAL A 267
SER A 145
 None
 1.34A 2j9cA-2psfA:
undetectable
2j9cB-2psfA:
undetectable
2j9cC-2psfA:
undetectable		 2j9cA-2psfA:
17.14
2j9cB-2psfA:
17.14
2j9cC-2psfA:
17.14
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.
2vc2 INTEGRIN ALPHA-IIB

(Homo sapiens) 		PF01839
(FG-GAP)
PF13517
(VCBS) 		4 VAL A 239
SER A  96
VAL A  98
SER A 172
 None
 1.25A 2j9cA-2vc2A:
undetectable
2j9cB-2vc2A:
undetectable
2j9cC-2vc2A:
undetectable		 2j9cA-2vc2A:
11.21
2j9cB-2vc2A:
11.21
2j9cC-2vc2A:
11.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vos FOLYLPOLYGLUTAMATE
SYNTHASE PROTEIN
FOLC

(Mycobacterium
tuberculosis) 		PF02875
(Mur_ligase_C)
PF08245
(Mur_ligase_M) 		4 SER A 473
VAL A 383
SER A 410
VAL A 475
 None
 1.15A 2j9cA-2vosA:
undetectable
2j9cB-2vosA:
undetectable
2j9cC-2vosA:
undetectable		 2j9cA-2vosA:
13.50
2j9cB-2vosA:
13.50
2j9cC-2vosA:
13.50
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.
2vun ENAMIDASE

(Eubacterium
barkeri) 		PF01979
(Amidohydro_1) 		4 VAL A 361
SER A  57
VAL A  59
SER A 360
 None
 1.39A 2j9cA-2vunA:
undetectable
2j9cB-2vunA:
undetectable
2j9cC-2vunA:
undetectable		 2j9cA-2vunA:
15.80
2j9cB-2vunA:
15.80
2j9cC-2vunA:
15.80
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.
2wan PULLULANASE

(Bacillus
acidopullulyticus) 		PF00128
(Alpha-amylase)
PF02922
(CBM_48) 		4 SER A 328
VAL A 369
SER A 323
VAL A 321
 None
 1.36A 2j9cA-2wanA:
undetectable
2j9cB-2wanA:
undetectable
2j9cC-2wanA:
undetectable		 2j9cA-2wanA:
8.58
2j9cB-2wanA:
8.58
2j9cC-2wanA:
8.58
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.
2xym RNA-DIRECTED RNA
POLYMERASE

(Hepacivirus C) 		PF00998
(RdRP_3) 		4 SER A 431
VAL A 435
SER A 510
VAL A 507
 None
 1.39A 2j9cA-2xymA:
3.9
2j9cB-2xymA:
3.7
2j9cC-2xymA:
3.5		 2j9cA-2xymA:
11.55
2j9cB-2xymA:
11.55
2j9cC-2xymA:
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.
2ypf AVRBS3

(Xanthomonas
campestris) 		PF03377
(TAL_effector) 		4 VAL A 329
SER A 299
VAL A 295
SER A 333
 None
 1.32A 2j9cA-2ypfA:
undetectable
2j9cB-2ypfA:
undetectable
2j9cC-2ypfA:
undetectable		 2j9cA-2ypfA:
10.07
2j9cB-2ypfA:
10.07
2j9cC-2ypfA:
10.07
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.
2yvx MG2+ TRANSPORTER
MGTE

(Thermus
thermophilus) 		PF00571
(CBS)
PF01769
(MgtE)
PF03448
(MgtE_N) 		4 SER A 371
VAL A 375
SER A 393
VAL A 395
 None
 1.37A 2j9cA-2yvxA:
undetectable
2j9cB-2yvxA:
undetectable
2j9cC-2yvxA:
undetectable		 2j9cA-2yvxA:
14.74
2j9cB-2yvxA:
14.74
2j9cC-2yvxA:
14.74
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.
3b9y AMMONIUM TRANSPORTER
FAMILY RH-LIKE
PROTEIN

(Nitrosomonas
europaea) 		PF00909
(Ammonium_transp) 		4 VAL A 261
SER A 250
VAL A 298
SER A 259
 None
 1.33A 2j9cA-3b9yA:
undetectable
2j9cB-3b9yA:
undetectable
2j9cC-3b9yA:
undetectable		 2j9cA-3b9yA:
14.69
2j9cB-3b9yA:
14.69
2j9cC-3b9yA:
14.69
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.
3cfu UNCHARACTERIZED
LIPOPROTEIN YJHA

(Bacillus
subtilis) 		PF11611
(DUF4352) 		4 SER A 171
VAL A 169
SER A 147
VAL A 145
 None
 1.21A 2j9cA-3cfuA:
undetectable
2j9cB-3cfuA:
undetectable
2j9cC-3cfuA:
undetectable		 2j9cA-3cfuA:
26.04
2j9cB-3cfuA:
26.04
2j9cC-3cfuA:
26.04
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.
3ctm CARBONYL REDUCTASE

(Candida
parapsilosis) 		PF13561
(adh_short_C2) 		4 SER A 166
SER A 259
VAL A 114
SER A 262
 None
 1.24A 2j9cA-3ctmA:
undetectable
2j9cB-3ctmA:
undetectable
2j9cC-3ctmA:
undetectable		 2j9cA-3ctmA:
17.73
2j9cB-3ctmA:
17.73
2j9cC-3ctmA:
17.73
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.
3h14 AMINOTRANSFERASE,
CLASSES I AND II

(Ruegeria
pomeroyi) 		PF00155
(Aminotran_1_2) 		4 SER A 199
VAL A 224
SER A 169
VAL A 167
 None
None
None
GOL  A 502 (-3.9A)
 1.33A 2j9cA-3h14A:
0.5
2j9cB-3h14A:
0.4
2j9cC-3h14A:
undetectable		 2j9cA-3h14A:
14.58
2j9cB-3h14A:
14.58
2j9cC-3h14A:
14.58
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.
3h4y PUTATIVE CHEMOTAXIS
PROTEIN

(Desulfovibrio
vulgaris) 		PF13690
(CheX) 		4 SER A  60
VAL A 150
SER A  46
VAL A  48
 None
 1.26A 2j9cA-3h4yA:
undetectable
2j9cB-3h4yA:
undetectable
2j9cC-3h4yA:
undetectable		 2j9cA-3h4yA:
22.84
2j9cB-3h4yA:
22.84
2j9cC-3h4yA:
22.84
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.
3hbd CLASS IV CHITINASE
CHIA4-PA2

(Picea abies) 		PF00182
(Glyco_hydro_19) 		4 SER A 250
VAL A 227
VAL A 249
SER A 228
 None
 1.19A 2j9cA-3hbdA:
undetectable
2j9cB-3hbdA:
undetectable
2j9cC-3hbdA:
undetectable		 2j9cA-3hbdA:
19.81
2j9cB-3hbdA:
19.81
2j9cC-3hbdA:
19.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hm4 CHEMOTAXIS PROTEIN
CHEX

(Desulfovibrio
alaskensis) 		PF13690
(CheX) 		4 SER A  60
VAL A 150
SER A  46
VAL A  48
 None
None
None
UNL  A 156 (-4.0A)
 1.30A 2j9cA-3hm4A:
undetectable
2j9cB-3hm4A:
1.6
2j9cC-3hm4A:
undetectable		 2j9cA-3hm4A:
23.72
2j9cB-3hm4A:
23.72
2j9cC-3hm4A:
23.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hns CS-35 FAB HEAVY
CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		4 VAL H 171
SER H 181
VAL H 174
SER H 183
 None
 1.08A 2j9cA-3hnsH:
undetectable
2j9cB-3hnsH:
undetectable
2j9cC-3hnsH:
undetectable		 2j9cA-3hnsH:
18.06
2j9cB-3hnsH:
18.06
2j9cC-3hnsH:
18.06
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.
3i50 MURINE HEAVY CHAIN
(IGG3) OF E53
MONOCLONAL ANTIBODY
FAB

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		4 VAL H 166
SER H 176
VAL H 169
SER H 178
 None
 1.17A 2j9cA-3i50H:
undetectable
2j9cB-3i50H:
undetectable
2j9cC-3i50H:
undetectable		 2j9cA-3i50H:
18.05
2j9cB-3i50H:
18.05
2j9cC-3i50H:
18.05
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.
3i9v NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT 3

(Thermus
thermophilus) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4)
PF10588
(NADH-G_4Fe-4S_3)
PF13510
(Fer2_4) 		4 VAL 3  50
SER 3  18
VAL 3  87
SER 3  82
 None
 1.18A 2j9cA-3i9v3:
undetectable
2j9cB-3i9v3:
undetectable
2j9cC-3i9v3:
undetectable		 2j9cA-3i9v3:
11.23
2j9cB-3i9v3:
11.23
2j9cC-3i9v3:
11.23
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.
3ihw CENTG3

(Homo sapiens) 		PF00071
(Ras) 		4 VAL A 163
SER A 105
VAL A 108
SER A 102
 None
 1.30A 2j9cA-3ihwA:
undetectable
2j9cB-3ihwA:
undetectable
2j9cC-3ihwA:
undetectable		 2j9cA-3ihwA:
21.39
2j9cB-3ihwA:
21.39
2j9cC-3ihwA:
21.39
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.
3k2b GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE
A, CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		4 SER A 177
VAL A 232
SER A 280
VAL A 237
 None
 1.40A 2j9cA-3k2bA:
2.0
2j9cB-3k2bA:
1.9
2j9cC-3k2bA:
1.9		 2j9cA-3k2bA:
16.08
2j9cB-3k2bA:
16.08
2j9cC-3k2bA:
16.08
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.
3l6g BETAINE ABC
TRANSPORTER PERMEASE
AND SUBSTRATE
BINDING PROTEIN

(Lactococcus
lactis) 		PF04069
(OpuAC) 		4 SER A 336
VAL A 374
SER A 332
SER A 375
 None
 1.27A 2j9cA-3l6gA:
undetectable
2j9cB-3l6gA:
undetectable
2j9cC-3l6gA:
undetectable		 2j9cA-3l6gA:
19.76
2j9cB-3l6gA:
19.76
2j9cC-3l6gA:
19.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3l6g BETAINE ABC
TRANSPORTER PERMEASE
AND SUBSTRATE
BINDING PROTEIN

(Lactococcus
lactis) 		PF04069
(OpuAC) 		4 SER A 375
SER A 336
VAL A 374
SER A 332
 None
 1.28A 2j9cA-3l6gA:
undetectable
2j9cB-3l6gA:
undetectable
2j9cC-3l6gA:
undetectable		 2j9cA-3l6gA:
19.76
2j9cB-3l6gA:
19.76
2j9cC-3l6gA:
19.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lpd ACIDIC EXTRACELLULAR
SUBTILISIN-LIKE
PROTEASE APRV2

(Dichelobacter
nodosus) 		PF00082
(Peptidase_S8) 		4 VAL A 297
SER A 292
VAL A 290
SER A 296
 None
 1.30A 2j9cA-3lpdA:
undetectable
2j9cB-3lpdA:
undetectable
2j9cC-3lpdA:
undetectable		 2j9cA-3lpdA:
16.81
2j9cB-3lpdA:
16.81
2j9cC-3lpdA:
16.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mgx PUTATIVE P450
MONOOXYGENASE

(Amycolatopsis
balhimycina) 		PF00067
(p450) 		4 SER A  47
VAL A 307
SER A  36
VAL A  34
 None
 1.14A 2j9cA-3mgxA:
undetectable
2j9cB-3mgxA:
undetectable
2j9cC-3mgxA:
undetectable		 2j9cA-3mgxA:
14.29
2j9cB-3mgxA:
14.29
2j9cC-3mgxA:
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.
3ouu BIOTIN CARBOXYLASE

(Campylobacter
jejuni) 		PF00289
(Biotin_carb_N)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		4 SER A 301
VAL A 225
SER A 243
VAL A 300
 None
 1.28A 2j9cA-3ouuA:
undetectable
2j9cB-3ouuA:
undetectable
2j9cC-3ouuA:
undetectable		 2j9cA-3ouuA:
15.47
2j9cB-3ouuA:
15.47
2j9cC-3ouuA:
15.47
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.
3ppc 5-METHYLTETRAHYDROPT
EROYLTRIGLUTAMATE--H
OMOCYSTEINE
METHYLTRANSFERASE

(Candida
albicans) 		PF01717
(Meth_synt_2)
PF08267
(Meth_synt_1) 		4 SER A   5
VAL A 332
VAL A   6
SER A 298
 None
 1.17A 2j9cA-3ppcA:
undetectable
2j9cB-3ppcA:
undetectable
2j9cC-3ppcA:
undetectable		 2j9cA-3ppcA:
10.28
2j9cB-3ppcA:
10.28
2j9cC-3ppcA:
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.
3rmt 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE 1

(Bacillus
halodurans) 		PF00275
(EPSP_synthase) 		4 SER A 166
VAL A 190
SER A 170
VAL A 168
 None
 1.22A 2j9cA-3rmtA:
undetectable
2j9cB-3rmtA:
undetectable
2j9cC-3rmtA:
undetectable		 2j9cA-3rmtA:
14.73
2j9cB-3rmtA:
14.73
2j9cC-3rmtA:
14.73
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.
3rwk INULINASE

(Aspergillus
ficuum) 		PF00251
(Glyco_hydro_32N)
PF08244
(Glyco_hydro_32C) 		4 VAL X 513
SER X 366
VAL X 510
SER X 364
 None
 1.36A 2j9cA-3rwkX:
undetectable
2j9cB-3rwkX:
undetectable
2j9cC-3rwkX:
undetectable		 2j9cA-3rwkX:
10.81
2j9cB-3rwkX:
10.81
2j9cC-3rwkX:
10.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3u0b OXIDOREDUCTASE,
SHORT CHAIN
DEHYDROGENASE/REDUCT
ASE FAMILY PROTEIN

(Mycolicibacterium
smegmatis) 		PF13561
(adh_short_C2) 		4 SER A 155
VAL A 185
VAL A 116
SER A 182
 None
 1.33A 2j9cA-3u0bA:
undetectable
2j9cB-3u0bA:
undetectable
2j9cC-3u0bA:
undetectable		 2j9cA-3u0bA:
12.78
2j9cB-3u0bA:
12.78
2j9cC-3u0bA:
12.78
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.
3ugm TAL EFFECTOR
AVRBS3/PTHA

(Xanthomonas
oryzae) 		PF03377
(TAL_effector) 		4 VAL A 363
SER A 333
VAL A 329
SER A 367
 None
 1.05A 2j9cA-3ugmA:
undetectable
2j9cB-3ugmA:
undetectable
2j9cC-3ugmA:
undetectable		 2j9cA-3ugmA:
7.05
2j9cB-3ugmA:
7.05
2j9cC-3ugmA:
7.05
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.
3ugm TAL EFFECTOR
AVRBS3/PTHA

(Xanthomonas
oryzae) 		PF03377
(TAL_effector) 		4 VAL A 668
SER A 638
VAL A 634
SER A 672
 None
 1.18A 2j9cA-3ugmA:
undetectable
2j9cB-3ugmA:
undetectable
2j9cC-3ugmA:
undetectable		 2j9cA-3ugmA:
7.05
2j9cB-3ugmA:
7.05
2j9cC-3ugmA:
7.05
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.
3ugm TAL EFFECTOR
AVRBS3/PTHA

(Xanthomonas
oryzae) 		PF03377
(TAL_effector) 		4 VAL A 736
SER A 706
VAL A 702
SER A 740
 None
 1.11A 2j9cA-3ugmA:
undetectable
2j9cB-3ugmA:
undetectable
2j9cC-3ugmA:
undetectable		 2j9cA-3ugmA:
7.05
2j9cB-3ugmA:
7.05
2j9cC-3ugmA:
7.05
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.
3vom PUTATIVE
PHOSPHOSERINE
AMINOTRANSFERASE

(Mycobacterium
tuberculosis) 		PF00266
(Aminotran_5) 		4 SER A 309
VAL A 158
SER A 179
VAL A 311
 None
None
PLP  A 401 ( 3.9A)
None
 1.35A 2j9cA-3vomA:
undetectable
2j9cB-3vomA:
undetectable
2j9cC-3vomA:
undetectable		 2j9cA-3vomA:
15.31
2j9cB-3vomA:
15.31
2j9cC-3vomA:
15.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3whe IMMUNOGLOBULIN HEAVY
CHAIN

(Homo sapiens) 		no annotation 4 SER M 190
VAL M 182
SER M 192
VAL M 155
 None
 1.26A 2j9cA-3wheM:
undetectable
2j9cB-3wheM:
undetectable
2j9cC-3wheM:
undetectable		 2j9cA-3wheM:
18.34
2j9cB-3wheM:
18.34
2j9cC-3wheM:
18.34
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.
3whs GAMMA-GLUTAMYLTRANSP
EPTIDASE SMALL CHAIN

(Bacillus
subtilis) 		PF01019
(G_glu_transpept) 		4 VAL B 481
SER B 559
VAL B 478
SER B 557
 None
 0.99A 2j9cA-3whsB:
undetectable
2j9cB-3whsB:
undetectable
2j9cC-3whsB:
undetectable		 2j9cA-3whsB:
20.42
2j9cB-3whsB:
20.42
2j9cC-3whsB:
20.42
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.
3zef PRE-MRNA-SPLICING
FACTOR 8

(Saccharomyces
cerevisiae) 		PF08084
(PROCT)
PF10596
(U6-snRNA_bdg)
PF10597
(U5_2-snRNA_bdg)
PF10598
(RRM_4)
PF12134
(PRP8_domainIV) 		4 VAL B1304
SER B1261
VAL B1267
SER B1305
 None
 1.12A 2j9cA-3zefB:
1.3
2j9cB-3zefB:
1.1
2j9cC-3zefB:
undetectable		 2j9cA-3zefB:
6.30
2j9cB-3zefB:
6.30
2j9cC-3zefB:
6.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bms ALCLOHOL
DEHYDROGENASE/SHORT-
CHAIN DEHYDROGENASE

(Ralstonia sp.
DSMZ 6428) 		PF13561
(adh_short_C2) 		4 VAL A 235
SER A 131
VAL A 175
SER A 232
 None
 1.19A 2j9cA-4bmsA:
undetectable
2j9cB-4bmsA:
undetectable
2j9cC-4bmsA:
undetectable		 2j9cA-4bmsA:
19.48
2j9cB-4bmsA:
19.48
2j9cC-4bmsA:
19.48
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.
4eqq PUTATIVE HOST CELL
SURFACE-EXPOSED
LIPOPROTEIN

(Streptococcus
phage TP-J34) 		PF07553
(Lipoprotein_Ltp) 		4 SER A  86
VAL A  90
SER A  73
VAL A  76
 None
 1.40A 2j9cA-4eqqA:
undetectable
2j9cB-4eqqA:
undetectable
2j9cC-4eqqA:
undetectable		 2j9cA-4eqqA:
21.49
2j9cB-4eqqA:
21.49
2j9cC-4eqqA:
21.49
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.
4fs3 ENOYL-[ACYL-CARRIER-
PROTEIN] REDUCTASE
[NADPH] FABI

(Staphylococcus
aureus) 		PF13561
(adh_short_C2) 		4 VAL A 241
SER A 141
VAL A 185
SER A 238
 None
 1.21A 2j9cA-4fs3A:
undetectable
2j9cB-4fs3A:
undetectable
2j9cC-4fs3A:
undetectable		 2j9cA-4fs3A:
24.00
2j9cB-4fs3A:
24.00
2j9cC-4fs3A:
24.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gjp HAX3

(Xanthomonas
campestris) 		PF03377
(TAL_effector) 		4 VAL A 329
SER A 299
VAL A 295
SER A 333
 None
 1.17A 2j9cA-4gjpA:
undetectable
2j9cB-4gjpA:
undetectable
2j9cC-4gjpA:
undetectable		 2j9cA-4gjpA:
14.23
2j9cB-4gjpA:
14.23
2j9cC-4gjpA:
14.23
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.
4hk1 PROLIFERATING CELL
NUCLEAR ANTIGEN

(Drosophila
melanogaster) 		PF00705
(PCNA_N)
PF02747
(PCNA_C) 		4 SER A 228
VAL A 236
SER A 134
VAL A 136
 None
 1.40A 2j9cA-4hk1A:
undetectable
2j9cB-4hk1A:
undetectable
2j9cC-4hk1A:
undetectable		 2j9cA-4hk1A:
16.79
2j9cB-4hk1A:
16.79
2j9cC-4hk1A:
16.79
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.
4hpz DTALE2

(Xanthomonas) 		PF03377
(TAL_effector) 		4 VAL A 397
SER A 367
VAL A 363
SER A 401
 None
 1.19A 2j9cA-4hpzA:
undetectable
2j9cB-4hpzA:
undetectable
2j9cC-4hpzA:
undetectable		 2j9cA-4hpzA:
14.00
2j9cB-4hpzA:
14.00
2j9cC-4hpzA:
14.00
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.
4k25 PROBABLE TRNA
THREONYLCARBAMOYLADE
NOSINE BIOSYNTHESIS
PROTEIN QRI7,
MITOCHONDRIAL

(Saccharomyces
cerevisiae) 		PF00814
(Peptidase_M22) 		4 SER A 168
VAL A 179
SER A 323
VAL A 321
 None
 1.00A 2j9cA-4k25A:
undetectable
2j9cB-4k25A:
undetectable
2j9cC-4k25A:
undetectable		 2j9cA-4k25A:
16.18
2j9cB-4k25A:
16.18
2j9cC-4k25A:
16.18
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.
4kw7 ARSENIC
METHYLTRANSFERASE

(Cyanidioschyzon
sp. 5508) 		PF13847
(Methyltransf_31) 		4 VAL A 128
SER A 102
VAL A  98
SER A 142
 None
 1.36A 2j9cA-4kw7A:
undetectable
2j9cB-4kw7A:
undetectable
2j9cC-4kw7A:
undetectable		 2j9cA-4kw7A:
18.23
2j9cB-4kw7A:
18.23
2j9cC-4kw7A:
18.23
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.
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida) 		PF00171
(Aldedh) 		4 SER A 431
VAL A 452
SER A 272
VAL A 274
 None
 1.34A 2j9cA-4qyjA:
undetectable
2j9cB-4qyjA:
undetectable
2j9cC-4qyjA:
undetectable		 2j9cA-4qyjA:
13.83
2j9cB-4qyjA:
13.83
2j9cC-4qyjA:
13.83
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.
4rlt (3R)-HYDROXYACYL-ACP
DEHYDRATASE SUBUNIT
HADB

(Mycobacterium
tuberculosis) 		PF01575
(MaoC_dehydratas) 		4 SER B 110
SER B 117
VAL B 111
SER B 138
 None
 1.38A 2j9cA-4rltB:
undetectable
2j9cB-4rltB:
undetectable
2j9cC-4rltB:
undetectable		 2j9cA-4rltB:
26.42
2j9cB-4rltB:
26.42
2j9cC-4rltB:
26.42
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.
4s1v D-3-PHOSPHOGLYCERATE
DEHYDROGENASE-RELATE
D PROTEIN

(Vibrio cholerae) 		no annotation 4 VAL D 234
SER D 237
VAL D 263
SER D 206
 None
 1.14A 2j9cA-4s1vD:
undetectable
2j9cB-4s1vD:
undetectable
2j9cC-4s1vD:
undetectable		 2j9cA-4s1vD:
17.52
2j9cB-4s1vD:
17.52
2j9cC-4s1vD:
17.52
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.
4ut1 FLAGELLAR
HOOK-ASSOCIATED
PROTEIN

(Burkholderia
pseudomallei) 		PF06429
(Flg_bbr_C) 		4 SER A 224
VAL A 235
SER A 219
VAL A 217
 None
 1.35A 2j9cA-4ut1A:
undetectable
2j9cB-4ut1A:
undetectable
2j9cC-4ut1A:
undetectable		 2j9cA-4ut1A:
8.79
2j9cB-4ut1A:
8.79
2j9cC-4ut1A:
8.79
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.
4yfl 1B2530 HEAVY CHAIN

(Homo sapiens) 		no annotation 4 SER H 189
VAL H 181
SER H 191
VAL H 154
 None
 1.34A 2j9cA-4yflH:
undetectable
2j9cB-4yflH:
undetectable
2j9cC-4yflH:
undetectable		 2j9cA-4yflH:
13.91
2j9cB-4yflH:
13.91
2j9cC-4yflH:
13.91
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.
5dld UDP-N-ACETYLGLUCOSAM
INE 2-EPIMERASE

(Burkholderia
vietnamiensis) 		PF02350
(Epimerase_2) 		4 SER A 104
VAL A 142
VAL A 103
SER A 143
 None
 1.16A 2j9cA-5dldA:
undetectable
2j9cB-5dldA:
undetectable
2j9cC-5dldA:
undetectable		 2j9cA-5dldA:
14.29
2j9cB-5dldA:
14.29
2j9cC-5dldA:
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.
5e7p CELL DIVISION
CONTROL PROTEIN
CDC48

(Mycolicibacterium
smegmatis) 		PF00004
(AAA)
PF02359
(CDC48_N) 		4 SER A 112
VAL A 183
SER A 198
VAL A 196
 None
 1.35A 2j9cA-5e7pA:
undetectable
2j9cB-5e7pA:
undetectable
2j9cC-5e7pA:
undetectable		 2j9cA-5e7pA:
9.77
2j9cB-5e7pA:
9.77
2j9cC-5e7pA:
9.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ejd TQAA

(Penicillium
aethiopicum) 		PF00550
(PP-binding) 		4 VAL A  74
SER A  69
VAL A  67
SER A  73
 None
 1.19A 2j9cA-5ejdA:
undetectable
2j9cB-5ejdA:
undetectable
2j9cC-5ejdA:
undetectable		 2j9cA-5ejdA:
18.58
2j9cB-5ejdA:
18.58
2j9cC-5ejdA:
18.58
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.
5ewo STRUCTURAL PROTEIN

(Mamastrovirus 1) 		PF12226
(Astro_capsid_p) 		4 SER A 594
VAL A 609
SER A 537
VAL A 535
 None
 1.40A 2j9cA-5ewoA:
undetectable
2j9cB-5ewoA:
undetectable
2j9cC-5ewoA:
undetectable		 2j9cA-5ewoA:
18.06
2j9cB-5ewoA:
18.06
2j9cC-5ewoA:
18.06
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.
5fzp DISPASE
AUTOLYSIS-INDUCING
PROTEIN

(Streptomyces
mobaraensis) 		no annotation 4 VAL A 229
SER A 282
VAL A 288
SER A 223
 None
 1.20A 2j9cA-5fzpA:
undetectable
2j9cB-5fzpA:
undetectable
2j9cC-5fzpA:
undetectable		 2j9cA-5fzpA:
16.86
2j9cB-5fzpA:
16.86
2j9cC-5fzpA:
16.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5h8k N-CARBAMOYLPUTRESCIN
E AMIDOHYDROLASE

(Medicago
truncatula) 		PF00795
(CN_hydrolase) 		4 SER A  12
VAL A 215
VAL A 260
SER A 217
 None
 1.32A 2j9cA-5h8kA:
undetectable
2j9cB-5h8kA:
undetectable
2j9cC-5h8kA:
undetectable		 2j9cA-5h8kA:
17.76
2j9cB-5h8kA:
17.76
2j9cC-5h8kA:
17.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jjt SERINE/THREONINE-PRO
TEIN PHOSPHATASE 5

(Arabidopsis
thaliana) 		PF00149
(Metallophos)
PF00515
(TPR_1)
PF08321
(PPP5)
PF13431
(TPR_17) 		4 SER A 433
VAL A 431
VAL A 229
SER A 412
 None
 1.06A 2j9cA-5jjtA:
undetectable
2j9cB-5jjtA:
undetectable
2j9cC-5jjtA:
undetectable		 2j9cA-5jjtA:
13.12
2j9cB-5jjtA:
13.12
2j9cC-5jjtA:
13.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5m2o PUTATIVE
CELLULOSOMAL
SCAFFOLDIN PROTEIN
GROUP I DOCKERIN

(Ruminococcus
flavefaciens;
Ruminococcus
flavefaciens) 		PF00963
(Cohesin)
no annotation 		4 SER A  37
VAL A 120
SER B  40
VAL B  43
 None
 1.39A 2j9cA-5m2oA:
undetectable
2j9cB-5m2oA:
undetectable
2j9cC-5m2oA:
undetectable		 2j9cA-5m2oA:
22.58
2j9cB-5m2oA:
22.58
2j9cC-5m2oA:
22.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5m38 OMPA FAMILY PROTEIN

(Escherichia
coli) 		no annotation 4 SER A 111
VAL A   3
SER A  44
VAL A  42
 None
 1.12A 2j9cA-5m38A:
undetectable
2j9cB-5m38A:
undetectable
2j9cC-5m38A:
undetectable		 2j9cA-5m38A:
undetectable
2j9cB-5m38A:
undetectable
2j9cC-5m38A:
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.
5mz9 -

(-) 		no annotation 4 SER A 767
VAL A 765
SER A 711
VAL A 737
 None
 1.24A 2j9cA-5mz9A:
undetectable
2j9cB-5mz9A:
undetectable
2j9cC-5mz9A:
undetectable		 2j9cA-5mz9A:
undetectable
2j9cB-5mz9A:
undetectable
2j9cC-5mz9A:
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.
5nc6 PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE

(Bacillus cereus) 		no annotation 4 VAL A 216
SER A 236
VAL A 240
SER A 195
 None
 1.28A 2j9cA-5nc6A:
undetectable
2j9cB-5nc6A:
undetectable
2j9cC-5nc6A:
undetectable		 2j9cA-5nc6A:
undetectable
2j9cB-5nc6A:
undetectable
2j9cC-5nc6A:
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.
5ndz LYSOZYME,PROTEINASE-
ACTIVATED RECEPTOR
2,SOLUBLE CYTOCHROME
B562,PROTEINASE-ACTI
VATED RECEPTOR 2

(Escherichia
coli;
Homo sapiens;
Escherichia
virus T4) 		PF00001
(7tm_1)
PF00959
(Phage_lysozyme)
PF07361
(Cytochrom_B562) 		4 VAL A 322
SER A  65
VAL A  68
SER A 320
 None
 1.19A 2j9cA-5ndzA:
undetectable
2j9cB-5ndzA:
undetectable
2j9cC-5ndzA:
undetectable		 2j9cA-5ndzA:
12.34
2j9cB-5ndzA:
12.34
2j9cC-5ndzA:
12.34
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.
5nj6 PROTEINASE-ACTIVATED
RECEPTOR 2,SOLUBLE
CYTOCHROME
B562,PROTEINASE-ACTI
VATED RECEPTOR 2

(Escherichia
coli;
Homo sapiens) 		PF00001
(7tm_1)
PF07361
(Cytochrom_B562) 		4 VAL A 322
SER A  65
VAL A  68
SER A 320
 None
 1.21A 2j9cA-5nj6A:
undetectable
2j9cB-5nj6A:
undetectable
2j9cC-5nj6A:
undetectable		 2j9cA-5nj6A:
13.50
2j9cB-5nj6A:
13.50
2j9cC-5nj6A:
13.50
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.
5opg ENVELOPE
GLYCOPROTEIN GN

(Hantaan
orthohantavirus) 		PF01567
(Hanta_G1) 		4 SER A 339
VAL A 337
SER A 323
SER A 326
 None
 1.15A 2j9cA-5opgA:
undetectable
2j9cB-5opgA:
undetectable
2j9cC-5opgA:
undetectable		 2j9cA-5opgA:
16.09
2j9cB-5opgA:
16.09
2j9cC-5opgA:
16.09
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.
5ovv SH3 AND MULTIPLE
ANKYRIN REPEAT
DOMAINS PROTEIN 3

(Rattus
norvegicus) 		no annotation 4 SER A 672
VAL A 670
VAL A 673
SER A 579
 None
 1.11A 2j9cA-5ovvA:
undetectable
2j9cB-5ovvA:
undetectable
2j9cC-5ovvA:
undetectable		 2j9cA-5ovvA:
undetectable
2j9cB-5ovvA:
undetectable
2j9cC-5ovvA:
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.
5tnx ALCOHOL
DEHYDROGENASE
ZINC-BINDING DOMAIN
PROTEIN

(Burkholderia
ambifaria) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		4 VAL A 210
SER A 268
VAL A 205
SER A 199
 None
None
CIT  A 401 (-3.7A)
None
 1.39A 2j9cA-5tnxA:
undetectable
2j9cB-5tnxA:
undetectable
2j9cC-5tnxA:
undetectable		 2j9cA-5tnxA:
16.25
2j9cB-5tnxA:
16.25
2j9cC-5tnxA:
16.25
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.
5ud6 DIHYDRODIPICOLINATE
SYNTHASE

(Cyanidioschyzon
merolae) 		no annotation 4 SER A 217
VAL A  14
VAL A 218
SER A  46
 None
 1.33A 2j9cA-5ud6A:
undetectable
2j9cB-5ud6A:
undetectable
2j9cC-5ud6A:
undetectable		 2j9cA-5ud6A:
undetectable
2j9cB-5ud6A:
undetectable
2j9cC-5ud6A:
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.
5wdh KINESIN-LIKE PROTEIN
KIFC1

(Homo sapiens) 		PF00225
(Kinesin) 		4 VAL A 462
SER A 562
VAL A 564
SER A 460
 None
 1.35A 2j9cA-5wdhA:
undetectable
2j9cB-5wdhA:
undetectable
2j9cC-5wdhA:
undetectable		 2j9cA-5wdhA:
14.64
2j9cB-5wdhA:
14.64
2j9cC-5wdhA:
14.64
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.
5xcc PROBABLE SURFACE
PROTEIN

(Clostridium
perfringens) 		no annotation 4 SER A 325
SER A 140
VAL A 322
SER A 143
 None
 1.35A 2j9cA-5xccA:
2.2
2j9cB-5xccA:
1.7
2j9cC-5xccA:
2.3		 2j9cA-5xccA:
undetectable
2j9cB-5xccA:
undetectable
2j9cC-5xccA:
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.
5zgb LHCR1
PSAF

(Cyanidioschyzon
merolae;
Cyanidioschyzon
merolae) 		no annotation
no annotation 		4 SER F 156
VAL F 124
VAL 1 107
SER F 127
 None
CLA  F 302 ( 4.8A)
None
None
 1.34A 2j9cA-5zgbF:
undetectable
2j9cB-5zgbF:
undetectable
2j9cC-5zgbF:
undetectable		 2j9cA-5zgbF:
undetectable
2j9cB-5zgbF:
undetectable
2j9cC-5zgbF:
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.
6b0n PGV19 FAB HEAVY
CHAIN

(Homo sapiens) 		no annotation 4 SER D 177
VAL D 169
SER D 179
VAL D 142
 None
 1.24A 2j9cA-6b0nD:
undetectable
2j9cB-6b0nD:
undetectable
2j9cC-6b0nD:
undetectable		 2j9cA-6b0nD:
undetectable
2j9cB-6b0nD:
undetectable
2j9cC-6b0nD:
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.
6b2b MONOBODY

(Homo sapiens) 		no annotation 4 SER C   4
SER C  79
VAL C  28
SER C  85
 None
 1.31A 2j9cA-6b2bC:
undetectable
2j9cB-6b2bC:
undetectable
2j9cC-6b2bC:
undetectable		 2j9cA-6b2bC:
27.72
2j9cB-6b2bC:
27.72
2j9cC-6b2bC:
27.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6b2b MONOBODY

(Homo sapiens) 		no annotation 4 SER C  79
VAL C  28
SER C  85
SER C   4
 None
 1.33A 2j9cA-6b2bC:
undetectable
2j9cB-6b2bC:
undetectable
2j9cC-6b2bC:
undetectable		 2j9cA-6b2bC:
27.72
2j9cB-6b2bC:
27.72
2j9cC-6b2bC:
27.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6b5i RETINAL
DEHYDROGENASE 2

(Homo sapiens) 		no annotation 4 VAL A 446
SER A 324
VAL A 312
SER A 291
 None
 1.37A 2j9cA-6b5iA:
undetectable
2j9cB-6b5iA:
undetectable
2j9cC-6b5iA:
undetectable		 2j9cA-6b5iA:
undetectable
2j9cB-6b5iA:
undetectable
2j9cC-6b5iA:
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.
6c14


(;
) 		no annotation
no annotation 		4 SER B  22
VAL A1400
VAL B  19
SER A1403
 None
 1.21A 2j9cA-6c14B:
undetectable
2j9cB-6c14B:
undetectable
2j9cC-6c14B:
undetectable		 2j9cA-6c14B:
undetectable
2j9cB-6c14B:
undetectable
2j9cC-6c14B:
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.
6fkh ATP SYNTHASE SUBUNIT
A, CHLOROPLASTIC

(Spinacia
oleracea) 		no annotation 4 SER a  43
VAL a  46
VAL a  39
SER a 108
 None
 1.22A 2j9cA-6fkha:
undetectable
2j9cB-6fkha:
undetectable
2j9cC-6fkha:
undetectable		 2j9cA-6fkha:
undetectable
2j9cB-6fkha:
undetectable
2j9cC-6fkha:
undetectable