SIMILAR PATTERNS OF AMINO ACIDS FOR 4LJ0_A_ACTA505_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.
1amy 1,4-ALPHA-D-GLUCAN
GLUCANOHYDROLASE

(Hordeum vulgare) 		PF00128
(Alpha-amylase)
PF07821
(Alpha-amyl_C2) 		3 LEU A 252
LYS A 249
THR A 248
 None
 0.55A 4lj0A-1amyA:
0.0		 4lj0A-1amyA:
9.97
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.
1c7j PROTEIN
(PARA-NITROBENZYL
ESTERASE)

(Bacillus
subtilis) 		PF00135
(COesterase) 		3 LEU A 279
LYS A 223
THR A 222
 None
 0.63A 4lj0A-1c7jA:
0.0		 4lj0A-1c7jA:
7.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ccw PROTEIN (GLUTAMATE
MUTASE)

(Clostridium
cochlearium) 		PF06368
(Met_asp_mut_E) 		3 LEU B 380
LYS B 377
THR B 376
 None
 0.52A 4lj0A-1ccwB:
0.0		 4lj0A-1ccwB:
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.
1f8r L-AMINO ACID OXIDASE

(Calloselasma
rhodostoma) 		PF01593
(Amino_oxidase) 		3 LEU A 189
LYS A 186
THR A 185
 None
 0.62A 4lj0A-1f8rA:
0.0		 4lj0A-1f8rA:
7.57
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.
1gl2 VESICLE TRANSPORT
V-SNARE PROTEIN
VTI1-LIKE 1

(Mus musculus) 		PF12352
(V-SNARE_C) 		3 LEU C 181
LYS C 178
THR C 177
 None
 0.62A 4lj0A-1gl2C:
0.0		 4lj0A-1gl2C:
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.
1gso PROTEIN (GLYCINAMIDE
RIBONUCLEOTIDE
SYNTHETASE)

(Escherichia
coli) 		PF01071
(GARS_A)
PF02843
(GARS_C)
PF02844
(GARS_N) 		3 LEU A 112
LYS A 109
THR A 108
 None
 0.57A 4lj0A-1gsoA:
0.0		 4lj0A-1gsoA:
8.91
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.
1khd ANTHRANILATE
PHOSPHORIBOSYLTRANSF
ERASE

(Pectobacterium
carotovorum) 		PF00591
(Glycos_transf_3)
PF02885
(Glycos_trans_3N) 		3 LEU A 181
LYS A 182
THR A 183
 None
 0.49A 4lj0A-1khdA:
0.0		 4lj0A-1khdA:
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.
1kop CARBONIC ANHYDRASE

(Neisseria
gonorrhoeae) 		PF00194
(Carb_anhydrase) 		3 LEU A 190
LYS A 191
THR A 192
 None
 0.59A 4lj0A-1kopA:
0.0		 4lj0A-1kopA:
15.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1l8w VLSE1

(Borreliella
burgdorferi) 		PF00921
(Lipoprotein_2) 		3 LEU A  88
LYS A  85
THR A  84
 None
 0.60A 4lj0A-1l8wA:
undetectable		 4lj0A-1l8wA:
10.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1m7k SILENCER OF DEATH
DOMAINS

(Homo sapiens) 		PF02179
(BAG) 		3 LEU A 421
LYS A 418
THR A 417
 None
 0.57A 4lj0A-1m7kA:
undetectable		 4lj0A-1m7kA:
16.00
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.
1mec MENGO VIRUS COAT
PROTEIN (SUBUNIT
VP1)

(Cardiovirus A) 		no annotation 3 LEU 1 106
LYS 1 107
THR 1 108
 None
 0.55A 4lj0A-1mec1:
undetectable		 4lj0A-1mec1:
15.09
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.
1nd7 WW DOMAIN-CONTAINING
PROTEIN 1

(Homo sapiens) 		PF00632
(HECT) 		3 LEU A 777
LYS A 774
THR A 773
 None
 0.59A 4lj0A-1nd7A:
undetectable		 4lj0A-1nd7A:
10.14
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.
1nlw MAD PROTEIN

(Homo sapiens) 		PF00010
(HLH) 		3 LEU A  48
LYS A  45
THR A  44
 None
 0.53A 4lj0A-1nlwA:
undetectable		 4lj0A-1nlwA:
13.75
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.
1p9b ADENYLOSUCCINATE
SYNTHETASE

(Plasmodium
falciparum) 		PF00709
(Adenylsucc_synt) 		3 LEU A 417
LYS A 418
THR A 419
 None
 0.61A 4lj0A-1p9bA:
undetectable		 4lj0A-1p9bA:
7.64
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.
1plf PLATELET FACTOR 4

(Bos taurus) 		PF00048
(IL8) 		3 LEU A  60
LYS A  61
THR A  62
 None
 0.56A 4lj0A-1plfA:
undetectable		 4lj0A-1plfA:
25.33
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.
1si1 IRON BINDING PROTEIN
FBPA

(Mannheimia
haemolytica) 		PF13343
(SBP_bac_6) 		3 LEU A 163
LYS A 160
THR A 159
 None
 0.60A 4lj0A-1si1A:
undetectable		 4lj0A-1si1A:
9.89
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.
1tcd TRIOSEPHOSPHATE
ISOMERASE

(Trypanosoma
cruzi) 		PF00121
(TIM) 		3 LEU A  56
LYS A  53
THR A  52
 None
 0.56A 4lj0A-1tcdA:
undetectable		 4lj0A-1tcdA:
17.33
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.
1v6a L-LACTATE
DEHYDROGENASE A
CHAIN

(Cyprinus carpio) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		3 LEU A  72
LYS A  73
THR A  74
 None
 0.59A 4lj0A-1v6aA:
undetectable		 4lj0A-1v6aA:
12.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ab4 TRNA PSEUDOURIDINE
SYNTHASE B

(Thermotoga
maritima) 		PF01472
(PUA)
PF01509
(TruB_N)
PF16198
(TruB_C_2) 		3 LEU A 243
LYS A 240
THR A 239
 None
 0.52A 4lj0A-2ab4A:
undetectable		 4lj0A-2ab4A:
9.86
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.
2f5g TRANSPOSASE,
PUTATIVE

(Sulfolobus
solfataricus) 		PF01797
(Y1_Tnp) 		3 LEU A  40
LYS A  37
THR A  36
 None
 0.60A 4lj0A-2f5gA:
undetectable		 4lj0A-2f5gA:
19.23
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.
2gfq UPF0204 PROTEIN
PH0006

(Pyrococcus
horikoshii) 		PF04414
(tRNA_deacylase) 		3 LEU A 209
LYS A 206
THR A 205
 None
 0.45A 4lj0A-2gfqA:
undetectable		 4lj0A-2gfqA:
12.04
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.
2inr DNA TOPOISOMERASE 4
SUBUNIT A

(Staphylococcus
aureus) 		PF00521
(DNA_topoisoIV) 		3 LEU A 366
LYS A 363
THR A 362
 None
 0.59A 4lj0A-2inrA:
undetectable		 4lj0A-2inrA:
9.15
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.
2kin KINESIN

(Rattus
norvegicus) 		PF00225
(Kinesin) 		3 LEU B 318
LYS B 315
THR B 314
 None
 0.63A 4lj0A-2kinB:
undetectable		 4lj0A-2kinB:
20.21
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.
2qps ALPHA-AMYLASE TYPE A
ISOZYME

(Hordeum vulgare) 		PF00128
(Alpha-amylase)
PF07821
(Alpha-amyl_C2) 		3 LEU A 254
LYS A 251
THR A 250
 None
 0.60A 4lj0A-2qpsA:
undetectable		 4lj0A-2qpsA:
10.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2v65 L-LACTATE
DEHYDROGENASE A
CHAIN

(Champsocephalus
gunnari) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		3 LEU A   7
LYS A   4
THR A   3
 None
 0.58A 4lj0A-2v65A:
undetectable		 4lj0A-2v65A:
10.84
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.
2v65 L-LACTATE
DEHYDROGENASE A
CHAIN

(Champsocephalus
gunnari) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		3 LEU A  73
LYS A  74
THR A  75
 None
 0.39A 4lj0A-2v65A:
undetectable		 4lj0A-2v65A:
10.84
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.
2vre DELTA(3,5)-DELTA(2,4
)-DIENOYL-COA
ISOMERASE

(Homo sapiens) 		PF00378
(ECH_1) 		3 LEU A 253
LYS A 250
THR A 249
 None
 0.61A 4lj0A-2vreA:
undetectable		 4lj0A-2vreA:
12.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2x2g TRIOSEPHOSPHATE
ISOMERASE,
GLYCOSOMAL

(Trypanosoma
brucei) 		PF00121
(TIM) 		3 LEU A  55
LYS A  52
THR A  51
 None
 0.55A 4lj0A-2x2gA:
undetectable		 4lj0A-2x2gA:
14.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yp2 HEMAGGLUTININ

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		3 LEU A 455
LYS A 452
THR A 451
 None
 0.54A 4lj0A-2yp2A:
undetectable		 4lj0A-2yp2A:
8.08
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.
3all 2-METHYL-3-HYDROXYPY
RIDINE-5-CARBOXYLIC
ACID OXYGENASE

(Mesorhizobium
japonicum) 		PF01494
(FAD_binding_3) 		3 LEU A 262
LYS A 263
THR A 264
 None
 0.51A 4lj0A-3allA:
undetectable		 4lj0A-3allA:
11.27
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.
3ch0 GLYCEROPHOSPHODIESTE
R PHOSPHODIESTERASE

(Cytophaga
hutchinsonii) 		PF03009
(GDPD) 		3 LEU A  33
LYS A  30
THR A  29
 None
EDO  A 284 ( 3.6A)
None
 0.63A 4lj0A-3ch0A:
undetectable		 4lj0A-3ch0A:
13.08
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.
3crn RESPONSE REGULATOR
RECEIVER DOMAIN
PROTEIN, CHEY-LIKE

(Methanospirillum
hungatei) 		PF00072
(Response_reg) 		3 LEU A  21
LYS A  18
THR A  17
 None
 0.52A 4lj0A-3crnA:
undetectable		 4lj0A-3crnA:
16.28
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.
3dty OXIDOREDUCTASE,
GFO/IDH/MOCA FAMILY

(Pseudomonas
syringae group
genomosp. 3) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		3 LEU A 105
LYS A 102
THR A 101
 None
 0.63A 4lj0A-3dtyA:
undetectable		 4lj0A-3dtyA:
9.97
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.
3jtm FORMATE
DEHYDROGENASE,
MITOCHONDRIAL

(Arabidopsis
thaliana) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		3 LEU A 352
LYS A 349
THR A 348
 None
GOL  A 386 ( 2.7A)
None
 0.62A 4lj0A-3jtmA:
undetectable		 4lj0A-3jtmA:
10.29
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.
3kve L-AMINO ACID OXIDASE

(Vipera
ammodytes) 		PF01593
(Amino_oxidase) 		3 LEU A 189
LYS A 186
THR A 185
 None
 0.56A 4lj0A-3kveA:
undetectable		 4lj0A-3kveA:
8.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3l0z PUTATIVE
NICOTINATE-NUCLEOTID
E-DIMETHYLBENZIMIDAZ
OLE
PHOSPHORIBOSYLTRANSF
ERASE

(Methanocaldococcus
jannaschii) 		PF02277
(DBI_PRT) 		3 LEU A  64
LYS A  65
THR A  66
 None
 0.55A 4lj0A-3l0zA:
undetectable		 4lj0A-3l0zA:
9.79
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.
3ldr FRUCTOSYLTRANSFERASE

(Aspergillus
japonicus) 		PF00251
(Glyco_hydro_32N)
PF08244
(Glyco_hydro_32C) 		3 LEU A 475
LYS A 472
THR A 471
 None
 0.60A 4lj0A-3ldrA:
undetectable		 4lj0A-3ldrA:
11.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lei PLATELET AGGREGATION
FACTOR SM-HPAF

(Streptococcus
mitis) 		PF00754
(F5_F8_type_C) 		3 LEU A 166
LYS A 167
THR A 168
 None
 0.61A 4lj0A-3leiA:
undetectable		 4lj0A-3leiA:
15.92
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.
3n9v TYPE II
INOSITOL-1,4,5-TRISP
HOSPHATE
5-PHOSPHATASE

(Homo sapiens) 		PF03372
(Exo_endo_phos) 		3 LEU A 544
LYS A 545
THR A 546
 None
 0.63A 4lj0A-3n9vA:
undetectable		 4lj0A-3n9vA:
10.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nyw PUTATIVE
OXIDOREDUCTASE

(Bacteroides
thetaiotaomicron) 		PF00106
(adh_short) 		3 LEU A 163
LYS A 160
THR A 159
 None
 0.63A 4lj0A-3nywA:
undetectable		 4lj0A-3nywA:
15.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ow2 50S RIBOSOMAL
PROTEIN L39E

(Haloarcula
marismortui) 		PF00832
(Ribosomal_L39) 		3 LEU 1  11
LYS 1   8
THR 1   7
 G  01417 ( 3.5A)
U  01677 ( 2.4A)
A  0 120 ( 4.2A)
 0.56A 4lj0A-3ow21:
undetectable		 4lj0A-3ow21:
16.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3p5m ENOYL-COA
HYDRATASE/ISOMERASE

(Mycobacterium
avium) 		PF00378
(ECH_1) 		3 LEU A 205
LYS A 202
THR A 201
 None
 0.61A 4lj0A-3p5mA:
undetectable		 4lj0A-3p5mA:
13.55
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.
3siv NHP2-LIKE PROTEIN 1

(Homo sapiens) 		PF01248
(Ribosomal_L7Ae) 		3 LEU A  23
LYS A  20
THR A  19
 None
 0.50A 4lj0A-3sivA:
undetectable		 4lj0A-3sivA:
19.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3t5o COMPLEMENT COMPONENT
C6

(Homo sapiens) 		PF00057
(Ldl_recept_a)
PF00084
(Sushi)
PF00090
(TSP_1)
PF01823
(MACPF) 		3 LEU A 388
LYS A 384
THR A 383
 None
 0.62A 4lj0A-3t5oA:
undetectable		 4lj0A-3t5oA:
5.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tos CALS11

(Micromonospora
echinospora) 		PF05711
(TylF) 		3 LEU A 200
LYS A 197
THR A 196
 None
 0.54A 4lj0A-3tosA:
undetectable		 4lj0A-3tosA:
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.
3v7p AMIDOHYDROLASE
FAMILY PROTEIN

(Nitratiruptor
sp. SB155-2) 		PF01979
(Amidohydro_1) 		3 LEU A 245
LYS A 242
THR A 241
 None
 0.50A 4lj0A-3v7pA:
undetectable		 4lj0A-3v7pA:
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.
3w0l GLUCOKINASE
REGULATORY PROTEIN

(Xenopus laevis) 		no annotation 3 LEU B 485
LYS B 482
THR B 481
 None
 0.45A 4lj0A-3w0lB:
undetectable		 4lj0A-3w0lB:
6.87
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.
3waf IRON ABC
TRANSPORTER,
PERIPLASMIC
IRON-BINDING PROTEIN

(Thermus
thermophilus) 		PF13416
(SBP_bac_8) 		3 LEU A 253
LYS A 254
THR A 255
 None
 0.60A 4lj0A-3wafA:
undetectable		 4lj0A-3wafA:
9.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wn6 ALPHA-AMYLASE

(Oryza sativa) 		PF00128
(Alpha-amylase)
PF07821
(Alpha-amyl_C2) 		3 LEU A 277
LYS A 274
THR A 273
 None
 0.46A 4lj0A-3wn6A:
undetectable		 4lj0A-3wn6A:
10.68
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.
4bqi ALPHA-GLUCAN
PHOSPHORYLASE 2,
CYTOSOLIC

(Arabidopsis
thaliana) 		PF00343
(Phosphorylase) 		3 LEU A 510
LYS A 511
THR A 512
 None
 0.39A 4lj0A-4bqiA:
undetectable		 4lj0A-4bqiA:
5.70
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.
4cbv COME

(Streptococcus
pneumoniae) 		PF00072
(Response_reg)
PF04397
(LytTR) 		3 LEU A 133
LYS A 129
THR A 128
 None
 0.58A 4lj0A-4cbvA:
undetectable		 4lj0A-4cbvA:
13.53
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.
4ce7 UNSATURATED
3S-RHAMNOGLYCURONYL
HYDROLASE

(Nonlabens
ulvanivorans) 		PF07470
(Glyco_hydro_88) 		3 LEU A 119
LYS A 116
THR A 115
 None
 0.56A 4lj0A-4ce7A:
undetectable		 4lj0A-4ce7A:
14.48
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.
4cmn INOSITOL
POLYPHOSPHATE
5-PHOSPHATASE OCRL-1

(Homo sapiens) 		PF03372
(Exo_endo_phos) 		3 LEU A 519
LYS A 520
THR A 521
 None
 0.52A 4lj0A-4cmnA:
undetectable		 4lj0A-4cmnA:
12.42
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.
4dy0 GLIA-DERIVED NEXIN

(Homo sapiens) 		PF00079
(Serpin) 		3 LEU A  58
LYS A  55
THR A  54
 None
 0.57A 4lj0A-4dy0A:
undetectable		 4lj0A-4dy0A:
9.71
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.
4ess OR187

(synthetic
construct) 		PF01661
(Macro) 		3 LEU A  97
LYS A  94
THR A  93
 None
 0.53A 4lj0A-4essA:
undetectable		 4lj0A-4essA:
17.20
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.
4fio METHENYLTETRAHYDROME
THANOPTERIN
CYCLOHYDROLASE

(Methanobrevibacter
ruminantium) 		PF02289
(MCH) 		3 LEU A  57
LYS A  54
THR A  53
 None
 0.53A 4lj0A-4fioA:
undetectable		 4lj0A-4fioA:
10.51
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.
4if4 RESPONSE REGULATOR
PROTEIN VRAR

(Staphylococcus
aureus) 		PF00072
(Response_reg)
PF00196
(GerE) 		3 LEU A 104
LYS A 105
THR A 106
 None
BEF  A 301 (-2.8A)
None
 0.59A 4lj0A-4if4A:
undetectable		 4lj0A-4if4A:
14.37
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.
4j72 PHOSPHO-N-ACETYLMURA
MOYL-PENTAPEPTIDE-TR
ANSFERASE

(Aquifex
aeolicus) 		PF00953
(Glycos_transf_4)
PF10555
(MraY_sig1) 		3 LEU A 136
LYS A 133
THR A 132
 None
 0.48A 4lj0A-4j72A:
undetectable		 4lj0A-4j72A:
8.61
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.
4jpn MINOR SPIKE PROTEIN
H

(Escherichia
virus phiX174) 		PF04687
(Microvir_H) 		3 LEU A 159
LYS A 156
THR A 155
 None
 0.61A 4lj0A-4jpnA:
undetectable		 4lj0A-4jpnA:
11.11
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.
4k29 ENOYL-COA
HYDRATASE/ISOMERASE

(Xanthobacter
autotrophicus) 		PF00378
(ECH_1) 		3 LEU A 214
LYS A 211
THR A 210
 None
 0.60A 4lj0A-4k29A:
undetectable		 4lj0A-4k29A:
11.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4lj0 NAB2

(Chaetomium
thermophilum) 		PF14608
(zf-CCCH_2) 		3 LEU A 442
LYS A 443
THR A 444
 ACT  A 505 (-3.6A)
ACT  A 505 (-4.7A)
ACT  A 505 (-3.9A)
 0.02A 4lj0A-4lj0A:
14.5		 4lj0A-4lj0A:
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.
4nd4 LACTATE
DEHYDROGENASE,
ADJACENT GENE
ENCODES PREDICTED
MALATE DEHYDROGENASE

(Cryptosporidium
parvum) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		3 LEU A 243
LYS A 244
THR A 244
 None
 0.62A 4lj0A-4nd4A:
undetectable		 4lj0A-4nd4A:
11.86
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.
4ovx XYLOSE ISOMERASE
DOMAIN PROTEIN TIM
BARREL

(Planctopirus
limnophila) 		PF01261
(AP_endonuc_2) 		3 LEU A 305
LYS A 302
THR A 301
 None
 0.60A 4lj0A-4ovxA:
undetectable		 4lj0A-4ovxA:
9.63
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.
4p1z PIWI-LIKE PROTEIN 1

(Mus musculus) 		PF02171
(Piwi) 		3 LEU A 607
LYS A 604
THR A 603
 None
 0.63A 4lj0A-4p1zA:
undetectable		 4lj0A-4p1zA:
16.39
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.
4pl2 DUAL-SPECIFICITY RNA
METHYLTRANSFERASE
RLMN

(Escherichia
coli) 		no annotation 3 LEU B 370
LYS B 367
THR B 366
 None
 0.59A 4lj0A-4pl2B:
undetectable		 4lj0A-4pl2B:
11.75
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.
4qfb CT263

(Chlamydia
trachomatis) 		no annotation 3 LEU A  45
LYS A  46
THR A  47
 None
 0.63A 4lj0A-4qfbA:
undetectable		 4lj0A-4qfbA:
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.
4qj4 1-PHOSPHATIDYLINOSIT
OL 4,5-BISPHOSPHATE
PHOSPHODIESTERASE
BETA-3

(Homo sapiens) 		PF00168
(C2)
PF00387
(PI-PLC-Y)
PF00388
(PI-PLC-X)
PF09279
(EF-hand_like) 		3 LEU B 162
LYS B 159
THR B 158
 None
 0.51A 4lj0A-4qj4B:
undetectable		 4lj0A-4qj4B:
7.53
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.
4rkm MCCA

(Wolinella
succinogenes) 		no annotation 3 LEU A 672
LYS A 669
THR A 668
 None
 0.55A 4lj0A-4rkmA:
undetectable		 4lj0A-4rkmA:
6.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rlv ANKYRIN-1, ANKYRIN-2

(Homo sapiens;
Mus musculus) 		PF00023
(Ank)
PF12796
(Ank_2)
PF13637
(Ank_4)
PF13857
(Ank_5) 		3 LEU A2385
LYS A2382
THR A2381
 None
 0.57A 4lj0A-4rlvA:
undetectable		 4lj0A-4rlvA:
5.46
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.
4wy5 ESTERASE

(Rhizomucor
miehei) 		PF07859
(Abhydrolase_3) 		3 LEU A 242
LYS A 236
THR A 239
 None
 0.63A 4lj0A-4wy5A:
undetectable		 4lj0A-4wy5A:
11.76
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.
4xlg STRUCTURE-SPECIFIC
ENDONUCLEASE SUBUNIT
SLX1

([Candida]
glabrata) 		PF01541
(GIY-YIG) 		3 LEU A 206
LYS A 203
THR A 202
 None
 0.54A 4lj0A-4xlgA:
undetectable		 4lj0A-4xlgA:
13.00
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.
4xmr PUTATIVE
METHYL-ACCEPTING
CHEMOTAXIS SIGNAL
TRANSDUCTION PROTEIN

(Campylobacter
jejuni) 		PF02743
(dCache_1) 		3 LEU A  46
LYS A  43
THR A  42
 None
 0.63A 4lj0A-4xmrA:
undetectable		 4lj0A-4xmrA:
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.
4y07 NEDD4-LIKE E3
UBIQUITIN-PROTEIN
LIGASE WWP2

(Homo sapiens) 		PF00632
(HECT) 		3 LEU A 725
LYS A 722
THR A 721
 None
 0.57A 4lj0A-4y07A:
undetectable		 4lj0A-4y07A:
10.71
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.
4yzw AGAP004976-PA

(Anopheles
gambiae) 		PF00372
(Hemocyanin_M)
PF03722
(Hemocyanin_N)
PF03723
(Hemocyanin_C) 		3 LEU A 115
LYS A 112
THR A 111
 None
 0.59A 4lj0A-4yzwA:
undetectable		 4lj0A-4yzwA:
5.89
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.
4zad FDC1

(Candida
dubliniensis) 		PF01977
(UbiD) 		3 LEU A 381
LYS A 382
THR A 383
 None
 0.63A 4lj0A-4zadA:
undetectable		 4lj0A-4zadA:
8.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5a6b N-ACETYL-BETA-D-GLUC
OSAMINIDASE

(Streptococcus
pneumoniae) 		PF00728
(Glyco_hydro_20) 		3 LEU D 212
LYS D 213
THR D 214
 None
 0.39A 4lj0A-5a6bD:
undetectable		 4lj0A-5a6bD:
7.14
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.
5axi E3 UBIQUITIN-PROTEIN
LIGASE CBL-B

(Mus musculus) 		PF02262
(Cbl_N)
PF02761
(Cbl_N2)
PF02762
(Cbl_N3) 		3 LEU A 148
LYS A 145
THR A 144
 None
 0.56A 4lj0A-5axiA:
undetectable		 4lj0A-5axiA:
12.05
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.
5b1y 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
REDUCTASE

(Aeropyrum
pernix) 		PF13561
(adh_short_C2) 		3 LEU A 125
LYS A 122
THR A 121
 None
 0.50A 4lj0A-5b1yA:
undetectable		 4lj0A-5b1yA:
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.
5cz1 INTEGRASE

(Mouse mammary
tumor virus) 		PF00665
(rve) 		3 LEU A 103
LYS A 100
THR A  99
 None
 0.63A 4lj0A-5cz1A:
undetectable		 4lj0A-5cz1A:
14.09
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.
5dfw SINGLE CHAIN FV
FRAGMENT

(Mus musculus) 		PF07686
(V-set) 		3 LEU H 104
LYS H 102
THR H 124
 None
 0.59A 4lj0A-5dfwH:
undetectable		 4lj0A-5dfwH:
11.79
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.
5dk6 5'-METHYLTHIOADENOSI
NE/S-ADENOSYLHOMOCYS
TEINE NUCLEOSIDASE

(Colwellia
psychrerythraea) 		PF01048
(PNP_UDP_1) 		3 LEU A 191
LYS A 192
THR A 193
 None
 0.61A 4lj0A-5dk6A:
undetectable		 4lj0A-5dk6A:
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.
5fbu PHOSPHOENOLPYRUVATE
SYNTHASE

(Listeria
monocytogenes) 		PF00391
(PEP-utilizers)
PF01326
(PPDK_N) 		3 LEU A 572
LYS A 569
THR A 568
 None
 0.60A 4lj0A-5fbuA:
undetectable		 4lj0A-5fbuA:
4.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5gkk PUTATIVE HOMING
ENDONUCLEASE

(Thermotoga
neapolitana) 		PF00961
(LAGLIDADG_1) 		3 LEU A  92
LYS A  93
THR A  94
 None
 0.39A 4lj0A-5gkkA:
undetectable		 4lj0A-5gkkA:
18.24
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.
5gsl 778AA LONG
HYPOTHETICAL
BETA-GALACTOSIDASE

(Pyrococcus
horikoshii) 		PF02449
(Glyco_hydro_42) 		3 LEU A 341
LYS A 342
THR A 343
 None
 0.58A 4lj0A-5gslA:
undetectable		 4lj0A-5gslA:
5.59
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.
5hfn CEPHALOSPORIN-C
DEACETYLASE

(Thermotoga
maritima) 		PF05448
(AXE1) 		3 LEU A  51
LYS A  52
THR A  53
 None
 0.54A 4lj0A-5hfnA:
undetectable		 4lj0A-5hfnA:
13.59
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.
5hzg STRIGOLACTONE
ESTERASE D14

(Arabidopsis
thaliana) 		PF12697
(Abhydrolase_6) 		3 LEU A 242
LYS A 243
THR A 244
 None
 0.53A 4lj0A-5hzgA:
undetectable		 4lj0A-5hzgA:
13.58
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.
5icg (S)-NORCOCLAURINE
6-O-METHYLTRANSFERAS
E

(Thalictrum
flavum) 		PF00891
(Methyltransf_2)
PF08100
(Dimerisation) 		3 LEU A 301
LYS A 298
THR A 297
 None
 0.63A 4lj0A-5icgA:
undetectable		 4lj0A-5icgA:
11.66
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.
5j72 PUTATIVE
N-ACETYLMURAMOYL-L-A
LANINE
AMIDASE,AUTOLYSIN
CWP6

(Clostridioides
difficile) 		PF01520
(Amidase_3)
PF04122
(CW_binding_2) 		3 LEU A 209
LYS A 206
THR A 205
 None
 0.53A 4lj0A-5j72A:
undetectable		 4lj0A-5j72A:
6.83
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.
5jcf MELANOMA
DIFFERENTIATION
ASSOCIATED PROTEIN-5

(Gallus gallus) 		PF00271
(Helicase_C)
PF04851
(ResIII)
PF11648
(RIG-I_C-RD) 		3 LEU A 340
LYS A 337
THR A 336
 None
 0.55A 4lj0A-5jcfA:
undetectable		 4lj0A-5jcfA:
7.07
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.
5ly9 VARIANT SURFACE
GLYCOPROTEIN MITAT
1.1

(Trypanosoma
brucei) 		PF00913
(Trypan_glycop) 		3 LEU A 316
LYS A 313
THR A 312
 NAG  A 402 ( 4.5A)
None
GOL  A 408 (-3.3A)
 0.63A 4lj0A-5ly9A:
undetectable		 4lj0A-5ly9A:
14.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mps PRE-MRNA-SPLICING
FACTOR 18

(Saccharomyces
cerevisiae) 		PF08082
(PRO8NT)
PF08083
(PROCN)
PF10596
(U6-snRNA_bdg)
PF10597
(U5_2-snRNA_bdg)
PF10598
(RRM_4)
PF12134
(PRP8_domainIV) 		3 LEU a 143
LYS a 140
THR a 139
 None
 0.61A 4lj0A-5mpsa:
undetectable		 4lj0A-5mpsa:
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.
5tj7 NEDD4-LIKE E3
UBIQUITIN-PROTEIN
LIGASE WWP2

(Homo sapiens) 		PF00397
(WW)
PF00632
(HECT) 		3 LEU A 725
LYS A 722
THR A 721
 None
 0.58A 4lj0A-5tj7A:
undetectable		 4lj0A-5tj7A:
8.24
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.
5vil MITOGEN-ACTIVATED
PROTEIN KINASE
KINASE KINASE 5

(Homo sapiens) 		no annotation 3 LEU A 788
LYS A 785
THR A 784
 None
 0.59A 4lj0A-5vilA:
undetectable		 4lj0A-5vilA:
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.
5xh9 EXTRACELLULAR
INVERTASE

(Aspergillus
kawachii) 		PF00251
(Glyco_hydro_32N)
PF08244
(Glyco_hydro_32C) 		3 LEU A 449
LYS A 446
THR A 445
 None
 0.59A 4lj0A-5xh9A:
undetectable		 4lj0A-5xh9A:
6.00
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.
5y3r DNA-DEPENDENT
PROTEIN KINASE
CATALYTIC SUBUNIT

(Homo sapiens) 		PF00454
(PI3_PI4_kinase)
PF02259
(FAT)
PF02260
(FATC)
PF08163
(NUC194) 		3 LEU C1915
LYS C1913
THR C1914
 None
 0.60A 4lj0A-5y3rC:
undetectable		 4lj0A-5y3rC:
1.76
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.
5y4d ANKYRIN-1,ANKYRIN-2,
ANKYRIN-2

(Homo sapiens;
Mus musculus) 		PF00023
(Ank)
PF12796
(Ank_2)
PF13637
(Ank_4) 		3 LEU A2385
LYS A2382
THR A2381
 None
 0.53A 4lj0A-5y4dA:
undetectable		 4lj0A-5y4dA:
6.07
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.
5y4e ANKYRIN-2,ANKYRIN-2

(Homo sapiens) 		PF00023
(Ank)
PF12796
(Ank_2) 		3 LEU A1385
LYS A1382
THR A1381
 None
 0.59A 4lj0A-5y4eA:
undetectable		 4lj0A-5y4eA:
13.86
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.
5z2g L-AMINO ACID OXIDASE

(Naja atra) 		no annotation 3 LEU A 208
LYS A 205
THR A 204
 None
 0.62A 4lj0A-5z2gA:
undetectable		 4lj0A-5z2gA:
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.
5zln TOLL-LIKE RECEPTOR 9

(Mus musculus) 		no annotation 3 LEU A 738
LYS A 739
THR A 740
 None
 0.53A 4lj0A-5zlnA:
undetectable		 4lj0A-5zlnA:
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.
6bmt HYPOTHETICAL PROTEIN

(Staphylococcus
delphini) 		no annotation 3 LEU B  67
LYS B  64
THR B  63
 None
 0.61A 4lj0A-6bmtB:
undetectable		 4lj0A-6bmtB:
undetectable