SIMILAR PATTERNS OF AMINO ACIDS FOR 1HK3_A_T44A3002_1

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.
1c0w DIPHTHERIA TOXIN
REPRESSOR

(Corynebacterium
diphtheriae) 		PF01325
(Fe_dep_repress)
PF02742
(Fe_dep_repr_C) 		4 GLN A 173
ASN A 169
ARG A  13
TYR A  16
 CO  A 601 (-2.6A)
None
CO  A 701 ( 4.9A)
None
 1.10A 1hk3A-1c0wA:
0.4		 1hk3A-1c0wA:
16.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1cij PROTEIN (HALOALKANE
DEHALOGENASE)

(Xanthobacter
autotrophicus) 		PF00561
(Abhydrolase_1) 		4 LEU A  15
ARG A  64
TYR A  18
SER A  60
 None
 1.13A 1hk3A-1cijA:
undetectable		 1hk3A-1cijA:
18.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1cnv CONCANAVALIN B

(Canavalia
ensiformis) 		PF00704
(Glyco_hydro_18) 		4 GLN A 148
LEU A 159
LEU A 110
SER A 155
 None
 0.98A 1hk3A-1cnvA:
undetectable		 1hk3A-1cnvA:
18.79
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.
1euj ENDOTHELIAL MONOCYTE
ACTIVATING
POLYPEPTIDE 2

(Homo sapiens) 		PF01588
(tRNA_bind) 		4 GLN A 127
LEU A   9
ARG A   8
LEU A  67
 None
 1.07A 1hk3A-1eujA:
undetectable		 1hk3A-1eujA:
12.80
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.
1fyj MULTIFUNCTIONAL
AMINOACYL-TRNA
SYNTHETASE

(Homo sapiens) 		PF00458
(WHEP-TRS) 		4 ASN A   7
TYR A  43
LYS A  46
SER A   2
 None
 1.08A 1hk3A-1fyjA:
3.1		 1hk3A-1fyjA:
10.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1j9m DD-TRANSPEPTIDASE

(Streptomyces
sp. K15) 		PF00768
(Peptidase_S11) 		4 GLN A  87
LEU A 104
TYR A 108
LEU A  46
 None
 1.02A 1hk3A-1j9mA:
undetectable		 1hk3A-1j9mA:
17.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1kcw CERULOPLASMIN

(Homo sapiens) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 ASN A 448
TYR A 406
LEU A 404
SER A 522
 None
 1.08A 1hk3A-1kcwA:
0.0		 1hk3A-1kcwA:
20.46
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.
1ko0 DIAMINOPIMELATE
DECARBOXYLASE

(Escherichia
coli) 		PF00278
(Orn_DAP_Arg_deC)
PF02784
(Orn_Arg_deC_N) 		4 GLN A  45
LEU A 201
TYR A 198
LEU A 228
 None
 1.13A 1hk3A-1ko0A:
undetectable		 1hk3A-1ko0A:
21.69
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.
1mda METHYLAMINE
DEHYDROGENASE (HEAVY
SUBUNIT)

(Paracoccus
denitrificans) 		PF06433
(Me-amine-dh_H) 		4 LEU H  81
ARG H 119
TYR H  97
SER H  85
 None
 1.11A 1hk3A-1mdaH:
undetectable		 1hk3A-1mdaH:
20.47
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.
1o5t TRYPTOPHANYL-TRNA
SYNTHETASE

(Homo sapiens) 		PF00579
(tRNA-synt_1b) 		4 GLN A 145
LEU A 335
LEU A 116
SER A 110
 None
 0.88A 1hk3A-1o5tA:
undetectable		 1hk3A-1o5tA:
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.
1osm OMPK36

(Klebsiella
pneumoniae) 		PF00267
(Porin_1) 		4 GLN A 255
ASN A 256
TYR A 275
LEU A 292
 None
None
D12  A 344 ( 4.7A)
None
 1.09A 1hk3A-1osmA:
undetectable		 1hk3A-1osmA:
18.08
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.
1ox4 IMIDAZOLE GLYCEROL
PHOSPHATE SYNTHASE
HISHF

(Saccharomyces
cerevisiae) 		PF00117
(GATase)
PF00977
(His_biosynth) 		4 ASN B 469
LEU B 521
LEU B 297
SER B 362
 None
 1.09A 1hk3A-1ox4B:
undetectable		 1hk3A-1ox4B:
21.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qgr PROTEIN (IMPORTIN
BETA SUBUNIT)

(Homo sapiens) 		PF03810
(IBN_N)
PF13513
(HEAT_EZ) 		4 GLN A 712
ARG A 679
LEU A 654
SER A 633
 None
 0.95A 1hk3A-1qgrA:
0.0		 1hk3A-1qgrA:
21.35
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.
1qh5 PROTEIN
(HYDROXYACYLGLUTATHI
ONE HYDROLASE)

(Homo sapiens) 		PF00753
(Lactamase_B)
PF16123
(HAGH_C) 		4 TYR A 221
LYS A 196
LEU A 136
SER A 213
 None
 1.13A 1hk3A-1qh5A:
undetectable		 1hk3A-1qh5A:
20.22
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1tf0 SERUM ALBUMIN

(Homo sapiens) 		PF00273
(Serum_albumin) 		5 GLN A 390
ASN A 391
LEU A 407
LEU A 453
SER A 489
 None
 1.17A 1hk3A-1tf0A:
48.1		 1hk3A-1tf0A:
99.83
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1tf0 SERUM ALBUMIN

(Homo sapiens) 		PF00273
(Serum_albumin) 		6 GLN A 390
LEU A 407
TYR A 411
LYS A 414
LEU A 453
SER A 489
 None
 0.48A 1hk3A-1tf0A:
48.1		 1hk3A-1tf0A:
99.83
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.
2bzl TYROSINE-PROTEIN
PHOSPHATASE,
NON-RECEPTOR TYPE 14

(Homo sapiens) 		PF00102
(Y_phosphatase) 		4 LEU A1177
TYR A1174
LYS A 903
LEU A1133
 None
 1.09A 1hk3A-2bzlA:
undetectable		 1hk3A-2bzlA:
19.04
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.
2czo BUD EMERGENCE
PROTEIN 1

(Saccharomyces
cerevisiae) 		PF00787
(PX) 		4 GLN A 319
LEU A 373
TYR A 376
LEU A 396
 None
 0.96A 1hk3A-2czoA:
undetectable		 1hk3A-2czoA:
15.43
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.
2f02 TAGATOSE-6-PHOSPHATE
KINASE

(Enterococcus
faecalis) 		PF00294
(PfkB) 		4 LEU A 173
ARG A 170
LEU A 162
SER A 168
 None
 1.09A 1hk3A-2f02A:
undetectable		 1hk3A-2f02A:
21.05
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.
2ie8 PHOSPHOGLYCERATE
KINASE

(Thermus
caldophilus) 		PF00162
(PGK) 		4 LEU A  46
ARG A  43
LEU A  54
SER A  38
 None
 0.88A 1hk3A-2ie8A:
undetectable		 1hk3A-2ie8A:
22.17
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.
2odl ADHESIN

(Haemophilus
influenzae) 		PF05860
(Haemagg_act) 		4 ASN A 126
LEU A 140
LEU A  71
SER A 134
 None
 1.11A 1hk3A-2odlA:
undetectable		 1hk3A-2odlA:
19.35
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.
2q03 UNCHARACTERIZED
PROTEIN

(Shewanella
denitrificans) 		PF11528
(DUF3224) 		4 LEU A  46
TYR A  42
LEU A  85
SER A  50
 None
 1.05A 1hk3A-2q03A:
undetectable		 1hk3A-2q03A:
12.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vhd CYTOCHROME C551
PEROXIDASE

(Pseudomonas
aeruginosa) 		PF00034
(Cytochrom_C)
PF03150
(CCP_MauG) 		4 GLN A 185
LEU A 206
LEU A 174
SER A 168
 None
 1.12A 1hk3A-2vhdA:
undetectable		 1hk3A-2vhdA:
19.80
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.
2vsk HEMAGGLUTININ-NEURAM
INIDASE

(Hendra
henipavirus) 		PF00423
(HN) 		4 ASN A 482
LEU A 466
TYR A 454
SER A 457
 None
 1.07A 1hk3A-2vskA:
undetectable		 1hk3A-2vskA:
19.73
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.
2w1q HYALURONOGLUCOSAMINI
DASE

(Clostridium
perfringens) 		PF00754
(F5_F8_type_C) 		4 ASN A 928
ARG A 925
LEU A 936
SER A 813
 None
 0.96A 1hk3A-2w1qA:
undetectable		 1hk3A-2w1qA:
17.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2y8n 4-HYDROXYPHENYLACETA
TE DECARBOXYLASE
LARGE SUBUNIT

(Clostridium
scatologenes) 		PF01228
(Gly_radical)
PF02901
(PFL-like) 		4 GLN A 439
LEU A 351
TYR A 228
LEU A 331
 None
 1.08A 1hk3A-2y8nA:
undetectable		 1hk3A-2y8nA:
19.75
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.
3ah5 THYMIDYLATE SYNTHASE
THYX

(Helicobacter
pylori) 		PF02511
(Thy1) 		4 GLN A  93
LEU A 181
TYR A 183
LEU A 209
 None
 1.10A 1hk3A-3ah5A:
2.7		 1hk3A-3ah5A:
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.
3av6 DNA
(CYTOSINE-5)-METHYLT
RANSFERASE 1

(Mus musculus) 		PF00145
(DNA_methylase)
PF01426
(BAH)
PF02008
(zf-CXXC)
PF12047
(DNMT1-RFD) 		4 LEU A1319
ARG A 879
LEU A1302
SER A1355
 None
 1.06A 1hk3A-3av6A:
2.5		 1hk3A-3av6A:
19.31
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.
3bex TYPE III
PANTOTHENATE KINASE

(Thermotoga
maritima) 		PF03309
(Pan_kinase) 		4 GLN A  66
ASN A  67
ARG A  72
SER A  74
 None
 0.96A 1hk3A-3bexA:
undetectable		 1hk3A-3bexA:
17.43
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.
3ble CITRAMALATE SYNTHASE
FROM LEPTOSPIRA
INTERROGANS

(Leptospira
interrogans) 		PF00682
(HMGL-like) 		4 GLN A 221
LEU A 249
LEU A   8
SER A 257
 None
 0.94A 1hk3A-3bleA:
undetectable		 1hk3A-3bleA:
19.25
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.
3bus METHYLTRANSFERASE

(Lechevalieria
aerocolonigenes) 		PF08241
(Methyltransf_11) 		4 LEU A 257
ARG A 221
LEU A  28
SER A 223
 None
 1.12A 1hk3A-3busA:
undetectable		 1hk3A-3busA:
19.21
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.
3e20 EUKARYOTIC PEPTIDE
CHAIN RELEASE FACTOR
SUBUNIT 1

(Schizosaccharomyces
pombe) 		no annotation 4 GLN C 310
LEU C 373
ARG C 327
LEU C 317
 None
 0.97A 1hk3A-3e20C:
2.0		 1hk3A-3e20C:
20.92
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.
3h5o TRANSCRIPTIONAL
REGULATOR GNTR

(Chromobacterium
violaceum) 		PF13377
(Peripla_BP_3) 		4 GLN A 267
LEU A 251
LYS A 186
LEU A 242
 None
 1.13A 1hk3A-3h5oA:
undetectable		 1hk3A-3h5oA:
18.97
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.
3jb9 PRE-MRNA-SPLICING
FACTOR CWF11

(Schizosaccharomyces
pombe) 		PF13087
(AAA_12)
PF16399
(Aquarius_N) 		4 GLN X 703
ASN X 702
LEU X 736
LEU X 681
 None
 1.13A 1hk3A-3jb9X:
undetectable		 1hk3A-3jb9X:
19.46
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.
3lew SUSD-LIKE
CARBOHYDRATE BINDING
PROTEIN

(Bacteroides
vulgatus) 		PF07980
(SusD_RagB)
PF14322
(SusD-like_3) 		4 GLN A 437
ASN A 436
LEU A 412
LEU A 235
 None
 1.06A 1hk3A-3lewA:
0.8		 1hk3A-3lewA:
20.43
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.
3nx3 ACETYLORNITHINE
AMINOTRANSFERASE

(Campylobacter
jejuni) 		PF00202
(Aminotran_3) 		4 GLN A 263
ASN A 262
LEU A 215
SER A 269
 None
 1.11A 1hk3A-3nx3A:
2.1		 1hk3A-3nx3A:
21.17
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.
3ogr BETA-GALACTOSIDASE

(Trichoderma
reesei) 		PF01301
(Glyco_hydro_35)
PF10435
(BetaGal_dom2)
PF13363
(BetaGal_dom3)
PF13364
(BetaGal_dom4_5) 		4 LEU A 860
LYS A 950
LEU A 807
SER A 804
 None
 1.01A 1hk3A-3ogrA:
undetectable		 1hk3A-3ogrA:
19.34
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.
3otn SUSD SUPERFAMILY
PROTEIN

(Parabacteroides
distasonis) 		PF07980
(SusD_RagB)
PF14322
(SusD-like_3) 		4 GLN A  92
TYR A 102
LEU A 309
SER A  86
 None
 1.12A 1hk3A-3otnA:
undetectable		 1hk3A-3otnA:
21.78
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.
3ssm METHYLTRANSFERASE

(Micromonospora
griseorubida) 		no annotation 4 GLN A 197
LEU A  29
TYR A  33
LEU A  41
 None
 1.08A 1hk3A-3ssmA:
undetectable		 1hk3A-3ssmA:
21.04
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.
3tw8 DENN
DOMAIN-CONTAINING
PROTEIN 1B

(Homo sapiens) 		PF02141
(DENN)
PF03455
(dDENN)
PF03456
(uDENN) 		4 GLN A 315
LEU A 171
TYR A 174
LEU A 296
 None
 0.96A 1hk3A-3tw8A:
2.5		 1hk3A-3tw8A:
23.79
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.
3wzf ASPARTATE
AMINOTRANSFERASE,
CYTOPLASMIC

(Homo sapiens) 		PF00155
(Aminotran_1_2) 		4 GLN A 204
LEU A 177
TYR A 158
LEU A 188
 None
 0.86A 1hk3A-3wzfA:
undetectable		 1hk3A-3wzfA:
22.55
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.
3wzf ASPARTATE
AMINOTRANSFERASE,
CYTOPLASMIC

(Homo sapiens) 		PF00155
(Aminotran_1_2) 		4 GLN A 207
LEU A 177
TYR A 158
LEU A 188
 None
 1.00A 1hk3A-3wzfA:
undetectable		 1hk3A-3wzfA:
22.55
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.
3zoq URACIL-DNA
GLYCOSYLASE

(Bacillus
subtilis) 		PF03167
(UDG) 		4 GLN A  12
LEU A 144
ARG A 147
LEU A 122
 None
 0.87A 1hk3A-3zoqA:
undetectable		 1hk3A-3zoqA:
15.33
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.
3zqs E3 UBIQUITIN-PROTEIN
LIGASE FANCL

(Homo sapiens) 		PF09765
(WD-3) 		4 GLN A 189
LEU A 152
LEU A 121
SER A 182
 None
 0.89A 1hk3A-3zqsA:
undetectable		 1hk3A-3zqsA:
15.34
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.
4b8b GENERAL NEGATIVE
REGULATOR OF
TRANSCRIPTION
SUBUNIT 1

(Saccharomyces
cerevisiae) 		PF16417
(CNOT1_TTP_bind)
PF16418
(CNOT1_HEAT)
PF16419
(CNOT1_HEAT_N) 		4 GLN A 634
LEU A 675
ARG A 676
LEU A 567
 None
 0.90A 1hk3A-4b8bA:
undetectable		 1hk3A-4b8bA:
22.52
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.
4c4a PROTEIN ARGININE
N-METHYLTRANSFERASE
7

(Mus musculus) 		PF06325
(PrmA) 		4 GLN A 425
LEU A 476
LEU A 399
SER A 473
 None
 1.09A 1hk3A-4c4aA:
undetectable		 1hk3A-4c4aA:
22.64
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.
4d1g FIBER PROTEIN

(Snake
atadenovirus A) 		no annotation 4 GLN A 249
ASN A 250
LEU A 281
SER A 277
 None
 1.02A 1hk3A-4d1gA:
undetectable		 1hk3A-4d1gA:
13.29
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.
4dws CHI2

(Yersinia
entomophaga) 		PF00704
(Glyco_hydro_18) 		4 GLN A 586
LEU A 196
LEU A 281
SER A 199
 GOL  A 701 (-3.5A)
None
None
None
 1.04A 1hk3A-4dwsA:
undetectable		 1hk3A-4dwsA:
20.91
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.
4eg9 UNCHARACTERIZED
PROTEIN
SAOUHSC_02783

(Staphylococcus
aureus) 		PF04507
(DUF576) 		4 ASN A 197
LEU A 201
ARG A 204
LEU A 233
 None
 1.12A 1hk3A-4eg9A:
undetectable		 1hk3A-4eg9A:
17.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4eme M18 ASPARTYL
AMINOPEPTIDASE

(Plasmodium
falciparum) 		PF02127
(Peptidase_M18) 		4 GLN A 562
ASN A 561
LEU A  82
TYR A 372
 None
 0.99A 1hk3A-4emeA:
undetectable		 1hk3A-4emeA:
21.60
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.
4eru YCIF BACTERIAL
STRESS RESPONSE
PROTEIN

(Salmonella
enterica) 		PF05974
(DUF892) 		4 GLN A  60
LEU A 136
TYR A 117
LEU A  14
 None
 1.08A 1hk3A-4eruA:
2.4		 1hk3A-4eruA:
16.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gyp GLUCARATE
DEHYDRATASE-RELATED
PROTEIN

(Escherichia
coli) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 GLN C  84
ASN C  80
ARG C 323
LEU C 120
 None
PEG  C 503 (-3.5A)
None
None
 1.05A 1hk3A-4gypC:
undetectable		 1hk3A-4gypC:
21.05
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.
4hi0 UREASE ACCESSORY
PROTEIN UREH

(Helicobacter
pylori) 		PF01774
(UreD) 		4 GLN B  80
LEU B  75
ARG B  76
LEU B  67
 None
 1.06A 1hk3A-4hi0B:
undetectable		 1hk3A-4hi0B:
17.41
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.
4jgh CULLIN-5

(Homo sapiens) 		PF00888
(Cullin) 		4 GLN D 175
ARG D 181
LEU D 155
SER D 183
 None
 1.06A 1hk3A-4jghD:
2.8		 1hk3A-4jghD:
22.85
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.
4kpk ENOYL-COA
HYDRATASE/ISOMERASE

(Shewanella
pealeana) 		PF00378
(ECH_1) 		4 LEU A  19
ARG A  34
LEU A 130
SER A  75
 None
 1.09A 1hk3A-4kpkA:
undetectable		 1hk3A-4kpkA:
22.18
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.
4m9x CELL DEATH PROTEIN 4

(Caenorhabditis
elegans) 		PF00619
(CARD)
PF00931
(NB-ARC) 		4 LEU A 266
ARG A 267
LEU A 211
SER A 186
 None
 1.09A 1hk3A-4m9xA:
undetectable		 1hk3A-4m9xA:
21.35
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.
4n7b LYTB

(Plasmodium
falciparum) 		PF02401
(LYTB) 		4 GLN A 253
LEU A 281
TYR A 288
LEU A 215
 None
 0.95A 1hk3A-4n7bA:
undetectable		 1hk3A-4n7bA:
20.91
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.
4nhy 2-OXOGLUTARATE AND
IRON-DEPENDENT
OXYGENASE
DOMAIN-CONTAINING
PROTEIN 1

(Homo sapiens) 		PF10637
(Ofd1_CTDD)
PF13661
(2OG-FeII_Oxy_4) 		4 GLN A 436
ARG A 505
TYR A 504
LEU A 365
 None
 0.99A 1hk3A-4nhyA:
undetectable		 1hk3A-4nhyA:
22.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4p08 COCAINE ESTERASE

(Rhodococcus sp.
MB1) 		PF02129
(Peptidase_S15)
PF08530
(PepX_C) 		4 GLN A 125
LEU A 247
ARG A 243
LEU A 134
 None
 1.12A 1hk3A-4p08A:
undetectable		 1hk3A-4p08A:
21.83
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4po0 SERUM ALBUMIN

(Oryctolagus
cuniculus) 		PF00273
(Serum_albumin) 		5 ASN A 391
LEU A 407
TYR A 411
LEU A 453
SER A 489
 NPS  A 601 (-4.3A)
NPS  A 601 ( 4.9A)
NPS  A 601 (-4.3A)
NPS  A 601 (-4.7A)
NPS  A 601 (-3.1A)
 1.17A 1hk3A-4po0A:
45.4		 1hk3A-4po0A:
74.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4po0 SERUM ALBUMIN

(Oryctolagus
cuniculus) 		PF00273
(Serum_albumin) 		5 GLN A 390
LEU A 407
TYR A 411
LEU A 453
SER A 489
 None
NPS  A 601 ( 4.9A)
NPS  A 601 (-4.3A)
NPS  A 601 (-4.7A)
NPS  A 601 (-3.1A)
 0.58A 1hk3A-4po0A:
45.4		 1hk3A-4po0A:
74.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4po0 SERUM ALBUMIN

(Oryctolagus
cuniculus) 		PF00273
(Serum_albumin) 		5 GLN A 390
TYR A 411
LYS A 414
LEU A 453
SER A 489
 None
NPS  A 601 (-4.3A)
NPS  A 601 (-2.7A)
NPS  A 601 (-4.7A)
NPS  A 601 (-3.1A)
 0.85A 1hk3A-4po0A:
45.4		 1hk3A-4po0A:
74.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4po0 SERUM ALBUMIN

(Oryctolagus
cuniculus) 		PF00273
(Serum_albumin) 		4 LEU A 430
ARG A 410
LYS A 414
SER A 489
 NPS  A 601 ( 4.0A)
NPS  A 601 (-4.5A)
NPS  A 601 (-2.7A)
NPS  A 601 (-3.1A)
 1.12A 1hk3A-4po0A:
45.4		 1hk3A-4po0A:
74.14
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.
4qre METHIONYL-TRNA
SYNTHETASE

(Staphylococcus
aureus) 		PF08264
(Anticodon_1)
PF09334
(tRNA-synt_1g) 		4 ASN A 229
LEU A 113
LEU A 120
SER A 216
 None
 1.10A 1hk3A-4qreA:
undetectable		 1hk3A-4qreA:
20.34
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.
4r1s CINNAMOYL COA
REDUCTASE

(Petunia x
hybrida) 		PF01370
(Epimerase) 		4 GLN A  94
LEU A  66
ARG A  38
SER A  86
 None
NAP  A 401 ( 4.8A)
NAP  A 401 (-3.3A)
NAP  A 401 (-3.8A)
 0.93A 1hk3A-4r1sA:
undetectable		 1hk3A-4r1sA:
19.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4u14 MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M3,ENDOLYSIN,MUSCARI
NIC ACETYLCHOLINE
RECEPTOR M3

(Escherichia
virus T4;
Rattus
norvegicus) 		PF00001
(7tm_1)
PF00959
(Phage_lysozyme) 		4 LEU A1099
ARG A1096
LEU A1118
SER A1090
 None
 1.14A 1hk3A-4u14A:
undetectable		 1hk3A-4u14A:
20.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4umi FIBER PROTEIN

(Snake
atadenovirus A) 		no annotation 4 GLN A 249
ASN A 250
LEU A 281
SER A 277
 None
 1.01A 1hk3A-4umiA:
undetectable		 1hk3A-4umiA:
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.
4yke MRE11

(Chaetomium
thermophilum) 		PF00149
(Metallophos)
PF04152
(Mre11_DNA_bind) 		4 GLN A 335
LEU A 370
ARG A 306
LEU A 310
 None
 0.99A 1hk3A-4ykeA:
undetectable		 1hk3A-4ykeA:
22.83
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.
4z9c PERTUSSIS TOXIN-LIKE
SUBUNIT ARTA

(Escherichia
coli) 		PF02917
(Pertussis_S1) 		4 LEU A 171
ARG A  30
LEU A  36
SER A  48
 None
 1.11A 1hk3A-4z9cA:
undetectable		 1hk3A-4z9cA:
16.70
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.
4z9p NUCLEOPROTEIN

(Zaire
ebolavirus) 		PF05505
(Ebola_NP) 		4 GLN A 217
LEU A  75
LEU A  99
SER A  93
 None
 1.13A 1hk3A-4z9pA:
3.1		 1hk3A-4z9pA:
21.48
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.
4zlr BRAIN TUMOR PROTEIN

(Drosophila
melanogaster) 		PF01436
(NHL) 		4 GLN A1003
ASN A 976
LEU A1017
TYR A1025
 U  C   5 ( 3.5A)
G  C   6 ( 3.5A)
None
None
 1.13A 1hk3A-4zlrA:
undetectable		 1hk3A-4zlrA:
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.
5ayn SOLUTE CARRIER
FAMILY 39
(IRON-REGULATED
TRANSPORTER)

(Bdellovibrio
bacteriovorus) 		PF06963
(FPN1) 		4 LEU A  13
ARG A  17
LEU A 216
SER A 136
 None
 1.07A 1hk3A-5aynA:
undetectable		 1hk3A-5aynA:
20.70
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.
5b2g ENDOLYSIN,CLAUDIN-4

(Escherichia
virus T4;
Homo sapiens) 		PF00822
(PMP22_Claudin)
PF00959
(Phage_lysozyme) 		4 LEU A1099
ARG A1096
LEU A1118
SER A1090
 None
 1.11A 1hk3A-5b2gA:
undetectable		 1hk3A-5b2gA:
19.93
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5dqf SERUM ALBUMIN

(Equus caballus) 		PF00273
(Serum_albumin) 		4 ASN A 390
LEU A 406
TYR A 410
SER A 488
 None
 1.12A 1hk3A-5dqfA:
45.9		 1hk3A-5dqfA:
76.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5dqf SERUM ALBUMIN

(Equus caballus) 		PF00273
(Serum_albumin) 		4 LEU A 406
TYR A 410
LEU A 452
SER A 488
 None
 0.85A 1hk3A-5dqfA:
45.9		 1hk3A-5dqfA:
76.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5dqf SERUM ALBUMIN

(Equus caballus) 		PF00273
(Serum_albumin) 		4 LEU A 406
TYR A 410
LYS A 413
SER A 488
 None
 0.54A 1hk3A-5dqfA:
45.9		 1hk3A-5dqfA:
76.25
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.
5dzx PROTOCADHERIN BETA 6

(Mus musculus) 		PF00028
(Cadherin)
PF08266
(Cadherin_2) 		4 GLN A  79
LEU A  56
TYR A   5
LEU A  24
 None
 1.13A 1hk3A-5dzxA:
undetectable		 1hk3A-5dzxA:
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.
5exk LIPOYL SYNTHASE

(Mycobacterium
tuberculosis) 		PF04055
(Radical_SAM)
PF16881
(LIAS_N) 		4 GLN A 270
LEU A 233
LEU A 220
SER A 226
 None
 1.08A 1hk3A-5exkA:
undetectable		 1hk3A-5exkA:
19.90
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.
5exr DNA POLYMERASE ALPHA
CATALYTIC SUBUNIT
DNA PRIMASE LARGE
SUBUNIT

(Homo sapiens) 		PF00136
(DNA_pol_B)
PF03104
(DNA_pol_B_exo1)
PF04104
(DNA_primase_lrg)
PF08996
(zf-DNA_Pol) 		4 GLN B  27
LEU B  45
ARG B  49
LEU C1451
 None
 1.08A 1hk3A-5exrB:
2.7		 1hk3A-5exrB:
21.65
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ghk SERUM ALBUMIN

(Canis lupus) 		PF00273
(Serum_albumin) 		5 ASN A 391
LEU A 407
TYR A 411
LEU A 453
SER A 489
 None
 1.15A 1hk3A-5ghkA:
45.3		 1hk3A-5ghkA:
79.79
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ghk SERUM ALBUMIN

(Canis lupus) 		PF00273
(Serum_albumin) 		4 LEU A 407
TYR A 411
LYS A 414
SER A 489
 None
 0.76A 1hk3A-5ghkA:
45.3		 1hk3A-5ghkA:
79.79
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.
5gl9 BETA-LACTAMASE

(Burkholderia
thailandensis) 		PF13354
(Beta-lactamase2) 		4 ASN A 136
LEU A  76
LYS A 234
LEU A 169
 None
 1.12A 1hk3A-5gl9A:
undetectable		 1hk3A-5gl9A:
17.89
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.
5h42 UNCHARACTERIZED
PROTEIN

(Lachnoclostridium
phytofermentans) 		PF17167
(Glyco_hydro_36) 		4 GLN A  41
ASN A  43
LEU A 533
SER A 383
 None
 0.95A 1hk3A-5h42A:
undetectable		 1hk3A-5h42A:
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.
5hkq CDII IMMUNITY
PROTEIN
CONTACT-DEPENDENT
INHIBITOR A

(Escherichia
coli) 		PF14436
(EndoU_bacteria)
no annotation 		4 ASN I   2
LEU A 294
TYR I  10
LEU I  25
 None
 1.13A 1hk3A-5hkqI:
undetectable		 1hk3A-5hkqI:
11.28
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.
5jpn COMPLEMENT C4-A

(Homo sapiens) 		PF01835
(A2M_N)
PF07703
(A2M_N_2) 		4 GLN A 430
LEU A 558
ARG A 559
LEU A 489
 None
 1.08A 1hk3A-5jpnA:
undetectable		 1hk3A-5jpnA:
21.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jrl DIPEPTIDYL
AMINOPEPTIDASES/ACYL
AMINOACYL-PEPTIDASES
-LIKE PROTEIN

(Sphingopyxis
alaskensis) 		PF00326
(Peptidase_S9) 		4 ASN A 686
LEU A 483
ARG A 486
TYR A 488
 None
 1.05A 1hk3A-5jrlA:
undetectable		 1hk3A-5jrlA:
20.80
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.
5k3j ACYL-COENZYME A
OXIDASE

(Caenorhabditis
elegans) 		PF01756
(ACOX)
PF02770
(Acyl-CoA_dh_M)
PF14749
(Acyl-CoA_ox_N) 		4 ASN A 600
LEU A 558
TYR A 350
SER A 607
 None
 1.10A 1hk3A-5k3jA:
undetectable		 1hk3A-5k3jA:
21.68
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.
5lpc VANADIUM-DEPENDENT
BROMOPEROXIDASE

(Acaryochloris
marina) 		no annotation 4 GLN A 322
ASN A 323
LEU A 135
ARG A 136
 None
 1.06A 1hk3A-5lpcA:
undetectable		 1hk3A-5lpcA:
21.35
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.
5o9c OSMOPORIN OMP36

(Klebsiella
aerogenes) 		no annotation 4 GLN C 266
ASN C 267
TYR C 286
LEU C 303
 None
 1.05A 1hk3A-5o9cC:
undetectable		 1hk3A-5o9cC:
9.34
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ori ALBUMIN

(Capra hircus) 		no annotation 4 ARG A 409
TYR A 410
LYS A 413
SER A 488
 None
 1.03A 1hk3A-5oriA:
44.9		 1hk3A-5oriA:
74.49
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ori ALBUMIN

(Capra hircus) 		no annotation 5 ASN A 390
LEU A 406
TYR A 410
LEU A 452
SER A 488
 None
 1.11A 1hk3A-5oriA:
44.9		 1hk3A-5oriA:
74.49
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ori ALBUMIN

(Capra hircus) 		no annotation 5 LEU A 406
TYR A 410
LYS A 413
LEU A 452
SER A 488
 None
 0.50A 1hk3A-5oriA:
44.9		 1hk3A-5oriA:
74.49
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ori ALBUMIN

(Capra hircus) 		no annotation 4 LEU A 429
ARG A 409
LYS A 413
SER A 488
 None
 1.00A 1hk3A-5oriA:
44.9		 1hk3A-5oriA:
74.49
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.
5txe ATXE2

(Asticcacaulis
excentricus) 		PF00326
(Peptidase_S9) 		4 ASN A 391
LEU A 394
ARG A 396
TYR A 397
 None
 0.72A 1hk3A-5txeA:
undetectable		 1hk3A-5txeA:
21.80
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.
5v2m MEVALONATE
DIPHOSPHATE
DECARBOXYLASE

(Enterococcus
faecalis) 		no annotation 4 GLN A  81
LEU A 133
ARG A 136
LEU A 113
 None
 0.96A 1hk3A-5v2mA:
undetectable		 1hk3A-5v2mA:
21.38
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.
5w3v APOBEC3H

(Macaca
nemestrina) 		no annotation 4 GLN B  33
LEU B 104
ARG B 105
LEU B  30
 None
 0.97A 1hk3A-5w3vB:
undetectable		 1hk3A-5w3vB:
16.41
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.
5yud BACULOVIRAL IAP
REPEAT-CONTAINING
PROTEIN 1E

(Mus musculus) 		no annotation 4 LEU A 869
ARG A 866
LEU A 889
SER A 861
 None
 0.81A 1hk3A-5yudA:
2.1		 1hk3A-5yudA:
9.23
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.
5yxe SERUM ALBUMIN

(Felis catus) 		no annotation 5 LEU A 407
TYR A 411
LYS A 414
LEU A 453
SER A 489
 None
 0.56A 1hk3A-5yxeA:
46.2		 1hk3A-5yxeA:
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.
6bca A-KINASE ANCHOR
PROTEIN 13

(Homo sapiens) 		no annotation 4 GLN A2326
LEU A2254
ARG A2234
LEU A2300
 None
 1.05A 1hk3A-6bcaA:
undetectable		 1hk3A-6bcaA:
10.18
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.
6ez8 HUNTINGTIN

(Homo sapiens) 		no annotation 4 GLN A1272
LEU A 985
LEU A1101
SER A1096
 None
 0.93A 1hk3A-6ez8A:
undetectable		 1hk3A-6ez8A:
6.81