SIMILAR PATTERNS OF AMINO ACIDS FOR 4KSZ_A_CYSA620

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.
1bmw POLLEN ALLERGEN PHL
P2

(Phleum pratense) 		PF01357
(Pollen_allerg_1) 		3 ARG A  34
GLU A  35
PHE A  54
 None
 0.95A 4kszA-1bmwA:
undetectable		 4kszA-1bmwA:
10.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1d7w MYELOPEROXIDASE

(Homo sapiens) 		PF03098
(An_peroxidase) 		3 ARG C 239
GLU C 242
PHE C 366
 HEM  A 605 (-4.3A)
HEM  A 605 (-2.1A)
None
 0.36A 4kszA-1d7wC:
12.7		 4kszA-1d7wC:
45.12
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1d7w MYELOPEROXIDASE

(Homo sapiens) 		PF03098
(An_peroxidase) 		3 ARG C 239
GLU C 242
PHE C 407
 HEM  A 605 (-4.3A)
HEM  A 605 (-2.1A)
HEM  A 605 (-4.5A)
 0.95A 4kszA-1d7wC:
12.7		 4kszA-1d7wC:
45.12
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.
1h4b POLCALCIN BET V 4

(Betula pendula) 		PF13499
(EF-hand_7) 		3 ARG A  13
GLU A  12
PHE A  63
 None
 0.87A 4kszA-1h4bA:
1.7		 4kszA-1h4bA:
11.13
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.
1jgg SEGMENTATION PROTEIN
EVEN-SKIPPED

(Drosophila
melanogaster) 		PF00046
(Homeobox) 		3 ARG A 115
GLU A 119
PHE A 149
 None
 0.99A 4kszA-1jggA:
undetectable		 4kszA-1jggA:
7.94
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.
1lrt INOSINE-5'-MONOPHOSP
HATE DEHYDROGENASE

(Tritrichomonas
suis) 		PF00478
(IMPDH) 		3 ARG A 299
GLU A 296
PHE A 266
 None
 0.87A 4kszA-1lrtA:
0.0		 4kszA-1lrtA:
21.13
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.
1mew INOSINE-5'-MONOPHOSP
HATE DEHYDROGENASE

(Tritrichomonas
suis) 		PF00478
(IMPDH)
PF00571
(CBS) 		3 ARG A 299
GLU A 296
PHE A 266
 None
 0.95A 4kszA-1mewA:
undetectable		 4kszA-1mewA:
21.00
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.
1nhw ENOYL-ACYL CARRIER
REDUCTASE

(Plasmodium
falciparum) 		PF13561
(adh_short_C2) 		3 ARG C 404
GLU C 402
PHE C 397
 None
 0.97A 4kszA-1nhwC:
undetectable		 4kszA-1nhwC:
8.92
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.
1o2d ALCOHOL
DEHYDROGENASE,
IRON-CONTAINING

(Thermotoga
maritima) 		PF00465
(Fe-ADH) 		3 ARG A  81
GLU A  61
PHE A  87
 None
 0.78A 4kszA-1o2dA:
0.0		 4kszA-1o2dA:
19.61
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.
1obg PHOSPHORIBOSYLAMIDOI
MIDAZOLE-
SUCCINOCARBOXAMIDE
SYNTHASE

(Saccharomyces
cerevisiae) 		PF01259
(SAICAR_synt) 		3 ARG A 105
GLU A 103
PHE A  86
 None
 0.91A 4kszA-1obgA:
0.0		 4kszA-1obgA:
20.66
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.
1p22 F-BOX/WD-REPEAT
PROTEIN 1A

(Homo sapiens) 		PF00400
(WD40)
PF12937
(F-box-like) 		3 ARG A 204
GLU A 529
PHE A 530
 None
 0.85A 4kszA-1p22A:
0.0		 4kszA-1p22A:
22.11
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.
1u2v ACTIN-RELATED
PROTEIN 3

(Bos taurus) 		PF00022
(Actin) 		3 ARG A  91
GLU A  90
PHE A 134
 None
 0.85A 4kszA-1u2vA:
0.9		 4kszA-1u2vA:
20.59
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.
1ujs ACTIN-BINDING LIM
PROTEIN HOMOLOGUE

(Homo sapiens) 		PF02209
(VHP)
PF16182
(AbLIM_anchor) 		3 ARG A  72
GLU A  45
PHE A  53
 None
 1.02A 4kszA-1ujsA:
undetectable		 4kszA-1ujsA:
9.85
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.
1ux6 THROMBOSPONDIN-1

(Homo sapiens) 		PF02412
(TSP_3)
PF05735
(TSP_C) 		3 ARG A1000
GLU A 999
PHE A1087
 None
 0.96A 4kszA-1ux6A:
undetectable		 4kszA-1ux6A:
20.86
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.
1xox APOPTOSIS INHIBITOR
SURVIVIN

(Homo sapiens) 		PF00653
(BIR) 		3 ARG A 106
GLU A 107
PHE A  59
 None
 1.01A 4kszA-1xoxA:
undetectable		 4kszA-1xoxA:
11.41
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.
1ygm HYPOTHETICAL PROTEIN
BSU31320

(Bacillus
subtilis) 		PF11458
(Mistic) 		3 ARG A  11
GLU A  59
PHE A  51
 None
 0.78A 4kszA-1ygmA:
undetectable		 4kszA-1ygmA:
11.54
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.
1yni SUCCINYLARGININE
DIHYDROLASE

(Escherichia
coli) 		PF04996
(AstB) 		3 ARG A 377
GLU A 376
PHE A 159
 None
 0.90A 4kszA-1yniA:
0.0		 4kszA-1yniA:
20.56
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.
1zv6 EPB49 PROTEIN

(Homo sapiens) 		PF02209
(VHP)
PF16182
(AbLIM_anchor) 		3 ARG A  66
GLU A  39
PHE A  47
 None
 0.96A 4kszA-1zv6A:
undetectable		 4kszA-1zv6A:
8.80
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.
2b3x IRON-RESPONSIVE
ELEMENT BINDING
PROTEIN 1

(Homo sapiens) 		PF00330
(Aconitase)
PF00694
(Aconitase_C) 		3 ARG A 149
GLU A 146
PHE A 154
 None
 0.92A 4kszA-2b3xA:
0.3		 4kszA-2b3xA:
19.62
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.
2cxj S100 CALCIUM-BINDING
PROTEIN A13

(Mus musculus) 		PF01023
(S_100) 		3 ARG A  78
GLU A  82
PHE A  21
 None
 0.96A 4kszA-2cxjA:
undetectable		 4kszA-2cxjA:
12.64
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2gjm LACTOPEROXIDASE

(Bubalus bubalis) 		PF03098
(An_peroxidase) 		3 ARG A 239
GLU A 242
PHE A 366
 HEM  A 605 (-4.7A)
HEM  A 605 ( 2.2A)
None
 0.49A 4kszA-2gjmA:
65.0		 4kszA-2gjmA:
99.66
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.
2gsz TWITCHING MOTILITY
PROTEIN PILT

(Aquifex
aeolicus) 		PF00437
(T2SSE) 		3 ARG A 229
GLU A 225
PHE A 257
 None
 0.71A 4kszA-2gszA:
undetectable		 4kszA-2gszA:
21.12
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.
2h92 CYTIDYLATE KINASE

(Staphylococcus
aureus) 		PF02224
(Cytidylate_kin) 		3 ARG A 152
GLU A 151
PHE A 166
 None
 0.84A 4kszA-2h92A:
undetectable		 4kszA-2h92A:
15.60
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.
2iy8 PROTEIN PM0188

(Pasteurella
multocida) 		PF11477
(PM0188) 		3 ARG A  86
GLU A  89
PHE A  92
 None
 0.96A 4kszA-2iy8A:
undetectable		 4kszA-2iy8A:
21.20
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.
2j5b TYROSYL-TRNA
SYNTHETASE

(Acanthamoeba
polyphaga
mimivirus) 		PF00579
(tRNA-synt_1b) 		3 ARG A  92
GLU A  96
PHE A 318
 ARG  A  92 ( 0.6A)
GLU  A  96 ( 0.6A)
PHE  A 318 ( 1.3A)
 0.96A 4kszA-2j5bA:
undetectable		 4kszA-2j5bA:
20.23
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.
2jan TYROSYL-TRNA
SYNTHETASE

(Mycobacterium
tuberculosis) 		PF00579
(tRNA-synt_1b) 		3 ARG A 108
GLU A 107
PHE A 112
 None
 0.99A 4kszA-2janA:
undetectable		 4kszA-2janA:
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.
2l4c ENDOPLASMIC
RETICULUM RESIDENT
PROTEIN 27

(Homo sapiens) 		PF13848
(Thioredoxin_6) 		3 ARG A 109
GLU A 112
PHE A  57
 None
 0.99A 4kszA-2l4cA:
undetectable		 4kszA-2l4cA:
11.58
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.
2m56 CAMPHOR
5-MONOOXYGENASE

(Pseudomonas
putida) 		PF00067
(p450) 		3 ARG A 365
GLU A 366
PHE A 158
 None
 0.97A 4kszA-2m56A:
undetectable		 4kszA-2m56A:
23.70
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.
2nq5 5-METHYLTETRAHYDROPT
EROYLTRIGLUTAMATE--H
OMOCYSTEINE
METHYLTRANSFERASE

(Streptococcus
mutans) 		PF01717
(Meth_synt_2)
PF08267
(Meth_synt_1) 		3 ARG A 337
GLU A 329
PHE A 342
 None
 0.93A 4kszA-2nq5A:
undetectable		 4kszA-2nq5A:
21.30
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.
2p5u UDP-GLUCOSE
4-EPIMERASE

(Thermus
thermophilus) 		PF01370
(Epimerase) 		3 ARG A  66
GLU A  64
PHE A  48
 None
 0.80A 4kszA-2p5uA:
undetectable		 4kszA-2p5uA:
20.17
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.
2pbp ENOYL-COA HYDRATASE
SUBUNIT I

(Geobacillus
kaustophilus) 		PF00378
(ECH_1) 		3 ARG A 146
GLU A 112
PHE A 130
 None
 1.00A 4kszA-2pbpA:
undetectable		 4kszA-2pbpA:
18.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2q7x UPF0052 PROTEIN
SP_1565

(Streptococcus
pneumoniae) 		PF01933
(UPF0052) 		3 ARG A 292
GLU A 316
PHE A 298
 None
 1.02A 4kszA-2q7xA:
undetectable		 4kszA-2q7xA:
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.
2qez ETHANOLAMINE
AMMONIA-LYASE HEAVY
CHAIN

(Listeria
monocytogenes) 		PF06751
(EutB) 		3 ARG A  44
GLU A  43
PHE A  14
 None
 0.90A 4kszA-2qezA:
undetectable		 4kszA-2qezA:
20.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qp4 BILE SALT
SULFOTRANSFERASE

(Homo sapiens) 		PF00685
(Sulfotransfer_1) 		3 ARG A  27
GLU A   9
PHE A   8
 None
 0.73A 4kszA-2qp4A:
undetectable		 4kszA-2qp4A:
18.27
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.
2wyr COBALT-ACTIVATED
PEPTIDASE TET1

(Pyrococcus
horikoshii) 		PF05343
(Peptidase_M42) 		3 ARG A  29
GLU A  30
PHE A  10
 None
 0.92A 4kszA-2wyrA:
undetectable		 4kszA-2wyrA:
18.99
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.
2xdf PHOSPHOENOLPYRUVATE-
PROTEIN
PHOSPHOTRANSFERASE

(Escherichia
coli) 		PF00391
(PEP-utilizers)
PF02896
(PEP-utilizers_C)
PF05524
(PEP-utilisers_N) 		3 ARG A 371
GLU A 310
PHE A 314
 None
 0.86A 4kszA-2xdfA:
undetectable		 4kszA-2xdfA:
20.96
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.
2y2w ARABINOFURANOSIDASE

(Bifidobacterium
longum) 		PF06964
(Alpha-L-AF_C) 		3 ARG A 134
GLU A 143
PHE A 115
 None
 1.01A 4kszA-2y2wA:
undetectable		 4kszA-2y2wA:
20.95
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.
2yfn ALPHA-GALACTOSIDASE-
SUCROSE KINASE AGASK

([Ruminococcus]
gnavus) 		PF02065
(Melibiase)
PF16874
(Glyco_hydro_36C)
PF16875
(Glyco_hydro_36N) 		3 ARG A 689
GLU A 684
PHE A 717
 None
 0.74A 4kszA-2yfnA:
undetectable		 4kszA-2yfnA:
21.84
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.
2zup DISULFIDE BOND
FORMATION PROTEIN B

(Escherichia
coli) 		PF02600
(DsbB) 		3 ARG B  48
GLU B  47
PHE B 150
 UQ1  B 177 (-4.5A)
UQ1  B 177 (-3.5A)
None
 0.87A 4kszA-2zupB:
undetectable		 4kszA-2zupB:
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.
2zyz TRNA-SPLICING
ENDONUCLEASE

(Pyrobaculum
aerophilum) 		PF01974
(tRNA_int_endo)
PF02778
(tRNA_int_endo_N) 		3 ARG B  88
GLU B 137
PHE B 135
 None
 0.72A 4kszA-2zyzB:
undetectable		 4kszA-2zyzB:
15.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dmk DOWN SYNDROME CELL
ADHESION MOLECULE
(DSCAM) ISOFORM
1.30.30, N-TERMINAL
EIGHT IG DOMAINS

(Drosophila
melanogaster) 		PF07679
(I-set)
PF13927
(Ig_3) 		3 ARG A  94
GLU A 381
PHE A 372
 None
 0.95A 4kszA-3dmkA:
undetectable		 4kszA-3dmkA:
20.98
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.
3dtg BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE

(Mycolicibacterium
smegmatis) 		PF01063
(Aminotran_4) 		3 ARG A 146
GLU A  78
PHE A 119
 OBZ  A 371 (-4.2A)
None
None
 0.85A 4kszA-3dtgA:
undetectable		 4kszA-3dtgA:
20.50
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.
3ewd ADENOSINE DEAMINASE

(Plasmodium
vivax) 		PF00962
(A_deaminase) 		3 ARG A 216
GLU A 248
PHE A 348
 None
 0.76A 4kszA-3ewdA:
undetectable		 4kszA-3ewdA:
20.03
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.
3g2f BONE MORPHOGENETIC
PROTEIN RECEPTOR
TYPE-2

(Homo sapiens) 		PF00069
(Pkinase) 		3 ARG A 459
GLU A 481
PHE A 462
 None
 0.87A 4kszA-3g2fA:
undetectable		 4kszA-3g2fA:
18.85
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.
3hjn THYMIDYLATE KINASE

(Thermotoga
maritima) 		PF02223
(Thymidylate_kin) 		3 ARG A 187
GLU A 188
PHE A 126
 None
 0.81A 4kszA-3hjnA:
undetectable		 4kszA-3hjnA:
15.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3i9s INTEGRON CASSETTE
PROTEIN

(Vibrio cholerae) 		PF00583
(Acetyltransf_1) 		3 ARG A  25
GLU A  22
PHE A  89
 None
 0.95A 4kszA-3i9sA:
undetectable		 4kszA-3i9sA:
14.04
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.
3ihu TRANSCRIPTIONAL
REGULATOR, GNTR
FAMILY

(Cupriavidus
pinatubonensis) 		PF00392
(GntR)
PF07729
(FCD) 		3 ARG A 186
GLU A 128
PHE A 136
 None
 0.95A 4kszA-3ihuA:
undetectable		 4kszA-3ihuA:
17.18
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.
3krc GERANYL DIPHOSPHATE
SYNTHASE LARGE
SUBUNIT

(Mentha x
piperita) 		PF00348
(polyprenyl_synt) 		3 ARG A  36
GLU A  33
PHE A 104
 None
 0.92A 4kszA-3krcA:
undetectable		 4kszA-3krcA:
19.43
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.
3mzs CHOLESTEROL
SIDE-CHAIN CLEAVAGE
ENZYME

(Bos taurus) 		PF00067
(p450) 		3 ARG A 180
GLU A 179
PHE A 246
 None
 0.88A 4kszA-3mzsA:
0.1		 4kszA-3mzsA:
21.67
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.
3pco PHENYLALANYL-TRNA
SYNTHETASE, ALPHA
SUBUNIT

(Escherichia
coli) 		PF01409
(tRNA-synt_2d)
PF02912
(Phe_tRNA-synt_N) 		3 ARG A 301
GLU A 300
PHE A 315
 AMP  A 992 (-3.7A)
None
None
 0.82A 4kszA-3pcoA:
undetectable		 4kszA-3pcoA:
20.81
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.
3soj PILE

(Francisella
tularensis) 		no annotation 3 ARG A  30
GLU A  29
PHE A  91
 None
 0.88A 4kszA-3sojA:
undetectable		 4kszA-3sojA:
10.09
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.
3upu ATP-DEPENDENT DNA
HELICASE DDA

(Escherichia
virus T4) 		PF13604
(AAA_30) 		3 ARG A 337
GLU A 338
PHE A 291
 None
 0.99A 4kszA-3upuA:
undetectable		 4kszA-3upuA:
21.92
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.
3uzb BRANCHED-CHAIN-AMINO
-ACID
AMINOTRANSFERASE

(Deinococcus
radiodurans) 		PF01063
(Aminotran_4) 		3 ARG A 145
GLU A  77
PHE A 118
 None
 0.74A 4kszA-3uzbA:
undetectable		 4kszA-3uzbA:
20.23
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.
3x17 ENDOGLUCANASE

(uncultured
bacterium) 		no annotation 3 ARG B 478
GLU B 477
PHE B 574
 None
 1.00A 4kszA-3x17B:
undetectable		 4kszA-3x17B:
20.56
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.
4bb9 GLUCOKINASE
REGULATORY PROTEIN

(Homo sapiens) 		no annotation 3 ARG A 297
GLU A 294
PHE A 466
 None
 0.95A 4kszA-4bb9A:
undetectable		 4kszA-4bb9A:
21.91
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.
4bx9 VACUOLAR PROTEIN
SORTING-ASSOCIATED
PROTEIN 33A

(Homo sapiens) 		PF00995
(Sec1) 		3 ARG A 137
GLU A 138
PHE A  26
 None
 0.96A 4kszA-4bx9A:
undetectable		 4kszA-4bx9A:
24.27
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.
4dqn PUTATIVE
BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE
ILVE

(Streptococcus
mutans) 		PF01063
(Aminotran_4) 		3 ARG A 126
GLU A  58
PHE A  99
 None
 0.76A 4kszA-4dqnA:
undetectable		 4kszA-4dqnA:
20.95
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.
4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE

(Sinorhizobium
meliloti) 		PF00171
(Aldedh) 		3 ARG A 278
GLU A 277
PHE A 147
 None
 1.02A 4kszA-4e4gA:
undetectable		 4kszA-4e4gA:
22.88
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.
4fm9 DNA TOPOISOMERASE
2-ALPHA

(Homo sapiens) 		PF00521
(DNA_topoisoIV)
PF01751
(Toprim)
PF16898
(TOPRIM_C) 		3 ARG A 713
GLU A 712
PHE A1003
 None
 0.98A 4kszA-4fm9A:
undetectable		 4kszA-4fm9A:
22.49
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.
4hxy PLM1

(Streptomyces
sp. HK803) 		PF08659
(KR) 		3 ARG A 202
GLU A 206
PHE A 236
 None
 0.96A 4kszA-4hxyA:
undetectable		 4kszA-4hxyA:
22.28
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.
4i7l LYSOZYME

(Escherichia
virus T4) 		PF00959
(Phage_lysozyme) 		3 ARG A   8
GLU A  11
PHE A 104
 None
 0.87A 4kszA-4i7lA:
undetectable		 4kszA-4i7lA:
14.93
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.
4ida RIPENING-INDUCED
PROTEIN

(Fragaria vesca) 		PF08240
(ADH_N)
PF13602
(ADH_zinc_N_2) 		3 ARG A 157
GLU A 156
PHE A 187
 None
 0.95A 4kszA-4idaA:
undetectable		 4kszA-4idaA:
21.23
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.
4krf PROTEIN ARGONAUTE-1

(Homo sapiens) 		PF02170
(PAZ)
PF02171
(Piwi)
PF08699
(ArgoL1)
PF16486
(ArgoN)
PF16487
(ArgoMid)
PF16488
(ArgoL2) 		3 ARG A  88
GLU A 394
PHE A 395
 None
 0.87A 4kszA-4krfA:
undetectable		 4kszA-4krfA:
20.66
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.
4nae HEPTAPRENYLGLYCERYL
PHOSPHATE SYNTHASE

(Geobacillus
kaustophilus) 		PF01884
(PcrB) 		3 ARG A  26
GLU A  25
PHE A  58
 None
 0.95A 4kszA-4naeA:
undetectable		 4kszA-4naeA:
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.
4nrq RNA DEMETHYLASE
ALKBH5

(Homo sapiens) 		PF13532
(2OG-FeII_Oxy_2) 		3 ARG A 213
GLU A 212
PHE A 186
 None
 0.94A 4kszA-4nrqA:
undetectable		 4kszA-4nrqA:
15.93
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.
4p5k RAS PEPTIDE,HLA
CLASS II
HISTOCOMPATIBILITY
ANTIGEN, DP BETA 1
CHAIN

(Homo sapiens) 		PF00969
(MHC_II_beta)
PF07654
(C1-set) 		3 ARG B  27
GLU B  26
PHE B -18
 None
 0.97A 4kszA-4p5kB:
undetectable		 4kszA-4p5kB:
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.
4pgh CAFFEIC ACID
O-METHYLTRANSFERASE

(Sorghum bicolor) 		PF00891
(Methyltransf_2)
PF08100
(Dimerisation) 		3 ARG A 332
GLU A 331
PHE A 346
 None
 0.99A 4kszA-4pghA:
undetectable		 4kszA-4pghA:
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.
4py5 RIBONUCLEASE

(Thermovibrio
ammonificans) 		PF01351
(RNase_HII) 		3 ARG A 162
GLU A 158
PHE A 182
 None
SO4  A 306 ( 4.8A)
None
 0.88A 4kszA-4py5A:
undetectable		 4kszA-4py5A:
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.
4qlo HOMOSERINE
O-ACETYLTRANSFERASE

(Staphylococcus
aureus) 		PF00561
(Abhydrolase_1) 		3 ARG A 114
GLU A 113
PHE A 146
 None
 0.99A 4kszA-4qloA:
undetectable		 4kszA-4qloA:
19.83
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.
4rbn SUCROSE
SYNTHASE:GLYCOSYL
TRANSFERASES GROUP 1

(Nitrosomonas
europaea) 		PF00534
(Glycos_transf_1)
PF00862
(Sucrose_synth) 		3 ARG A 773
GLU A 770
PHE A 127
 None
 0.99A 4kszA-4rbnA:
undetectable		 4kszA-4rbnA:
21.24
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.
4uf7 GLYCOPROTEIN

(Ghanaian bat
henipavirus) 		PF00423
(HN) 		3 ARG A 280
GLU A 273
PHE A 578
 None
 0.91A 4kszA-4uf7A:
undetectable		 4kszA-4uf7A:
21.06
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.
4uup MALATE DEHYDROGENASE

(synthetic
construct) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		3 ARG A 161
GLU A 165
PHE A 221
 PO4  A 346 (-3.9A)
None
None
 1.01A 4kszA-4uupA:
undetectable		 4kszA-4uupA:
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.
4x9f DOWN SYNDROME CELL
ADHESION MOLECULE
ISOFORM 6.9

(Drosophila
melanogaster) 		PF07679
(I-set) 		3 ARG A  94
GLU A 381
PHE A 372
 None
 1.01A 4kszA-4x9fA:
undetectable		 4kszA-4x9fA:
22.46
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.
4yaq PG9_N100FY FAB HEAVY
CHAIN

(Homo sapiens) 		no annotation 3 ARG H  94
GLU H  95
PHE H  50
 PCA  H   2 (-4.0A)
None
None
 1.02A 4kszA-4yaqH:
undetectable		 4kszA-4yaqH:
17.98
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.
4zu9 ELONGATION FACTOR
SELB

(Aquifex
aeolicus) 		PF00009
(GTP_EFTU)
PF09107
(SelB-wing_3) 		3 ARG A 370
GLU A 369
PHE A 350
 None
 0.99A 4kszA-4zu9A:
undetectable		 4kszA-4zu9A:
21.99
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.
5b7s CYSTEINE DESULFURASE

(Thermococcus
onnurineus) 		PF00266
(Aminotran_5) 		3 ARG A 230
GLU A 231
PHE A 234
 GOL  A 401 ( 4.6A)
None
None
 0.98A 4kszA-5b7sA:
undetectable		 4kszA-5b7sA:
21.61
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.
5bn4 NEQ263

(Nanoarchaeum
equitans) 		PF00006
(ATP-synt_ab) 		3 ARG B 142
GLU B 141
PHE B 172
 None
 0.97A 4kszA-5bn4B:
undetectable		 4kszA-5bn4B:
23.05
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.
5boh BETA-LACTAMASE

(Acinetobacter
baumannii) 		PF00905
(Transpeptidase) 		3 ARG A 216
GLU A 239
PHE A 237
 None
 0.98A 4kszA-5bohA:
undetectable		 4kszA-5bohA:
16.89
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.
5clv TRFB TRANSCRIPTIONAL
REPRESSOR PROTEIN

(Escherichia
coli) 		PF16509
(KORA) 		3 ARG A  28
GLU A  25
PHE A  40
 None
 0.66A 4kszA-5clvA:
undetectable		 4kszA-5clvA:
11.19
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.
5cuy ACIDOCALCISOMAL
PYROPHOSPHATASE

(Trypanosoma
brucei) 		PF00719
(Pyrophosphatase) 		3 ARG A 106
GLU A 103
PHE A  88
 None
 0.89A 4kszA-5cuyA:
undetectable		 4kszA-5cuyA:
22.26
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.
5e8l HETERODIMERIC
GERANYLGERANYL
PYROPHOSPHATE
SYNTHASE LARGE
SUBUNIT 1,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF00348
(polyprenyl_synt) 		3 ARG A  44
GLU A  41
PHE A 112
 None
 0.97A 4kszA-5e8lA:
undetectable		 4kszA-5e8lA:
19.74
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.
5eb9 CD8 ALPHA CHAIN

(Gallus gallus) 		PF07686
(V-set) 		3 ARG A  92
GLU A  23
PHE A 119
 None
 0.98A 4kszA-5eb9A:
undetectable		 4kszA-5eb9A:
11.05
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.
5f9s SERINE--PYRUVATE
AMINOTRANSFERASE

(Homo sapiens) 		PF00266
(Aminotran_5) 		3 ARG A 381
GLU A 378
PHE A 343
 None
 0.86A 4kszA-5f9sA:
undetectable		 4kszA-5f9sA:
21.26
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.
5fdn PHOSPHOENOLPYRUVATE
CARBOXYLASE 3

(Arabidopsis
thaliana) 		PF00311
(PEPcase) 		3 ARG A 271
GLU A 270
PHE A 158
 None
 1.02A 4kszA-5fdnA:
0.6		 4kszA-5fdnA:
21.89
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.
5gje LOW-DENSITY
LIPOPROTEIN
RECEPTOR-RELATED
PROTEIN 6

(Homo sapiens) 		PF00058
(Ldl_recept_b)
PF14670
(FXa_inhibition) 		3 ARG A 197
GLU A 161
PHE A 186
 None
 0.99A 4kszA-5gjeA:
undetectable		 4kszA-5gjeA:
23.62
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.
5gwj DNA TOPOISOMERASE
2-BETA

(Homo sapiens) 		PF00521
(DNA_topoisoIV)
PF01751
(Toprim)
PF16898
(TOPRIM_C) 		3 ARG A 729
GLU A 728
PHE A1019
 None
 0.93A 4kszA-5gwjA:
undetectable		 4kszA-5gwjA:
22.34
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.
5izt OUTER SURFACE
PROTEIN

(Borreliella
burgdorferi) 		PF05714
(Borrelia_lipo_1) 		3 ARG A 220
GLU A 221
PHE A 226
 None
 0.96A 4kszA-5iztA:
undetectable		 4kszA-5iztA:
21.86
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.
5jqk PEPTIDASE, PUTATIVE

(Plasmodium
falciparum) 		PF00557
(Peptidase_M24)
PF01321
(Creatinase_N)
PF16188
(Peptidase_M24_C)
PF16189
(Creatinase_N_2) 		3 ARG A 597
GLU A 594
PHE A 685
 None
 0.93A 4kszA-5jqkA:
undetectable		 4kszA-5jqkA:
21.07
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.
5l5n PLEXIN-A4

(Mus musculus) 		PF01403
(Sema)
PF01437
(PSI)
PF01833
(TIG) 		3 ARG A  69
GLU A  45
PHE A  42
 ARG  A  69 ( 0.6A)
GLU  A  45 ( 0.5A)
PHE  A  42 ( 1.3A)
 0.78A 4kszA-5l5nA:
undetectable		 4kszA-5l5nA:
18.88
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.
5mgv PHENYLALANINE--TRNA
LIGASE,
MITOCHONDRIAL

(Homo sapiens) 		PF01409
(tRNA-synt_2d)
PF03147
(FDX-ACB) 		3 ARG A 282
GLU A 281
PHE A 296
 None
 0.97A 4kszA-5mgvA:
undetectable		 4kszA-5mgvA:
20.56
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.
5mwc GENETICALLY-ENCODED
GREEN CALCIUM
INDICATOR NTNC

(synthetic
construct) 		no annotation 3 ARG D 113
GLU D 124
PHE D  22
 None
 0.96A 4kszA-5mwcD:
undetectable		 4kszA-5mwcD:
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.
5n8o DNA HELICASE I

(Escherichia
coli) 		PF07057
(TraI)
PF08751
(TrwC)
PF13604
(AAA_30) 		3 ARG A 198
GLU A 202
PHE A 901
 None
 0.92A 4kszA-5n8oA:
undetectable		 4kszA-5n8oA:
16.31
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.
5ocd -

(-) 		no annotation 3 ARG A  21
GLU A  20
PHE A 194
 None
 0.90A 4kszA-5ocdA:
undetectable		 4kszA-5ocdA:
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.
5u3f BRANCHED-CHAIN-AMINO
-ACID
AMINOTRANSFERASE

(Mycobacterium
tuberculosis) 		PF01063
(Aminotran_4) 		3 ARG A 146
GLU A  78
PHE A 119
 None
 0.78A 4kszA-5u3fA:
undetectable		 4kszA-5u3fA:
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.
5vxk SINGLE-DOMAIN
ANTIBODY JMK-H2

(Vicugna pacos) 		no annotation 3 ARG B 116
GLU B 112
PHE B  37
 None
 0.99A 4kszA-5vxkB:
undetectable		 4kszA-5vxkB:
14.21
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.
5w8x LIPID-A-DISACCHARIDE
SYNTHASE

(Escherichia
coli) 		no annotation 3 ARG A  79
GLU A 107
PHE A  94
 None
 0.89A 4kszA-5w8xA:
undetectable		 4kszA-5w8xA:
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.
5wgx FLAVIN-DEPENDENT
HALOGENASE

(Malbranchea
aurantiaca) 		PF04820
(Trp_halogenase) 		3 ARG A 325
GLU A 261
PHE A 349
 None
 0.87A 4kszA-5wgxA:
undetectable		 4kszA-5wgxA:
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.
5wzk PUMILIO HOMOLOG 23

(Arabidopsis
thaliana) 		no annotation 3 ARG A 125
GLU A 123
PHE A  96
 None
 0.98A 4kszA-5wzkA:
undetectable		 4kszA-5wzkA:
21.92
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.
6aon DIHYDROLIPOYL
DEHYDROGENASE

(Bordetella
pertussis) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		3 ARG A 158
GLU A 159
PHE A 165
 None
 0.87A 4kszA-6aonA:
0.0		 4kszA-6aonA:
20.30
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.
6erc PEROXINECTIN A

(Dictyostelium
discoideum) 		no annotation 3 ARG A 233
GLU A 236
PHE A 352
 HEM  A 604 (-3.1A)
HEM  A 604 (-2.2A)
None
 0.73A 4kszA-6ercA:
39.8		 4kszA-6ercA:
undetectable