SIMILAR PATTERNS OF AMINO ACIDS FOR 5IMS_B_ACTB713_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.
1b0z PROTEIN
(PHOSPHOGLUCOSE
ISOMERASE)

(Geobacillus
stearothermophilus) 		PF00342
(PGI) 		3 GLY A 200
GLN A 413
LYS A 139
 None
 0.97A 5imsB-1b0zA:
3.4		 5imsB-1b0zA:
21.88
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.
1c7j PROTEIN
(PARA-NITROBENZYL
ESTERASE)

(Bacillus
subtilis) 		PF00135
(COesterase) 		3 GLY A 127
GLN A 433
LYS A 441
 None
 0.92A 5imsB-1c7jA:
undetectable		 5imsB-1c7jA:
22.43
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.
1e0k DNA HELICASE

(Escherichia
virus T7) 		PF03796
(DnaB_C) 		3 GLY A 313
GLN A 506
LYS A 318
 None
 0.99A 5imsB-1e0kA:
4.0		 5imsB-1e0kA:
17.63
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.
1efp PROTEIN (ELECTRON
TRANSFER
FLAVOPROTEIN)

(Paracoccus
denitrificans) 		PF00766
(ETF_alpha)
PF01012
(ETF) 		3 GLY A 130
GLN A 243
LYS A 269
 None
 0.86A 5imsB-1efpA:
7.1		 5imsB-1efpA:
20.12
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.
1ffv CUTL, MOLYBDOPROTEIN
OF CARBON MONOXIDE
DEHYDROGENASE

(Hydrogenophaga
pseudoflava) 		PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2) 		3 GLY B 266
GLN B 524
LYS B 271
 PCD  B1920 (-3.6A)
PCD  B1920 (-3.5A)
None
 0.99A 5imsB-1ffvB:
undetectable		 5imsB-1ffvB:
22.38
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.
1gdv CYTOCHROME C6

(Pyropia
yezoensis) 		PF13442
(Cytochrome_CBB3) 		3 GLY A  84
GLN A  80
LYS A  33
 None
 0.93A 5imsB-1gdvA:
undetectable		 5imsB-1gdvA:
9.04
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1jsc ACETOHYDROXY-ACID
SYNTHASE

(Saccharomyces
cerevisiae) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		3 GLY A 116
GLN A 202
LYS A 251
 2HP  A 698 (-3.5A)
2HP  A 698 ( 3.2A)
None
 0.38A 5imsB-1jscA:
57.9		 5imsB-1jscA:
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.
1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT

(Escherichia
coli) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4) 		3 GLY A 977
GLN A 918
LYS A 906
 None
 0.73A 5imsB-1kqfA:
5.8		 5imsB-1kqfA:
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.
1lw3 MYOTUBULARIN-RELATED
PROTEIN 2

(Homo sapiens) 		PF02893
(GRAM)
PF06602
(Myotub-related) 		3 GLY A 334
GLN A 286
LYS A 294
 None
 0.95A 5imsB-1lw3A:
undetectable		 5imsB-1lw3A:
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.
1n21 (+)-BORNYL
DIPHOSPHATE SYNTHASE

(Salvia
officinalis) 		PF01397
(Terpene_synth)
PF03936
(Terpene_synth_C) 		3 GLY A 207
GLN A 169
LYS A 541
 None
 1.00A 5imsB-1n21A:
undetectable		 5imsB-1n21A:
20.28
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.
1ryo SEROTRANSFERRIN

(Homo sapiens) 		PF00405
(Transferrin) 		3 GLY A  34
GLN A 269
LYS A   4
 None
 0.94A 5imsB-1ryoA:
undetectable		 5imsB-1ryoA:
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.
1sqh HYPOTHETICAL PROTEIN
CG14615-PA

(Drosophila
melanogaster) 		PF08445
(FR47) 		3 GLY A 121
GLN A  91
LYS A 298
 None
 0.94A 5imsB-1sqhA:
undetectable		 5imsB-1sqhA:
18.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1tye INTEGRIN BETA-3

(Homo sapiens) 		PF00362
(Integrin_beta)
PF17205
(PSI_integrin) 		3 GLY B 271
GLN B 228
LYS B 298
 None
 0.88A 5imsB-1tyeB:
2.2		 5imsB-1tyeB:
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.
1un1 XYLOGLUCAN
ENDOTRANSGLYCOSYLASE

(Populus tremula) 		PF00722
(Glyco_hydro_16)
PF06955
(XET_C) 		3 GLY A 108
GLN A 165
LYS A 160
 None
 0.84A 5imsB-1un1A:
undetectable		 5imsB-1un1A:
15.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1vec ATP-DEPENDENT RNA
HELICASE P54

(Homo sapiens) 		PF00270
(DEAD) 		3 GLY A 132
GLN A 168
LYS A 135
 None
 0.57A 5imsB-1vecA:
3.5		 5imsB-1vecA:
15.78
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.
1w8j MYOSIN VA

(Gallus gallus) 		PF00063
(Myosin_head) 		3 GLY A 163
GLN A 681
LYS A 169
 None
 0.96A 5imsB-1w8jA:
undetectable		 5imsB-1w8jA:
21.81
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.
1we5 PUTATIVE FAMILY 31
GLUCOSIDASE YICI

(Escherichia
coli) 		PF01055
(Glyco_hydro_31)
PF13802
(Gal_mutarotas_2) 		3 GLY A   6
GLN A  11
LYS A 224
 None
 0.95A 5imsB-1we5A:
1.1		 5imsB-1we5A:
21.75
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.
1zzg GLUCOSE-6-PHOSPHATE
ISOMERASE

(Thermus
thermophilus) 		PF00342
(PGI) 		3 GLY A 185
GLN A 399
LYS A 125
 None
 0.90A 5imsB-1zzgA:
4.7		 5imsB-1zzgA:
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.
2aqx PREDICTED: INOSITOL
1,4,5-TRISPHOSPHATE
3-KINASE B

(Mus musculus) 		PF03770
(IPK) 		3 GLY A 674
GLN A 668
LYS A 687
 None
 0.84A 5imsB-2aqxA:
undetectable		 5imsB-2aqxA:
17.82
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.
2b0t NADP ISOCITRATE
DEHYDROGENASE

(Corynebacterium
glutamicum) 		PF03971
(IDH) 		3 GLY A 709
GLN A 590
LYS A 718
 None
 0.85A 5imsB-2b0tA:
undetectable		 5imsB-2b0tA:
22.92
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.
2b5i INTERLEUKIN-2
RECEPTOR BETA CHAIN

(Homo sapiens) 		no annotation 3 GLY B  65
GLN B  46
LYS B  71
 None
 0.97A 5imsB-2b5iB:
undetectable		 5imsB-2b5iB:
15.13
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.
2e3d UTP--GLUCOSE-1-PHOSP
HATE
URIDYLYLTRANSFERASE

(Escherichia
coli) 		PF00483
(NTP_transferase) 		3 GLY A  17
GLN A 109
LYS A  65
 None
 0.98A 5imsB-2e3dA:
undetectable		 5imsB-2e3dA:
19.15
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.
2et6 (3R)-HYDROXYACYL-COA
DEHYDROGENASE

(Candida
tropicalis) 		PF00106
(adh_short) 		3 GLY A 460
GLN A 464
LYS A 179
 None
 0.94A 5imsB-2et6A:
2.7		 5imsB-2et6A:
22.54
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.
2fon PEROXISOMAL ACYL-COA
OXIDASE 1A

(Solanum
lycopersicum) 		PF01756
(ACOX)
PF02770
(Acyl-CoA_dh_M)
PF14749
(Acyl-CoA_ox_N) 		3 GLY A 425
GLN A 433
LYS A 381
 None
 0.98A 5imsB-2fonA:
undetectable		 5imsB-2fonA:
23.28
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.
2hau SEROTRANSFERRIN

(Homo sapiens) 		PF00405
(Transferrin) 		3 GLY A  34
GLN A 269
LYS A   4
 None
 0.97A 5imsB-2hauA:
undetectable		 5imsB-2hauA:
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.
2jis CYSTEINE SULFINIC
ACID DECARBOXYLASE

(Homo sapiens) 		PF00282
(Pyridoxal_deC) 		3 GLY A 454
GLN A 456
LYS A 442
 None
 0.89A 5imsB-2jisA:
3.7		 5imsB-2jisA:
23.03
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.
2jm1 TRANSCRIPTIONAL
REGULATOR ATRX

(Homo sapiens) 		no annotation 3 GLY A 227
GLN A 219
LYS A 242
 None
 0.98A 5imsB-2jm1A:
undetectable		 5imsB-2jm1A:
11.61
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.
2lv7 CALCIUM-BINDING
PROTEIN 7

(Homo sapiens) 		PF13499
(EF-hand_7) 		3 GLY A  51
GLN A  88
LYS A  43
 None
CA  A 201 ( 4.2A)
None
 0.99A 5imsB-2lv7A:
undetectable		 5imsB-2lv7A:
10.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2okj GLUTAMATE
DECARBOXYLASE 1

(Homo sapiens) 		PF00282
(Pyridoxal_deC) 		3 GLY A 555
GLN A 557
LYS A 543
 None
 0.94A 5imsB-2okjA:
5.0		 5imsB-2okjA:
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.
2omk HYPOTHETICAL PROTEIN

(Bacteroides
thetaiotaomicron) 		PF04263
(TPK_catalytic) 		3 GLY A  56
GLN A  75
LYS A  86
 None
 0.96A 5imsB-2omkA:
2.8		 5imsB-2omkA:
17.59
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.
2pa4 UTP-GLUCOSE-1-PHOSPH
ATE
URIDYLYLTRANSFERASE

(Corynebacterium
glutamicum) 		PF00483
(NTP_transferase) 		3 GLY A  21
GLN A 112
LYS A  69
 UPG  A 326 (-3.4A)
UPG  A 326 (-3.2A)
UPG  A 326 ( 4.3A)
 0.76A 5imsB-2pa4A:
undetectable		 5imsB-2pa4A:
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.
2q8n GLUCOSE-6-PHOSPHATE
ISOMERASE

(Thermotoga
maritima) 		PF00342
(PGI) 		3 GLY A 196
GLN A 415
LYS A 137
 None
 0.93A 5imsB-2q8nA:
2.7		 5imsB-2q8nA:
23.53
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.
2ux8 GLUCOSE-1-PHOSPHATE
URIDYLYLTRANSFERASE

(Sphingomonas
elodea) 		PF00483
(NTP_transferase) 		3 GLY A  15
GLN A 105
LYS A  63
 None
 0.98A 5imsB-2ux8A:
undetectable		 5imsB-2ux8A:
19.88
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.
2vp1 PERIPLASMIC
IRON-BINDING PROTEIN

(Synechocystis
sp. PCC 6803) 		PF13343
(SBP_bac_6) 		3 GLY A  98
GLN A  72
LYS A 270
 None
 0.86A 5imsB-2vp1A:
undetectable		 5imsB-2vp1A:
19.13
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.
2vz9 FATTY ACID SYNTHASE

(Sus scrofa) 		PF00107
(ADH_zinc_N)
PF00109
(ketoacyl-synt)
PF00698
(Acyl_transf_1)
PF02801
(Ketoacyl-synt_C)
PF08242
(Methyltransf_12)
PF08659
(KR)
PF14765
(PS-DH)
PF16197
(KAsynt_C_assoc) 		3 GLY A1963
GLN A1961
LYS A1911
 None
 0.91A 5imsB-2vz9A:
undetectable		 5imsB-2vz9A:
14.71
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.
2wfx HEDGEHOG-INTERACTING
PROTEIN

(Homo sapiens) 		PF07995
(GSDH) 		3 GLY B 275
GLN B 273
LYS B 247
 None
 0.70A 5imsB-2wfxB:
undetectable		 5imsB-2wfxB:
19.79
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.
2yln PUTATIVE ABC
TRANSPORTER,
PERIPLASMIC BINDING
PROTEIN, AMINO ACID

(Neisseria
gonorrhoeae) 		PF00497
(SBP_bac_3) 		3 GLY A 231
GLN A 115
LYS A 129
 GOL  A1283 (-3.4A)
None
GOL  A1283 (-2.7A)
 0.97A 5imsB-2ylnA:
undetectable		 5imsB-2ylnA:
18.90
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.
2zuy YESX PROTEIN

(Bacillus
subtilis) 		PF01839
(FG-GAP) 		3 GLY A 365
GLN A 386
LYS A 393
 None
 0.86A 5imsB-2zuyA:
undetectable		 5imsB-2zuyA:
21.29
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.
2zws NEUTRAL CERAMIDASE

(Pseudomonas
aeruginosa) 		PF04734
(Ceramidase_alk)
PF17048
(Ceramidse_alk_C) 		3 GLY A 151
GLN A 288
LYS A 279
 None
None
GOL  A 657 (-2.9A)
 0.79A 5imsB-2zwsA:
undetectable		 5imsB-2zwsA:
21.90
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.
3bvh FIBRINOGEN GAMMA
CHAIN

(Homo sapiens) 		PF00147
(Fibrinogen_C)
PF08702
(Fib_alpha) 		3 GLY C 188
GLN C 154
LYS C 162
 None
 0.96A 5imsB-3bvhC:
undetectable		 5imsB-3bvhC:
17.25
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.
3cp2 TRNA URIDINE
5-CARBOXYMETHYLAMINO
METHYL MODIFICATION
ENZYME GIDA

(Escherichia
coli) 		PF01134
(GIDA)
PF13932
(GIDA_assoc) 		3 GLY A 376
GLN A 383
LYS A  56
 None
 0.96A 5imsB-3cp2A:
undetectable		 5imsB-3cp2A:
23.68
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3e9y ACETOLACTATE
SYNTHASE,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		3 GLY A 121
GLN A 207
LYS A 256
 None
 0.60A 5imsB-3e9yA:
51.3		 5imsB-3e9yA:
39.05
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.
3ecd SERINE
HYDROXYMETHYLTRANSFE
RASE 2

(Burkholderia
pseudomallei) 		PF00464
(SHMT) 		3 GLY A 316
GLN A 299
LYS A 306
 None
 1.00A 5imsB-3ecdA:
2.4		 5imsB-3ecdA:
21.70
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.
3f5b AMINOGLYCOSIDE
N(6')ACETYLTRANSFERA
SE

(Legionella
pneumophila) 		PF13523
(Acetyltransf_8) 		3 GLY A 107
GLN A 111
LYS A 144
 FMT  A 186 ( 3.7A)
None
None
 0.96A 5imsB-3f5bA:
undetectable		 5imsB-3f5bA:
12.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fbg PUTATIVE ARGINATE
LYASE

(Staphylococcus
haemolyticus) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		3 GLY A 193
GLN A 300
LYS A 170
 None
 0.77A 5imsB-3fbgA:
3.4		 5imsB-3fbgA:
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.
3fvw PUTATIVE
NAD(P)H-DEPENDENT
FMN REDUCTASE

(Streptococcus
mutans) 		PF03358
(FMN_red) 		3 GLY A 148
GLN A 174
LYS A 167
 None
 0.93A 5imsB-3fvwA:
2.2		 5imsB-3fvwA:
15.21
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.
3h5l PUTATIVE
BRANCHED-CHAIN AMINO
ACID ABC TRANSPORTER

(Ruegeria
pomeroyi) 		PF13458
(Peripla_BP_6) 		3 GLY A 430
GLN A 410
LYS A 427
 None
 0.69A 5imsB-3h5lA:
5.4		 5imsB-3h5lA:
21.15
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.
3iv0 SUSD HOMOLOG

(Bacteroides
thetaiotaomicron) 		PF07980
(SusD_RagB)
PF14322
(SusD-like_3) 		3 GLY A 447
GLN A 384
LYS A 365
 None
 0.89A 5imsB-3iv0A:
undetectable		 5imsB-3iv0A:
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.
3jb9 PRE-MRNA-SPLICING
FACTOR CWF11

(Schizosaccharomyces
pombe) 		PF13087
(AAA_12)
PF16399
(Aquarius_N) 		3 GLY X 748
GLN X1045
LYS X 754
 None
 0.83A 5imsB-3jb9X:
undetectable		 5imsB-3jb9X:
18.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kd3 PHOSPHOSERINE
PHOSPHOHYDROLASE-LIK
E PROTEIN

(Francisella
tularensis) 		PF12710
(HAD) 		3 GLY A  46
GLN A 175
LYS A 196
 None
 0.55A 5imsB-3kd3A:
3.3		 5imsB-3kd3A:
19.26
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.
3ksk TYPE-2 RESTRICTION
ENZYME PVUII

(Proteus hauseri) 		PF09225
(Endonuc-PvuII) 		3 GLY A 266
GLN A  17
LYS A 198
 None
 0.91A 5imsB-3kskA:
undetectable		 5imsB-3kskA:
19.12
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.
3mwj HEAT RESISTANT RNA
DEPENDENT ATPASE

(Thermus
thermophilus) 		PF00270
(DEAD) 		3 GLY A  48
GLN A  87
LYS A  51
 None
 0.74A 5imsB-3mwjA:
3.2		 5imsB-3mwjA:
16.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ohg UNCHARACTERIZED
PROTEIN FROM DUF2233
FAMILY

(Bacteroides
ovatus) 		PF09992
(NAGPA) 		3 GLY A 201
GLN A 204
LYS A 259
 None
 0.96A 5imsB-3ohgA:
undetectable		 5imsB-3ohgA:
16.92
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.
3oid ENOYL-[ACYL-CARRIER-
PROTEIN] REDUCTASE
[NADPH]

(Bacillus
subtilis) 		PF13561
(adh_short_C2) 		3 GLY A  81
GLN A   3
LYS A 130
 None
 0.87A 5imsB-3oidA:
4.2		 5imsB-3oidA:
18.16
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.
3r3s OXIDOREDUCTASE

(Salmonella
enterica) 		PF13561
(adh_short_C2) 		3 GLY A 240
GLN A 237
LYS A  20
 None
NAD  A 300 (-3.8A)
None
 0.73A 5imsB-3r3sA:
3.3		 5imsB-3r3sA:
19.59
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.
3u3l TABLYSIN 15

(Tabanus yao) 		PF00188
(CAP) 		3 GLY C  89
GLN C 105
LYS C 109
 None
 0.52A 5imsB-3u3lC:
undetectable		 5imsB-3u3lC:
16.49
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.
3ue3 SEPTUM FORMATION,
PENICILLIN BINDING
PROTEIN 3,
PEPTIDOGLYCAN
SYNTHETASE

(Acinetobacter
sp. ATCC 27244) 		PF00905
(Transpeptidase)
PF03717
(PBP_dimer) 		3 GLY A 509
GLN A 504
LYS A 389
 None
 0.97A 5imsB-3ue3A:
undetectable		 5imsB-3ue3A:
22.67
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.
3utn THIOSULFATE
SULFURTRANSFERASE
TUM1

(Saccharomyces
cerevisiae) 		PF00581
(Rhodanese) 		3 GLY X 175
GLN X 170
LYS X 179
 None
 0.99A 5imsB-3utnX:
undetectable		 5imsB-3utnX:
21.45
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.
3wg6 CONJUGATED
POLYKETONE REDUCTASE
C1

(Candida
parapsilosis) 		PF00248
(Aldo_ket_red) 		3 GLY A 220
GLN A 295
LYS A 291
 None
 0.72A 5imsB-3wg6A:
undetectable		 5imsB-3wg6A:
19.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wks O-PHOSPHO-L-SERYL-TR
NA:CYS-TRNA SYNTHASE

(Methanocaldococcus
jannaschii) 		PF05889
(SepSecS) 		3 GLY A 375
GLN A 380
LYS A 302
 None
 0.98A 5imsB-3wksA:
3.7		 5imsB-3wksA:
22.89
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.
4axs CARBAMATE KINASE

(Mycoplasma
penetrans) 		PF00696
(AA_kinase) 		3 GLY A   9
GLN A  50
LYS A 209
 SO4  A1312 ( 3.6A)
None
SO4  A1311 (-3.2A)
 0.94A 5imsB-4axsA:
2.6		 5imsB-4axsA:
19.91
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.
4d48 GLUCOSE-1-PHOSPHATE
URIDYLYLTRANSFERASE

(Erwinia
amylovora) 		PF00483
(NTP_transferase) 		3 GLY A  17
GLN A 109
LYS A  65
 None
 0.93A 5imsB-4d48A:
undetectable		 5imsB-4d48A:
19.09
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.
4m75 U6 SNRNA-ASSOCIATED
SM-LIKE PROTEIN LSM6
U6 SNRNA-ASSOCIATED
SM-LIKE PROTEIN LSM5

(Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae) 		PF01423
(LSM)
PF01423
(LSM) 		3 GLY E  69
GLN E  66
LYS D  85
 None
 0.91A 5imsB-4m75E:
undetectable		 5imsB-4m75E:
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.
4nox EUKARYOTIC
TRANSLATION
INITIATION FACTOR 3
SUBUNIT B

(Chaetomium
thermophilum) 		PF08662
(eIF2A) 		3 GLY A 370
GLN A 367
LYS A 451
 None
 0.90A 5imsB-4noxA:
undetectable		 5imsB-4noxA:
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.
4oc9 PUTATIVE
O-ACETYLHOMOSERINE
(THIOL)-LYASE

(Campylobacter
jejuni) 		PF01053
(Cys_Met_Meta_PP) 		3 GLY A 395
GLN A 392
LYS A 106
 None
 1.00A 5imsB-4oc9A:
3.6		 5imsB-4oc9A:
21.96
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.
4oua PROTEOLYTICALLY
ACTIVATED FORM OF
PPO4 TYROSINASE

(Agaricus
bisporus) 		PF00264
(Tyrosinase) 		3 GLY A  11
GLN A 103
LYS A  14
 None
 0.93A 5imsB-4ouaA:
undetectable		 5imsB-4ouaA:
19.88
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.
4um8 INTEGRIN BETA-6

(Homo sapiens) 		PF00362
(Integrin_beta)
PF17205
(PSI_integrin) 		3 GLY B 274
GLN B 231
LYS B 301
 None
 0.95A 5imsB-4um8B:
3.0		 5imsB-4um8B:
21.66
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.
4wk0 INTEGRIN BETA-1

(Homo sapiens) 		PF00362
(Integrin_beta)
PF17205
(PSI_integrin) 		3 GLY B 279
GLN B 237
LYS B 305
 None
 0.85A 5imsB-4wk0B:
3.9		 5imsB-4wk0B:
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.
4xgc ORIGIN RECOGNITION
COMPLEX SUBUNIT 1

(Drosophila
melanogaster) 		PF00004
(AAA)
PF09079
(Cdc6_C) 		3 GLY A 598
GLN A 743
LYS A 604
 None
 1.00A 5imsB-4xgcA:
2.8		 5imsB-4xgcA:
22.69
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.
4ypl LON PROTEASE

(Meiothermus
taiwanensis) 		PF00004
(AAA)
PF05362
(Lon_C) 		3 GLY A 716
GLN A 742
LYS A 721
 None
None
4KZ  A 801 (-3.4A)
 0.84A 5imsB-4yplA:
undetectable		 5imsB-4yplA:
23.25
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.
5ao5 C-TYPE MANNOSE
RECEPTOR 2

(Homo sapiens) 		PF00040
(fn2)
PF00059
(Lectin_C) 		3 GLY A 413
GLN A 397
LYS A 506
 None
 0.73A 5imsB-5ao5A:
undetectable		 5imsB-5ao5A:
19.97
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.
5b3f PHOSPHORIBULOKINASE/
URIDINE KINASE

(Methanospirillum
hungatei) 		PF00485
(PRK) 		3 GLY A 121
GLN A 184
LYS A  30
 None
None
SO4  A 401 (-2.7A)
 0.91A 5imsB-5b3fA:
undetectable		 5imsB-5b3fA:
20.54
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.
5cb2 PROTEIN SEY1

(Candida
albicans) 		PF05879
(RHD3) 		3 GLY A  65
GLN A 161
LYS A  71
 None
None
GNP  A 702 (-3.7A)
 0.92A 5imsB-5cb2A:
3.6		 5imsB-5cb2A:
21.64
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.
5cnx AMINOPEPTIDASE YPDF

(Escherichia
coli) 		PF00557
(Peptidase_M24)
PF01321
(Creatinase_N) 		3 GLY A 295
GLN A  28
LYS A 128
 None
 0.91A 5imsB-5cnxA:
undetectable		 5imsB-5cnxA:
20.41
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.
5e6s INTEGRIN BETA-2

(Homo sapiens) 		PF00362
(Integrin_beta)
PF17205
(PSI_integrin) 		3 GLY B 262
GLN B 220
LYS B 288
 None
 0.98A 5imsB-5e6sB:
2.6		 5imsB-5e6sB:
22.89
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.
5e9w MRNA CAP GUANINE-N7
METHYLTRANSFERASE

(Homo sapiens) 		PF03291
(Pox_MCEL) 		3 GLY A 311
GLN A 476
LYS A 194
 None
 0.87A 5imsB-5e9wA:
3.2		 5imsB-5e9wA:
16.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ffo INTEGRIN BETA-6

(Homo sapiens) 		PF00362
(Integrin_beta) 		3 GLY B 274
GLN B 231
LYS B 301
 None
 0.91A 5imsB-5ffoB:
3.5		 5imsB-5ffoB:
17.23
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.
5fv0 ESSC

(Geobacillus
thermodenitrificans) 		PF01580
(FtsK_SpoIIIE) 		3 GLY A1420
GLN A1383
LYS A1429
 None
 0.98A 5imsB-5fv0A:
2.6		 5imsB-5fv0A:
23.17
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.
5gru DIABODY PROTEIN
DIABODY PROTEIN

(Homo sapiens;
Mus musculus) 		PF07686
(V-set)
PF07686
(V-set) 		3 GLY H 130
GLN H  13
LYS L  65
 GLY  H 130 ( 0.0A)
GLN  H  13 ( 0.6A)
LYS  L  65 ( 0.0A)
 0.94A 5imsB-5gruH:
undetectable		 5imsB-5gruH:
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.
5gv3 LYSOSOME-ASSOCIATED
MEMBRANE
GLYCOPROTEIN 2

(Mus musculus) 		PF01299
(Lamp) 		3 GLY A  72
GLN A  87
LYS A  83
 None
 0.93A 5imsB-5gv3A:
undetectable		 5imsB-5gv3A:
14.19
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.
5gy0 GLUCANASE

(Ruminiclostridium
thermocellum) 		PF00759
(Glyco_hydro_9)
PF00942
(CBM_3) 		3 GLY A  72
GLN A  48
LYS A  82
 None
 0.95A 5imsB-5gy0A:
undetectable		 5imsB-5gy0A:
21.21
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.
5i99 CONTACTIN-3

(Mus musculus) 		PF00041
(fn3)
PF07679
(I-set)
PF13927
(Ig_3) 		3 GLY A 556
GLN A 522
LYS A 553
 None
 1.00A 5imsB-5i99A:
undetectable		 5imsB-5i99A:
21.28
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.
5j11 THYMIC STROMAL
LYMPHOPOIETIN

(Homo sapiens) 		PF15216
(TSLP) 		3 GLY A  89
GLN A 140
LYS A 134
 None
 0.70A 5imsB-5j11A:
undetectable		 5imsB-5j11A:
13.47
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.
5k1c WD REPEAT-CONTAINING
PROTEIN 20

(Homo sapiens) 		PF00400
(WD40) 		3 GLY C 263
GLN C 240
LYS C 259
 None
 0.90A 5imsB-5k1cC:
undetectable		 5imsB-5k1cC:
23.82
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.
5ktl 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE

(Trichormus
variabilis) 		PF00701
(DHDPS) 		3 GLY A   5
GLN A 218
LYS A 203
 None
 0.90A 5imsB-5ktlA:
undetectable		 5imsB-5ktlA:
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.
5l22 ABC TRANSPORTER
(HLYB SUBFAMILY)

(Aquifex
aeolicus) 		no annotation 3 GLY B 366
GLN B 541
LYS B 372
 None
None
ADP  B 601 (-2.5A)
 0.93A 5imsB-5l22B:
undetectable		 5imsB-5l22B:
22.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5lug SPINDLIN-LIKE
PROTEIN 2, ISOFORM
CRA_A

(Homo sapiens) 		PF02513
(Spin-Ssty) 		3 GLY A 208
GLN A 231
LYS A 212
 None
 0.76A 5imsB-5lugA:
undetectable		 5imsB-5lugA:
15.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5m32 PROTEASOME SUBUNIT
BETA TYPE-2

(Homo sapiens) 		PF00227
(Proteasome) 		3 GLY J 112
GLN J   8
LYS J 185
 None
 0.99A 5imsB-5m32J:
undetectable		 5imsB-5m32J:
15.05
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.
5mrw POTASSIUM-TRANSPORTI
NG ATPASE
POTASSIUM-BINDING
SUBUNIT

(Escherichia
coli) 		PF03814
(KdpA) 		3 GLY A 234
GLN A 129
LYS A 226
 None
 0.58A 5imsB-5mrwA:
undetectable		 5imsB-5mrwA:
22.71
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.
5msy GLYCOSIDE HYDROLASE

(Bacteroides
thetaiotaomicron) 		PF12904
(Collagen_bind_2)
PF13204
(DUF4038) 		3 GLY A 156
GLN A 162
LYS A 193
 None
 0.83A 5imsB-5msyA:
undetectable		 5imsB-5msyA:
19.58
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.
5o6b ATP-DEPENDENT DNA
HELICASE PIF1

(Saccharomyces
cerevisiae) 		no annotation 3 GLY A 258
GLN A 413
LYS A 264
 None
None
ALF  A1002 ( 2.7A)
 0.94A 5imsB-5o6bA:
undetectable		 5imsB-5o6bA:
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.
5uj7 ORIGIN RECOGNITION
COMPLEX SUBUNIT 1

(Homo sapiens) 		PF00004
(AAA)
PF09079
(Cdc6_C) 		3 GLY A 534
GLN A 679
LYS A 540
 None
None
ATP  A 900 (-3.0A)
 0.87A 5imsB-5uj7A:
undetectable		 5imsB-5uj7A:
21.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ujm ORIGIN RECOGNITION
COMPLEX SUBUNIT 1

(Homo sapiens) 		PF00004
(AAA)
PF09079
(Cdc6_C) 		3 GLY A 534
GLN A 679
LYS A 540
 None
None
ATP  A 901 (-3.0A)
 0.88A 5imsB-5ujmA:
undetectable		 5imsB-5ujmA:
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.
5vc2 SERINE
HYDROXYMETHYLTRANSFE
RASE

(Helicobacter
pylori) 		PF00464
(SHMT) 		3 GLY A 308
GLN A 291
LYS A 298
 None
 0.89A 5imsB-5vc2A:
undetectable		 5imsB-5vc2A:
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.
5vj1 MDCA

(Pseudomonas
aeruginosa) 		PF16957
(Mal_decarbox_Al) 		3 GLY A 386
GLN A 419
LYS A 415
 None
 0.83A 5imsB-5vj1A:
undetectable		 5imsB-5vj1A:
23.27
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.
6bgd GLUCOSE/GALACTOSE-BI
NDING LIPOPROTEIN

(Treponema
pallidum) 		no annotation 3 GLY A 104
GLN A 119
LYS A 116
 None
 0.87A 5imsB-6bgdA:
2.8		 5imsB-6bgdA:
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.
6bwf -

(-) 		no annotation 3 GLY A 299
GLN A 297
LYS A 305
 None
 0.86A 5imsB-6bwfA:
undetectable		 5imsB-6bwfA:
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.
6eon BETA-GALACTOSIDASE

(Bacteroides
thetaiotaomicron) 		no annotation 3 GLY A 171
GLN A 106
LYS A  26
 None
 0.95A 5imsB-6eonA:
undetectable		 5imsB-6eonA:
23.01
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.
6epc PROTEASOME (PROSOME,
MACROPAIN) 26S
SUBUNIT, NON-ATPASE,
12

(Rattus
norvegicus) 		no annotation 3 GLY P  38
GLN P  41
LYS P  78
 None
 1.00A 5imsB-6epcP:
undetectable		 5imsB-6epcP:
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.
6fos PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A2

(Cyanidioschyzon
merolae) 		no annotation 3 GLY B 316
GLN B 322
LYS B 300
 None
 0.83A 5imsB-6fosB:
undetectable		 5imsB-6fosB:
undetectable