SIMILAR PATTERNS OF AMINO ACIDS FOR 3C6G_A_VD3A701_2

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.
1crk CREATINE KINASE

(Gallus gallus) 		PF00217
(ATP-gua_Ptrans)
PF02807
(ATP-gua_PtransN) 		3 MET A 241
VAL A 352
GLU A 118
 None
 0.86A 3c6gA-1crkA:
0.0		 3c6gA-1crkA:
20.65
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.
1ddg SULFITE REDUCTASE
(NADPH) FLAVOPROTEIN
ALPHA-COMPONENT

(Escherichia
coli) 		PF00175
(NAD_binding_1)
PF00667
(FAD_binding_1) 		3 MET A 471
VAL A 506
GLU A 501
 None
 0.86A 3c6gA-1ddgA:
0.0		 3c6gA-1ddgA:
21.19
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.
1gpe PROTEIN (GLUCOSE
OXIDASE)

(Penicillium
amagasakiense) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		3 MET A 528
VAL A 398
GLU A 531
 None
 0.89A 3c6gA-1gpeA:
0.0		 3c6gA-1gpeA:
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.
1gyq PROTEIN
(GLYCERALDEHYDE-3-PH
OSPHATE
DEHYDROGENASE)

(Leishmania
mexicana) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		3 MET A 146
VAL A 161
GLU A 152
 None
 0.90A 3c6gA-1gyqA:
0.0		 3c6gA-1gyqA:
19.60
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.
1qsa PROTEIN (SOLUBLE
LYTIC
TRANSGLYCOSYLASE
SLT70)

(Escherichia
coli) 		PF01464
(SLT)
PF14718
(SLT_L) 		3 MET A 385
VAL A 408
GLU A 403
 None
 0.69A 3c6gA-1qsaA:
0.0		 3c6gA-1qsaA:
20.53
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.
1rh9 ENDO-BETA-MANNANASE

(Solanum
lycopersicum) 		PF00150
(Cellulase) 		3 MET A 367
VAL A 362
GLU A 380
 None
 0.81A 3c6gA-1rh9A:
0.0		 3c6gA-1rh9A:
21.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1rpn GDP-MANNOSE
4,6-DEHYDRATASE

(Pseudomonas
aeruginosa) 		PF16363
(GDP_Man_Dehyd) 		3 MET A 255
VAL A 313
GLU A 261
 None
 0.71A 3c6gA-1rpnA:
undetectable		 3c6gA-1rpnA:
20.24
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.
1suu DNA GYRASE SUBUNIT A

(Borreliella
burgdorferi) 		PF03989
(DNA_gyraseA_C) 		3 MET A 727
VAL A 759
GLU A 784
 None
 0.86A 3c6gA-1suuA:
0.0		 3c6gA-1suuA:
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.
1t3v CONSERVED
HYPOTHETICAL PROTEIN

(Thermotoga
maritima) 		PF02579
(Nitro_FeMo-Co) 		3 MET A  84
VAL A  68
GLU A  82
 None
 0.76A 3c6gA-1t3vA:
0.0		 3c6gA-1t3vA:
13.15
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.
1ulz PYRUVATE CARBOXYLASE
N-TERMINAL DOMAIN

(Aquifex
aeolicus) 		PF00289
(Biotin_carb_N)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		3 MET A 288
VAL A 258
GLU A 209
 None
 0.91A 3c6gA-1ulzA:
undetectable		 3c6gA-1ulzA:
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.
1v5x PHOSPHORIBOSYLANTHRA
NILATE ISOMERASE

(Thermus
thermophilus) 		PF00697
(PRAI) 		3 MET A  71
VAL A  93
GLU A  66
 None
 0.66A 3c6gA-1v5xA:
undetectable		 3c6gA-1v5xA:
18.53
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.
1xkd ISOCITRATE
DEHYDROGENASE

(Aeropyrum
pernix) 		PF00180
(Iso_dh) 		3 MET A 213
VAL A 302
GLU A 218
 None
 0.81A 3c6gA-1xkdA:
undetectable		 3c6gA-1xkdA:
21.54
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.
1xr4 PUTATIVE CITRATE
LYASE ALPHA
CHAIN/CITRATE-ACP
TRANSFERASE

(Salmonella
enterica) 		PF04223
(CitF) 		3 MET A 289
VAL A 281
GLU A 259
 None
 0.85A 3c6gA-1xr4A:
undetectable		 3c6gA-1xr4A:
20.48
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.
1y6z HEAT SHOCK PROTEIN,
PUTATIVE

(Plasmodium
falciparum) 		PF00183
(HSP90) 		3 MET A 134
VAL A 174
GLU A 169
 None
 0.87A 3c6gA-1y6zA:
undetectable		 3c6gA-1y6zA:
19.96
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.
1y8p [PYRUVATE
DEHYDROGENASE
[LIPOAMIDE]] KINASE
ISOZYME 3

(Homo sapiens) 		PF02518
(HATPase_c)
PF10436
(BCDHK_Adom3) 		3 MET A  47
VAL A 104
GLU A  95
 None
 0.69A 3c6gA-1y8pA:
undetectable		 3c6gA-1y8pA:
21.47
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.
2b8e CATION-TRANSPORTING
ATPASE

(Archaeoglobus
fulgidus) 		PF00702
(Hydrolase) 		3 MET A 506
VAL A 532
GLU A 491
 None
 0.86A 3c6gA-2b8eA:
undetectable		 3c6gA-2b8eA:
21.59
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.
2bjo ORGANIC
HYDROPEROXIDE
RESISTANCE PROTEIN
OHRB

(Bacillus
subtilis) 		PF02566
(OsmC) 		3 MET A  82
VAL A 129
GLU A  45
 None
 0.69A 3c6gA-2bjoA:
undetectable		 3c6gA-2bjoA:
12.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2e3d UTP--GLUCOSE-1-PHOSP
HATE
URIDYLYLTRANSFERASE

(Escherichia
coli) 		PF00483
(NTP_transferase) 		3 MET A 155
VAL A 169
GLU A 255
 None
 0.87A 3c6gA-2e3dA:
undetectable		 3c6gA-2e3dA:
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.
2fg1 CONSERVED
HYPOTHETICAL PROTEIN
BT1257

(Bacteroides
thetaiotaomicron) 		PF01661
(Macro) 		3 MET A  79
VAL A  20
GLU A 106
 None
 0.82A 3c6gA-2fg1A:
undetectable		 3c6gA-2fg1A:
17.99
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.
2fr1 ERYTHROMYCIN
SYNTHASE, ERYAI

(Saccharopolyspora
erythraea) 		PF08659
(KR) 		3 MET A1864
VAL A1450
GLU A1867
 None
 0.75A 3c6gA-2fr1A:
undetectable		 3c6gA-2fr1A:
21.16
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.
2i99 MU-CRYSTALLIN
HOMOLOG

(Homo sapiens) 		PF02423
(OCD_Mu_crystall) 		3 MET A 295
VAL A 248
GLU A 257
 None
 0.67A 3c6gA-2i99A:
undetectable		 3c6gA-2i99A:
21.55
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.
2j1q ARGININE KINASE

(Trypanosoma
cruzi) 		PF00217
(ATP-gua_Ptrans)
PF02807
(ATP-gua_PtransN) 		3 MET A 159
VAL A 152
GLU A 255
 None
 0.86A 3c6gA-2j1qA:
undetectable		 3c6gA-2j1qA:
22.06
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.
2jvl TRMBF1

(Trichoderma
reesei) 		PF01381
(HTH_3) 		3 MET A  98
VAL A 135
GLU A  95
 None
 0.91A 3c6gA-2jvlA:
undetectable		 3c6gA-2jvlA:
14.43
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.
2po2 PROBABLE EXOSOME
COMPLEX EXONUCLEASE
2

(Pyrococcus
abyssi) 		PF01138
(RNase_PH)
PF03725
(RNase_PH_C) 		3 MET B 125
VAL B 189
GLU B 185
 None
 0.71A 3c6gA-2po2B:
undetectable		 3c6gA-2po2B:
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.
2qeu PUTATIVE
CARBOXYMUCONOLACTONE
DECARBOXYLASE

(Paraburkholderia
xenovorans) 		PF02627
(CMD) 		3 MET A  92
VAL A  72
GLU A 100
 None
 0.90A 3c6gA-2qeuA:
undetectable		 3c6gA-2qeuA:
15.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vbi PYRUVATE
DECARBOXYLASE

(Acetobacter
pasteurianus) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		3 MET A 406
VAL A 402
GLU A 383
 None
 0.90A 3c6gA-2vbiA:
undetectable		 3c6gA-2vbiA:
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.
2voy CATION-TRANSPORTING
ATPASE

(Archaeoglobus
fulgidus) 		PF00702
(Hydrolase) 		3 MET J 506
VAL J 532
GLU J 491
 None
 0.87A 3c6gA-2voyJ:
undetectable		 3c6gA-2voyJ:
15.27
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.
2vpw NRFC PROTEIN
THIOSULFATE
REDUCTASE

(Thermus
thermophilus) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4)
PF13247
(Fer4_11) 		3 MET B  25
VAL A  62
GLU A  66
 None
 0.70A 3c6gA-2vpwB:
undetectable		 3c6gA-2vpwB:
17.86
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.
2wvg PYRUVATE
DECARBOXYLASE

(Zymomonas
mobilis) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		3 MET A 410
VAL A 406
GLU A 387
 None
 0.83A 3c6gA-2wvgA:
undetectable		 3c6gA-2wvgA:
22.44
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.
2xdf PHOSPHOENOLPYRUVATE-
PROTEIN
PHOSPHOTRANSFERASE

(Escherichia
coli) 		PF00391
(PEP-utilizers)
PF02896
(PEP-utilizers_C)
PF05524
(PEP-utilisers_N) 		3 MET A 501
VAL A 488
GLU A 431
 None
 0.84A 3c6gA-2xdfA:
undetectable		 3c6gA-2xdfA:
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.
3aux DNA DOUBLE-STRAND
BREAK REPAIR RAD50
ATPASE

(Methanocaldococcus
jannaschii) 		PF13476
(AAA_23) 		3 MET A  10
VAL A1001
GLU A   7
 None
 0.91A 3c6gA-3auxA:
undetectable		 3c6gA-3auxA:
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.
3d34 SPONDIN-2

(Homo sapiens) 		PF06468
(Spond_N) 		3 MET A  57
VAL A  97
GLU A  83
 None
 0.86A 3c6gA-3d34A:
undetectable		 3c6gA-3d34A:
19.20
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.
3gd7 FUSION COMPLEX OF
CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR, RESIDUES
1193-1427 AND
MALTOSE/MALTODEXTRIN
IMPORT ATP-BINDING
PROTEIN MALK,
RESIDUES 219-371

(Escherichia
coli;
Homo sapiens) 		PF00005
(ABC_tran)
PF08402
(TOBE_2) 		3 MET A1469
VAL A1507
GLU A1466
 None
 0.87A 3c6gA-3gd7A:
undetectable		 3c6gA-3gd7A:
21.59
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.
3ge6 NITROREDUCTASE

(Exiguobacterium
sibiricum) 		PF00881
(Nitroreductase) 		3 MET A  33
VAL A 151
GLU A  38
 None
 0.78A 3c6gA-3ge6A:
undetectable		 3c6gA-3ge6A:
17.86
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.
3gge PDZ
DOMAIN-CONTAINING
PROTEIN GIPC2

(Homo sapiens) 		PF00595
(PDZ) 		3 MET A 193
VAL A 178
GLU A 163
 None
 0.91A 3c6gA-3ggeA:
undetectable		 3c6gA-3ggeA:
12.29
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.
3guv SITE-SPECIFIC
RECOMBINASE,
RESOLVASE FAMILY
PROTEIN

(Streptococcus
pneumoniae) 		PF00239
(Resolvase) 		3 MET A  32
VAL A  80
GLU A  46
 None
 0.88A 3c6gA-3guvA:
undetectable		 3c6gA-3guvA:
16.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hkm OS03G0854200 PROTEIN

(Oryza sativa) 		PF01138
(RNase_PH) 		3 MET A 203
VAL A 151
GLU A 206
 None
 0.73A 3c6gA-3hkmA:
undetectable		 3c6gA-3hkmA:
19.14
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.
3iic CHEC DOMAIN PROTEIN

(Shewanella
loihica) 		PF13690
(CheX) 		3 MET A  73
VAL A  85
GLU A  68
 None
 0.91A 3c6gA-3iicA:
undetectable		 3c6gA-3iicA:
14.50
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.
3j09 COPPER-EXPORTING
P-TYPE ATPASE A

(Archaeoglobus
fulgidus) 		PF00122
(E1-E2_ATPase)
PF00403
(HMA)
PF00702
(Hydrolase) 		3 MET A 506
VAL A 532
GLU A 491
 None
 0.87A 3c6gA-3j09A:
undetectable		 3c6gA-3j09A:
21.74
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.
3ln6 GLUTATHIONE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
GSHAB

(Streptococcus
agalactiae) 		PF01071
(GARS_A)
PF04262
(Glu_cys_ligase) 		3 MET A 688
VAL A 695
GLU A 686
 None
 0.74A 3c6gA-3ln6A:
undetectable		 3c6gA-3ln6A:
19.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3oyt 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE I

(Yersinia pestis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		3 MET A 331
VAL A  22
GLU A 343
 None
None
K  A 408 (-3.5A)
 0.91A 3c6gA-3oytA:
undetectable		 3c6gA-3oytA:
22.61
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.
3pry HEAT SHOCK PROTEIN
HSP 90-BETA

(Homo sapiens) 		PF00183
(HSP90) 		3 MET A 466
VAL A 511
GLU A 471
 None
 0.91A 3c6gA-3pryA:
undetectable		 3c6gA-3pryA:
22.20
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.
3q3h HMW1C-LIKE
GLYCOSYLTRANSFERASE

(Actinobacillus
pleuropneumoniae) 		no annotation 3 MET A 323
VAL A 318
GLU A 328
 None
 0.82A 3c6gA-3q3hA:
undetectable		 3c6gA-3q3hA:
22.16
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.
3q4t ACTIVIN RECEPTOR
TYPE-2A

(Homo sapiens) 		PF00069
(Pkinase) 		3 MET A 482
VAL A 475
GLU A 456
 None
 0.88A 3c6gA-3q4tA:
undetectable		 3c6gA-3q4tA:
20.53
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.
3qi6 CYSTATHIONINE
GAMMA-SYNTHASE METB
(CGS)

(Mycobacterium
ulcerans) 		PF01053
(Cys_Met_Meta_PP) 		3 MET A 262
VAL A 371
GLU A 267
 None
 0.56A 3c6gA-3qi6A:
undetectable		 3c6gA-3qi6A:
22.20
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.
3r97 MALONYL COA-ACP
TRANSACYLASE

(Xanthomonas
oryzae) 		PF00698
(Acyl_transf_1) 		3 MET A 123
VAL A 198
GLU A  62
 None
 0.84A 3c6gA-3r97A:
undetectable		 3c6gA-3r97A:
21.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rlf MALTOSE/MALTODEXTRIN
IMPORT ATP-BINDING
PROTEIN MALK

(Escherichia
coli) 		PF00005
(ABC_tran)
PF08402
(TOBE_2) 		3 MET A 260
VAL A 298
GLU A 257
 None
 0.59A 3c6gA-3rlfA:
undetectable		 3c6gA-3rlfA:
19.64
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.
3rpl D-FRUCTOSE
1,6-BISPHOSPHATASE
CLASS
2/SEDOHEPTULOSE
1,7-BISPHOSPHATASE

(Synechocystis
sp. PCC 6803) 		PF03320
(FBPase_glpX) 		3 MET A  44
VAL A  13
GLU A   8
 None
 0.81A 3c6gA-3rplA:
undetectable		 3c6gA-3rplA:
21.34
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.
3tdm COMPUTATIONALLY
DESIGNED TWO-FOLD
SYMMETRIC TIM-BARREL
PROTEIN, FLR (HALF
MOLECULE)

(synthetic
construct) 		PF00977
(His_biosynth) 		3 MET A  86
VAL A 100
GLU A  91
 None
 0.89A 3c6gA-3tdmA:
undetectable		 3c6gA-3tdmA:
14.10
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.
3tz1 TROPONIN C

(Chlamys
nipponensis) 		PF13499
(EF-hand_7) 		3 MET A 147
VAL A 138
GLU A 129
 None
 0.83A 3c6gA-3tz1A:
undetectable		 3c6gA-3tz1A:
10.17
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.
3u37 ACETYL-XYLAN
ESTERASE EST2A

(Butyrivibrio
proteoclasticus) 		PF13472
(Lipase_GDSL_2) 		3 MET A  90
VAL A  43
GLU A  47
 None
 0.75A 3c6gA-3u37A:
undetectable		 3c6gA-3u37A:
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.
3u9i MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME,
C-TERMINAL DOMAIN
PROTEIN

(Roseiflexus sp.
RS-1) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 MET A 282
VAL A 317
GLU A 109
 None
 0.77A 3c6gA-3u9iA:
undetectable		 3c6gA-3u9iA:
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.
3vte TETRAHYDROCANNABINOL
IC ACID SYNTHASE

(Cannabis sativa) 		PF01565
(FAD_binding_4)
PF08031
(BBE) 		3 MET A 397
VAL A 465
GLU A 402
 None
 0.70A 3c6gA-3vteA:
undetectable		 3c6gA-3vteA:
23.08
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.
4aej COLLAGEN
ALPHA-1(III) CHAIN

(Homo sapiens) 		PF01410
(COLFI) 		3 MET A  75
VAL A  71
GLU A  79
 None
None
GOL  A1246 (-3.1A)
 0.83A 3c6gA-4aejA:
undetectable		 3c6gA-4aejA:
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.
4bva THIOMORPHOLINE-CARBO
XYLATE DEHYDROGENASE

(Mus musculus) 		PF02423
(OCD_Mu_crystall) 		3 MET A 294
VAL A 247
GLU A 256
 None
None
T3  A1314 (-3.7A)
 0.72A 3c6gA-4bvaA:
undetectable		 3c6gA-4bvaA:
21.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4cgy DNA TOPOISOMERASE
3-ALPHA

(Homo sapiens) 		PF01131
(Topoisom_bac)
PF01751
(Toprim) 		3 MET A 575
VAL A 616
GLU A 578
 None
 0.90A 3c6gA-4cgyA:
undetectable		 3c6gA-4cgyA:
20.10
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.
4cok PYRUVATE
DECARBOXYLASE

(Gluconacetobacter
diazotrophicus) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		3 MET A 406
VAL A 402
GLU A 383
 None
 0.86A 3c6gA-4cokA:
undetectable		 3c6gA-4cokA:
19.47
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.
4d48 GLUCOSE-1-PHOSPHATE
URIDYLYLTRANSFERASE

(Erwinia
amylovora) 		PF00483
(NTP_transferase) 		3 MET A 155
VAL A 169
GLU A 255
 None
 0.87A 3c6gA-4d48A:
undetectable		 3c6gA-4d48A:
21.52
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.
4ed9 CAIB/BAIF FAMILY
PROTEIN

(Brucella suis) 		PF02515
(CoA_transf_3) 		3 MET A 202
VAL A  23
GLU A  99
 None
None
EDO  A 404 (-4.1A)
 0.81A 3c6gA-4ed9A:
undetectable		 3c6gA-4ed9A:
22.12
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.
4evz HISF-LUCA

(synthetic
construct) 		PF00977
(His_biosynth) 		3 MET A  62
VAL A  33
GLU A  67
 None
 0.89A 3c6gA-4evzA:
undetectable		 3c6gA-4evzA:
21.47
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.
4eye PROBABLE
OXIDOREDUCTASE

(Mycobacteroides
abscessus) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		3 MET A 288
VAL A 182
GLU A 115
 None
 0.82A 3c6gA-4eyeA:
undetectable		 3c6gA-4eyeA:
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.
4f0l AMIDOHYDROLASE

(Brucella
abortus) 		PF01979
(Amidohydro_1) 		3 MET A 278
VAL A 238
GLU A 258
 None
 0.75A 3c6gA-4f0lA:
undetectable		 3c6gA-4f0lA:
22.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4f1n KPAGO

(Vanderwaltozyma
polyspora) 		PF02171
(Piwi) 		3 MET A 646
VAL A 649
GLU A 661
 None
 0.75A 3c6gA-4f1nA:
undetectable		 3c6gA-4f1nA:
17.92
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.
4fc2 POLY(ADP-RIBOSE)
GLYCOHYDROLASE

(Mus musculus) 		PF05028
(PARG_cat) 		3 MET A 907
VAL A 953
GLU A 913
 None
 0.90A 3c6gA-4fc2A:
undetectable		 3c6gA-4fc2A:
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.
4fx5 VON WILLEBRAND
FACTOR TYPE A

(Catenulispora
acidiphila) 		PF13768
(VWA_3) 		3 MET A 358
VAL A 435
GLU A 390
 None
 0.77A 3c6gA-4fx5A:
undetectable		 3c6gA-4fx5A:
19.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4j8q PUTATIVE
UNCHARACTERIZED
PROTEIN

(Bacteroides
fragilis) 		PF12667
(NigD_N)
PF17415
(NigD_C) 		3 MET A 159
VAL A 107
GLU A 175
 None
 0.74A 3c6gA-4j8qA:
undetectable		 3c6gA-4j8qA:
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.
4nar PUTATIVE URONATE
ISOMERASE

(Thermotoga
maritima) 		PF09861
(DUF2088) 		3 MET A 298
VAL A 375
GLU A 372
 None
 0.90A 3c6gA-4narA:
undetectable		 3c6gA-4narA:
22.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4oer NIKA PROTEIN

(Brucella suis) 		PF00496
(SBP_bac_5) 		3 MET A 233
VAL A 473
GLU A 228
 None
 0.71A 3c6gA-4oerA:
undetectable		 3c6gA-4oerA:
23.52
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.
4um2 TELOMERASE-BINDING
PROTEIN EST1A

(Homo sapiens) 		PF10373
(EST1_DNA_bind)
PF10374
(EST1) 		3 MET A 939
VAL A1026
GLU A1021
 None
 0.91A 3c6gA-4um2A:
undetectable		 3c6gA-4um2A:
20.45
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.
4wcw RIBOSOMAL SILENCING
FACTOR RSFS

(Mycobacterium
tuberculosis) 		PF02410
(RsfS) 		3 MET A  63
VAL A  91
GLU A  58
 None
 0.86A 3c6gA-4wcwA:
undetectable		 3c6gA-4wcwA:
12.94
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.
4x8i LYSYL AMINOPEPTIDASE

(Pyrococcus
furiosus) 		PF05343
(Peptidase_M42) 		3 MET A 342
VAL A 225
GLU A 196
 None
 0.91A 3c6gA-4x8iA:
undetectable		 3c6gA-4x8iA:
22.61
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.
4xox 3-OXOACYL-ACP
SYNTHASE

(Vibrio cholerae) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		3 MET A 327
VAL A  22
GLU A 339
 None
 0.87A 3c6gA-4xoxA:
undetectable		 3c6gA-4xoxA:
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.
4ywh ABC TRANSPORTER
SOLUTE BINDING
PROTEIN

(Actinobacillus
succinogenes) 		PF13407
(Peripla_BP_4) 		3 MET A 261
VAL A 216
GLU A 143
 None
 0.68A 3c6gA-4ywhA:
undetectable		 3c6gA-4ywhA:
22.50
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.
4zcf RESTRICTION
ENDONUCLEASE
ECOP15I,
MODIFICATION SUBUNIT

(Escherichia
coli) 		PF01555
(N6_N4_Mtase) 		3 MET A 109
VAL A 117
GLU A 187
 None
 0.79A 3c6gA-4zcfA:
undetectable		 3c6gA-4zcfA:
22.80
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.
5a5l D-FRUCTOSE
1,6-BISPHOSPHATASE
CLASS
2/SEDOHEPTULOSE
1,7-BISPHOSPHATASE

(Thermosynechococcus
elongatus) 		PF03320
(FBPase_glpX) 		3 MET A  44
VAL A  13
GLU A   8
 None
 0.71A 3c6gA-5a5lA:
undetectable		 3c6gA-5a5lA:
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.
5cj5 ALPHA-1,4-GLUCAN:MAL
TOSE-1-PHOSPHATE
MALTOSYLTRANSFERASE

(Mycolicibacterium
thermoresistibile) 		PF00128
(Alpha-amylase)
PF11896
(DUF3416) 		3 MET A 681
VAL A 620
GLU A 653
 None
 0.89A 3c6gA-5cj5A:
undetectable		 3c6gA-5cj5A:
22.16
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.
5cnx AMINOPEPTIDASE YPDF

(Escherichia
coli) 		PF00557
(Peptidase_M24)
PF01321
(Creatinase_N) 		3 MET A 224
VAL A 347
GLU A 321
 None
None
ZN  A 401 ( 2.3A)
 0.89A 3c6gA-5cnxA:
undetectable		 3c6gA-5cnxA:
20.93
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.
5dus ORF1A

(Middle East
respiratory
syndrome-related
coronavirus) 		PF01661
(Macro) 		3 MET A 114
VAL A  14
GLU A 144
 None
 0.89A 3c6gA-5dusA:
undetectable		 3c6gA-5dusA:
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.
5ejb FUSION GLYCOPROTEIN
F0

(Hendra
henipavirus) 		no annotation 3 MET B  76
VAL B  68
GLU B 196
 None
 0.60A 3c6gA-5ejbB:
undetectable		 3c6gA-5ejbB:
22.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5eqj TRNA
(ADENINE(58)-N(1))-M
ETHYLTRANSFERASE
NON-CATALYTIC
SUBUNIT TRM6

(Saccharomyces
cerevisiae) 		PF04189
(Gcd10p) 		3 MET A 255
VAL A 296
GLU A 253
 None
 0.87A 3c6gA-5eqjA:
undetectable		 3c6gA-5eqjA:
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.
5f2h UNCHARACTERIZED
PROTEIN

(Bacillus cereus) 		PF02230
(Abhydrolase_2) 		3 MET A  65
VAL A 100
GLU A  95
 None
 0.82A 3c6gA-5f2hA:
undetectable		 3c6gA-5f2hA:
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.
5ha5 BRUCELLA OVIS
OXIDOREDUCTASE

(Brucella ovis) 		PF13561
(adh_short_C2) 		3 MET A 196
VAL A 251
GLU A 225
 None
 0.86A 3c6gA-5ha5A:
undetectable		 3c6gA-5ha5A:
20.93
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.
5hl6 PUTATIVE GAF SENSOR
PROTEIN

(Burkholderia
vietnamiensis) 		PF13185
(GAF_2) 		3 MET A 150
VAL A  96
GLU A 145
 None
 0.90A 3c6gA-5hl6A:
undetectable		 3c6gA-5hl6A:
16.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5i61 POTENTIAL
RNA-DEPENDENT RNA
POLYMERASE

(Human
picobirnavirus) 		no annotation 3 MET B 428
VAL B  81
GLU B 190
 None
 0.74A 3c6gA-5i61B:
undetectable		 3c6gA-5i61B:
23.26
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.
5j49 UTP--GLUCOSE-1-PHOSP
HATE
URIDYLYLTRANSFERASE

(Paraburkholderia
xenovorans) 		PF00483
(NTP_transferase) 		3 MET A 143
VAL A 157
GLU A 148
 None
 0.88A 3c6gA-5j49A:
undetectable		 3c6gA-5j49A:
22.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jnz BETA CHAIN

(Acipenser
stellatus) 		PF00042
(Globin) 		3 MET B 133
VAL B  12
GLU B   7
 None
 0.85A 3c6gA-5jnzB:
undetectable		 3c6gA-5jnzB:
14.55
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.
5me3 SISTER CHROMATID
COHESION PROTEIN 2

(Eremothecium
gossypii) 		PF12765
(Cohesin_HEAT)
PF12830
(Nipped-B_C) 		3 MET A1411
VAL A1366
GLU A1406
 None
 0.90A 3c6gA-5me3A:
undetectable		 3c6gA-5me3A:
16.80
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.
5nv3 RIBULOSE
BISPHOSPHATE
CARBOXYLASE LARGE
CHAIN

(Rhodobacter
sphaeroides) 		PF00016
(RuBisCO_large)
PF02788
(RuBisCO_large_N) 		3 MET A 252
VAL A 267
GLU A 257
 None
 0.91A 3c6gA-5nv3A:
undetectable		 3c6gA-5nv3A:
22.32
Potential target for repurposing, i.e. matched protein structure has less than 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 MET A 758
VAL A 712
GLU A 753
 None
 0.68A 3c6gA-5uj7A:
undetectable		 3c6gA-5uj7A:
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.
5ujm ORIGIN RECOGNITION
COMPLEX SUBUNIT 1

(Homo sapiens) 		PF00004
(AAA)
PF09079
(Cdc6_C) 		3 MET A 758
VAL A 712
GLU A 753
 None
 0.69A 3c6gA-5ujmA:
undetectable		 3c6gA-5ujmA:
23.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5uv2 (+)-LIMONENE
SYNTHASE

(Citrus sinensis) 		PF01397
(Terpene_synth)
PF03936
(Terpene_synth_C) 		3 MET A 317
VAL A 310
GLU A 285
 None
 0.87A 3c6gA-5uv2A:
undetectable		 3c6gA-5uv2A:
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.
5veg FLAVODOXIN

(Lactobacillus
reuteri) 		no annotation 3 MET A  64
VAL A  54
GLU A  67
 None
 0.77A 3c6gA-5vegA:
undetectable		 3c6gA-5vegA:
16.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5vol PUTATIVE ESTERASE

(Bacteroides
intestinalis) 		PF00756
(Esterase) 		3 MET A 179
VAL A 212
GLU A 244
 None
 0.60A 3c6gA-5volA:
undetectable		 3c6gA-5volA:
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.
5ywo 2F2 HEAVY CHAIN

(Mus musculus) 		no annotation 3 MET N  34
VAL N 107
GLU N   6
 None
 0.91A 3c6gA-5ywoN:
undetectable		 3c6gA-5ywoN:
12.59
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.
5z7r SHORT-CHAIN-ENOYL-CO
A HYDRATASE

(Clostridium
acetobutylicum) 		no annotation 3 MET A   1
VAL A   6
GLU A  42
 None
 0.58A 3c6gA-5z7rA:
undetectable		 3c6gA-5z7rA:
12.89
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.
6b3y DENN
DOMAIN-CONTAINING
PROTEIN 3

(Mus musculus) 		no annotation 3 MET A 795
VAL A 788
GLU A 802
 None
 0.91A 3c6gA-6b3yA:
undetectable		 3c6gA-6b3yA:
11.06
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.
6bha CASPASE-3

(Homo sapiens) 		no annotation 3 MET A 100
VAL A 134
GLU A  98
 None
 0.88A 3c6gA-6bhaA:
undetectable		 3c6gA-6bhaA:
12.03
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.
6eon BETA-GALACTOSIDASE

(Bacteroides
thetaiotaomicron) 		no annotation 3 MET A 547
VAL A 576
GLU A 602
 None
 0.78A 3c6gA-6eonA:
undetectable		 3c6gA-6eonA:
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.
6fkh ATP SYNTHASE SUBUNIT
BETA, CHLOROPLASTIC

(Spinacia
oleracea) 		no annotation 3 MET D 247
VAL D  77
GLU D 284
 None
 0.80A 3c6gA-6fkhD:
undetectable		 3c6gA-6fkhD:
12.85