SIMILAR PATTERNS OF AMINO ACIDS FOR 5G5G_A_ACTA1231

List of similar pattern of amino acids derived from ASSAM search

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1amy 1,4-ALPHA-D-GLUCAN
GLUCANOHYDROLASE

(Hordeum vulgare) 		PF00128
(Alpha-amylase)
PF07821
(Alpha-amyl_C2) 		3 ARG A 225
THR A 266
ASP A 267
 None
 0.93A 5g5gA-1amyA:
undetectable
5g5gB-1amyA:
undetectable		 5g5gA-1amyA:
20.78
5g5gB-1amyA:
21.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1apy ASPARTYLGLUCOSAMINID
ASE
ASPARTYLGLUCOSAMINID
ASE

(Homo sapiens;
Homo sapiens) 		PF01112
(Asparaginase_2)
PF01112
(Asparaginase_2) 		3 ARG B 211
THR B 201
ASP A  65
 None
 0.94A 5g5gA-1apyB:
0.0
5g5gB-1apyB:
0.0		 5g5gA-1apyB:
19.37
5g5gB-1apyB:
19.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ezv UBIQUINOL-CYTOCHROME
C REDUCTASE COMPLEX
CORE PROTEIN 2

(Saccharomyces
cerevisiae) 		PF00675
(Peptidase_M16) 		3 ARG B  40
THR B 280
ASP B 281
 None
 0.96A 5g5gA-1ezvB:
undetectable
5g5gB-1ezvB:
0.0		 5g5gA-1ezvB:
22.13
5g5gB-1ezvB:
24.08
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.
1fbl FIBROBLAST
(INTERSTITIAL)
COLLAGENASE (MMP-1)

(Sus scrofa) 		PF00045
(Hemopexin)
PF00413
(Peptidase_M10) 		3 ARG A 300
THR A 243
ASP A 245
 None
 0.95A 5g5gA-1fblA:
0.0
5g5gB-1fblA:
0.0		 5g5gA-1fblA:
20.67
5g5gB-1fblA:
23.04
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.
1jof CARBOXY-CIS,CIS-MUCO
NATE CYCLASE

(Neurospora
crassa) 		PF10282
(Lactonase) 		3 ARG A  86
THR A  92
ASP A  91
 None
 0.92A 5g5gA-1jofA:
0.0
5g5gB-1jofA:
0.0		 5g5gA-1jofA:
20.71
5g5gB-1jofA:
22.31
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.
1k25 LOW-AFFINITY
PENICILLIN-BINDING
PROTEIN 2X

(Streptococcus
pneumoniae) 		PF00905
(Transpeptidase)
PF03717
(PBP_dimer)
PF03793
(PASTA) 		3 ARG A 733
THR A 411
ASP A 414
 None
 0.81A 5g5gA-1k25A:
0.0
5g5gB-1k25A:
0.0		 5g5gA-1k25A:
15.91
5g5gB-1k25A:
18.81
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.
1lwd ISOCITRATE
DEHYDROGENASE

(Sus scrofa) 		PF00180
(Iso_dh) 		3 ARG A  50
THR A  76
ASP A  17
 None
 0.94A 5g5gA-1lwdA:
0.0
5g5gB-1lwdA:
0.0		 5g5gA-1lwdA:
20.59
5g5gB-1lwdA:
20.05
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.
1mw7 HYPOTHETICAL PROTEIN
HP0162

(Helicobacter
pylori) 		PF01709
(Transcrip_reg) 		3 ARG A 104
THR A  99
ASP A 231
 None
 0.87A 5g5gA-1mw7A:
0.3
5g5gB-1mw7A:
0.0		 5g5gA-1mw7A:
22.10
5g5gB-1mw7A:
23.10
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.
1p43 ENOLASE 1

(Saccharomyces
cerevisiae) 		PF00113
(Enolase_C)
PF03952
(Enolase_N) 		3 ARG A 119
THR A 381
ASP A 380
 None
 0.92A 5g5gA-1p43A:
1.4
5g5gB-1p43A:
undetectable		 5g5gA-1p43A:
21.35
5g5gB-1p43A:
24.38
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.
1pem RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE 2
ALPHA CHAIN

(Salmonella
enterica) 		PF00317
(Ribonuc_red_lgN)
PF02867
(Ribonuc_red_lgC)
PF08343
(RNR_N) 		3 ARG A 516
THR A 443
ASP A 447
 None
 0.90A 5g5gA-1pemA:
undetectable
5g5gB-1pemA:
undetectable		 5g5gA-1pemA:
16.18
5g5gB-1pemA:
18.26
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.
1sng COG4826: SERINE
PROTEASE INHIBITOR

(Thermobifida
fusca) 		PF00079
(Serpin) 		3 ARG A   9
THR A  64
ASP A  11
 None
 0.89A 5g5gA-1sngA:
undetectable
5g5gB-1sngA:
undetectable		 5g5gA-1sngA:
21.52
5g5gB-1sngA:
23.93
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.
1t8w AMP NUCLEOSIDASE

(Escherichia
coli) 		PF01048
(PNP_UDP_1)
PF10423
(AMNp_N) 		3 ARG A 177
THR A  86
ASP A 175
 None
 0.89A 5g5gA-1t8wA:
0.8
5g5gB-1t8wA:
undetectable		 5g5gA-1t8wA:
20.13
5g5gB-1t8wA:
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.
1vj0 ALCOHOL
DEHYDROGENASE,
ZINC-CONTAINING

(Thermotoga
maritima) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		3 ARG A 254
THR A 186
ASP A 257
 None
 0.86A 5g5gA-1vj0A:
undetectable
5g5gB-1vj0A:
undetectable		 5g5gA-1vj0A:
20.63
5g5gB-1vj0A:
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.
1vkh PUTATIVE SERINE
HYDROLASE

(Saccharomyces
cerevisiae) 		PF07859
(Abhydrolase_3) 		3 ARG A  94
THR A  13
ASP A  11
 None
 0.89A 5g5gA-1vkhA:
undetectable
5g5gB-1vkhA:
undetectable		 5g5gA-1vkhA:
21.63
5g5gB-1vkhA:
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.
2cl2 PUTATIVE
LAMINARINASE

(Phanerochaete
chrysosporium) 		no annotation 3 ARG A  73
THR A  27
ASP A  25
 None
 0.93A 5g5gA-2cl2A:
undetectable
5g5gB-2cl2A:
undetectable		 5g5gA-2cl2A:
20.88
5g5gB-2cl2A:
21.71
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.
2e4u METABOTROPIC
GLUTAMATE RECEPTOR 3

(Rattus
norvegicus) 		PF01094
(ANF_receptor)
PF07562
(NCD3G) 		3 ARG A 249
THR A 103
ASP A 102
 None
 0.58A 5g5gA-2e4uA:
undetectable
5g5gB-2e4uA:
undetectable		 5g5gA-2e4uA:
15.68
5g5gB-2e4uA:
20.88
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.
2gd9 HYPOTHETICAL PROTEIN
YYAP

(Bacillus
subtilis) 		PF01872
(RibD_C) 		3 ARG A   8
THR A  49
ASP A  48
 None
 0.90A 5g5gA-2gd9A:
undetectable
5g5gB-2gd9A:
undetectable		 5g5gA-2gd9A:
20.08
5g5gB-2gd9A:
20.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2gk1 BETA-HEXOSAMINIDASE
SUBUNIT ALPHA
BETA-HEXOSAMINIDASE
SUBUNIT BETA CHAIN A

(Homo sapiens;
Homo sapiens) 		no annotation
no annotation 		3 ARG N 533
THR I 467
ASP I 465
 None
 0.95A 5g5gA-2gk1N:
undetectable
5g5gB-2gk1N:
undetectable		 5g5gA-2gk1N:
19.16
5g5gB-2gk1N:
19.16
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.
2grv LPQW

(Mycolicibacterium
smegmatis) 		PF00496
(SBP_bac_5) 		3 ARG A 279
THR A 401
ASP A 399
 None
 0.73A 5g5gA-2grvA:
undetectable
5g5gB-2grvA:
undetectable		 5g5gA-2grvA:
16.67
5g5gB-2grvA:
21.02
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.
2jbw 2,6-DIHYDROXY-PSEUDO
-OXYNICOTINE
HYDROLASE

(Paenarthrobacter
nicotinovorans) 		PF06500
(DUF1100) 		3 ARG A  90
THR A  40
ASP A  43
 None
 0.82A 5g5gA-2jbwA:
undetectable
5g5gB-2jbwA:
undetectable		 5g5gA-2jbwA:
21.67
5g5gB-2jbwA:
22.72
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.
2kxp F-ACTIN-CAPPING
PROTEIN SUBUNIT
ALPHA-1
MYOTROPHIN

(Gallus gallus;
Mus musculus) 		PF01267
(F-actin_cap_A)
PF12796
(Ank_2) 		3 ARG C 636
THR A 253
ASP A 252
 None
 0.93A 5g5gA-2kxpC:
undetectable
5g5gB-2kxpC:
undetectable		 5g5gA-2kxpC:
20.35
5g5gB-2kxpC:
18.18
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.
2o1v ENDOPLASMIN

(Canis lupus) 		PF00183
(HSP90)
PF02518
(HATPase_c) 		3 ARG A 156
THR A 219
ASP A 218
 None
 0.85A 5g5gA-2o1vA:
undetectable
5g5gB-2o1vA:
undetectable		 5g5gA-2o1vA:
16.04
5g5gB-2o1vA:
19.17
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.
2p68 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
REDUCTASE

(Aquifex
aeolicus) 		PF13561
(adh_short_C2) 		3 ARG A  17
THR A 192
ASP A 193
 None
 0.93A 5g5gA-2p68A:
undetectable
5g5gB-2p68A:
undetectable		 5g5gA-2p68A:
24.52
5g5gB-2p68A:
20.18
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.
2rhp THROMBOSPONDIN-2

(Homo sapiens) 		PF02412
(TSP_3)
PF05735
(TSP_C)
PF07645
(EGF_CA)
PF12947
(EGF_3) 		3 ARG A1093
THR A1144
ASP A1142
 None
NAG  A   4 (-4.3A)
None
 0.94A 5g5gA-2rhpA:
undetectable
5g5gB-2rhpA:
undetectable		 5g5gA-2rhpA:
15.29
5g5gB-2rhpA:
18.41
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.
2v4j SULFITE REDUCTASE,
DISSIMILATORY-TYPE
SUBUNIT ALPHA
SULFITE REDUCTASE,
DISSIMILATORY-TYPE
SUBUNIT BETA

(Desulfovibrio
vulgaris;
Desulfovibrio
vulgaris) 		PF01077
(NIR_SIR)
PF03460
(NIR_SIR_ferr)
PF01077
(NIR_SIR)
PF03460
(NIR_SIR_ferr) 		3 ARG A 207
THR B  19
ASP B  20
 None
 0.88A 5g5gA-2v4jA:
undetectable
5g5gB-2v4jA:
undetectable		 5g5gA-2v4jA:
19.10
5g5gB-2v4jA:
22.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wbp L-ARGININE
BETA-HYDROXYLASE

(Streptomyces
vinaceus) 		PF02668
(TauD) 		3 ARG A 343
THR A 338
ASP A 179
 None
 0.85A 5g5gA-2wbpA:
undetectable
5g5gB-2wbpA:
undetectable		 5g5gA-2wbpA:
22.01
5g5gB-2wbpA:
23.88
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.
2wok CLAVULANIC ACID
BIOSYNTHESIS
OLIGOPEPTIDE BINDING
PROTEIN 2

(Streptomyces
clavuligerus) 		PF00496
(SBP_bac_5) 		3 ARG A 198
THR A 116
ASP A 119
 None
 0.72A 5g5gA-2wokA:
undetectable
5g5gB-2wokA:
undetectable		 5g5gA-2wokA:
17.77
5g5gB-2wokA:
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.
2x9o 15,16-DIHYDROBILIVER
DIN-FERREDOXIN
OXIDOREDUCTASE

(Synechococcus
sp. WH 8020) 		PF05996
(Fe_bilin_red) 		3 ARG A 112
THR A 184
ASP A  77
 None
 0.94A 5g5gA-2x9oA:
0.5
5g5gB-2x9oA:
undetectable		 5g5gA-2x9oA:
19.48
5g5gB-2x9oA:
20.85
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.
2yd3 RECEPTOR-TYPE
TYROSINE-PROTEIN
PHOSPHATASE S

(Homo sapiens) 		PF07679
(I-set) 		3 ARG A 183
THR A 200
ASP A 201
 None
 0.51A 5g5gA-2yd3A:
undetectable
5g5gB-2yd3A:
undetectable		 5g5gA-2yd3A:
24.22
5g5gB-2yd3A:
21.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yuh TUBULIN-SPECIFIC
CHAPERONE C

(Homo sapiens) 		PF07986
(TBCC) 		3 ARG A  53
THR A  51
ASP A  32
 None
 0.97A 5g5gA-2yuhA:
undetectable
5g5gB-2yuhA:
undetectable		 5g5gA-2yuhA:
21.07
5g5gB-2yuhA:
20.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2z6p UFM1-CONJUGATING
ENZYME 1

(Homo sapiens) 		PF08694
(UFC1) 		3 ARG A 127
THR A   6
ASP A   3
 None
 0.92A 5g5gA-2z6pA:
undetectable
5g5gB-2z6pA:
undetectable		 5g5gA-2z6pA:
20.26
5g5gB-2z6pA:
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.
2zal L-ASPARAGINASE
L-ASPARAGINASE

(Escherichia
coli;
Escherichia
coli) 		PF01112
(Asparaginase_2)
PF01112
(Asparaginase_2) 		3 ARG B 207
THR B 197
ASP A  83
 ASP  B 501 ( 2.8A)
ASP  B 501 ( 3.9A)
None
 0.94A 5g5gA-2zalB:
undetectable
5g5gB-2zalB:
undetectable		 5g5gA-2zalB:
20.52
5g5gB-2zalB:
18.67
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.
3be5 PUTATIVE IRON
COMPOUND-BINDING
PROTEIN OF ABC
TRANSPORTER FAMILY

(Escherichia
coli) 		PF01497
(Peripla_BP_2) 		3 ARG A 246
THR A 249
ASP A 248
 None
 0.89A 5g5gA-3be5A:
undetectable
5g5gB-3be5A:
undetectable		 5g5gA-3be5A:
21.84
5g5gB-3be5A:
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.
3dm0 MALTOSE-BINDING
PERIPLASMIC PROTEIN
FUSED WITH RACK1

(Escherichia
coli;
Arabidopsis
thaliana) 		PF00400
(WD40)
PF01547
(SBP_bac_1) 		3 ARG A1058
THR A1015
ASP A1037
 None
 0.95A 5g5gA-3dm0A:
undetectable
5g5gB-3dm0A:
undetectable		 5g5gA-3dm0A:
15.84
5g5gB-3dm0A:
18.36
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.
3fhn PROTEIN TRANSPORT
PROTEIN TIP20

(Saccharomyces
cerevisiae) 		PF04437
(RINT1_TIP1) 		3 ARG A 251
THR A 183
ASP A 182
 None
 0.66A 5g5gA-3fhnA:
undetectable
5g5gB-3fhnA:
undetectable		 5g5gA-3fhnA:
15.10
5g5gB-3fhnA:
16.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3icj UNCHARACTERIZED
METAL-DEPENDENT
HYDROLASE

(Pyrococcus
furiosus) 		PF07969
(Amidohydro_3) 		3 ARG A 133
THR A 214
ASP A 217
 None
 0.84A 5g5gA-3icjA:
undetectable
5g5gB-3icjA:
undetectable		 5g5gA-3icjA:
17.14
5g5gB-3icjA:
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.
3igh UNCHARACTERIZED
METAL-DEPENDENT
HYDROLASE

(Pyrococcus
horikoshii) 		PF07969
(Amidohydro_3) 		3 ARG X 117
THR X 198
ASP X 201
 None
SO4  X   5 (-4.1A)
None
 0.63A 5g5gA-3ighX:
undetectable
5g5gB-3ighX:
undetectable		 5g5gA-3ighX:
17.63
5g5gB-3ighX:
22.27
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.
3jsa HOMOSERINE
DEHYDROGENASE

(Thermoplasma
volcanium) 		PF00742
(Homoserine_dh)
PF03447
(NAD_binding_3) 		3 ARG A 164
THR A 296
ASP A 295
 None
 0.79A 5g5gA-3jsaA:
undetectable
5g5gB-3jsaA:
undetectable		 5g5gA-3jsaA:
22.35
5g5gB-3jsaA:
24.66
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.
3jtw DIHYDROFOLATE
REDUCTASE

(Pediococcus
pentosaceus) 		PF01872
(RibD_C) 		3 ARG A   3
THR A  49
ASP A  48
 None
 0.82A 5g5gA-3jtwA:
undetectable
5g5gB-3jtwA:
undetectable		 5g5gA-3jtwA:
21.19
5g5gB-3jtwA:
21.51
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.
3klq PUTATIVE PILUS
ANCHORING PROTEIN

(Streptococcus
pyogenes) 		PF12892
(FctA) 		3 ARG A 119
THR A  22
ASP A  20
 None
 0.86A 5g5gA-3klqA:
undetectable
5g5gB-3klqA:
undetectable		 5g5gA-3klqA:
19.27
5g5gB-3klqA:
19.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lg6 PUTATIVE GLUTATHIONE
TRANSFERASE

(Coccidioides
immitis) 		PF13409
(GST_N_2)
PF14497
(GST_C_3) 		3 ARG A  21
THR A 225
ASP A 224
 None
 0.91A 5g5gA-3lg6A:
undetectable
5g5gB-3lg6A:
undetectable		 5g5gA-3lg6A:
18.33
5g5gB-3lg6A:
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.
3mhu DIHYDROOROTATE
DEHYDROGENASE

(Leishmania
major) 		PF01180
(DHO_dh) 		3 ARG A 224
THR A 254
ASP A 257
 None
 0.92A 5g5gA-3mhuA:
undetectable
5g5gB-3mhuA:
undetectable		 5g5gA-3mhuA:
22.50
5g5gB-3mhuA:
23.59
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.
3or2 SULFITE REDCUTASE
SUBUNIT ALPHA
SULFITE REDCUTASE
SUBUNIT BETA

(Desulfovibrio
gigas;
Desulfovibrio
gigas) 		PF01077
(NIR_SIR)
PF00037
(Fer4)
PF01077
(NIR_SIR)
PF03460
(NIR_SIR_ferr) 		3 ARG A 207
THR B  19
ASP B  20
 None
 0.92A 5g5gA-3or2A:
undetectable
5g5gB-3or2A:
undetectable		 5g5gA-3or2A:
19.68
5g5gB-3or2A:
22.77
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.
3tsd INOSINE-5'-MONOPHOSP
HATE DEHYDROGENASE

(Bacillus
anthracis) 		PF00478
(IMPDH)
PF00571
(CBS) 		3 ARG A 389
THR A  53
ASP A  52
 None
 0.81A 5g5gA-3tsdA:
undetectable
5g5gB-3tsdA:
undetectable		 5g5gA-3tsdA:
18.24
5g5gB-3tsdA:
21.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ubm FORMYL-COA:OXALATE
COA-TRANSFERASE

(Acetobacter
aceti) 		PF02515
(CoA_transf_3) 		3 ARG A 429
THR A 411
ASP A 412
 None
 0.78A 5g5gA-3ubmA:
undetectable
5g5gB-3ubmA:
undetectable		 5g5gA-3ubmA:
20.88
5g5gB-3ubmA:
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.
3ubr CYTOCHROME C-552

(Shewanella
oneidensis) 		PF02335
(Cytochrom_C552) 		3 ARG A 466
THR A 152
ASP A 126
 None
 0.76A 5g5gA-3ubrA:
undetectable
5g5gB-3ubrA:
undetectable		 5g5gA-3ubrA:
19.95
5g5gB-3ubrA:
23.11
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.
3wdy BETA-1,3-1,4-GLUCANA
SE

(Paecilomyces
sp.
'thermophila') 		no annotation 3 ARG A  70
THR A  26
ASP A  24
 None
 0.94A 5g5gA-3wdyA:
undetectable
5g5gB-3wdyA:
undetectable		 5g5gA-3wdyA:
18.50
5g5gB-3wdyA:
21.71
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.
4a5w COMPLEMENT C5

(Homo sapiens) 		PF00207
(A2M)
PF01759
(NTR)
PF01835
(A2M_N)
PF07677
(A2M_recep)
PF07678
(A2M_comp)
PF07703
(A2M_N_2) 		3 ARG A1279
THR A1290
ASP A1289
 None
 0.90A 5g5gA-4a5wA:
undetectable
5g5gB-4a5wA:
undetectable		 5g5gA-4a5wA:
9.57
5g5gB-4a5wA:
11.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4aip FE-REGULATED PROTEIN
B

(Neisseria
meningitidis) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		3 ARG A 304
THR A 345
ASP A 342
 None
 0.73A 5g5gA-4aipA:
undetectable
5g5gB-4aipA:
undetectable		 5g5gA-4aipA:
15.86
5g5gB-4aipA:
18.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bkx HISTONE DEACETYLASE
1

(Homo sapiens) 		PF00850
(Hist_deacetyl) 		3 ARG B   8
THR B 322
ASP B 321
 None
 0.84A 5g5gA-4bkxB:
undetectable
5g5gB-4bkxB:
undetectable		 5g5gA-4bkxB:
18.24
5g5gB-4bkxB:
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.
4crm TRANSLATION
INITIATION FACTOR
RLI1

(Saccharomyces
cerevisiae) 		PF00005
(ABC_tran)
PF00037
(Fer4)
PF04068
(RLI) 		3 ARG P 512
THR P 449
ASP P 450
 None
 0.91A 5g5gA-4crmP:
undetectable
5g5gB-4crmP:
undetectable		 5g5gA-4crmP:
16.58
5g5gB-4crmP:
19.17
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.
4eqm PROTEIN KINASE

(Staphylococcus
aureus) 		PF00069
(Pkinase) 		3 ARG A 132
THR A 190
ASP A 191
 None
 0.87A 5g5gA-4eqmA:
undetectable
5g5gB-4eqmA:
undetectable		 5g5gA-4eqmA:
23.13
5g5gB-4eqmA:
20.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4f7z RAP GUANINE
NUCLEOTIDE EXCHANGE
FACTOR 4

(Mus musculus) 		PF00027
(cNMP_binding)
PF00610
(DEP)
PF00617
(RasGEF)
PF00618
(RasGEF_N) 		3 ARG A 785
THR A 715
ASP A 796
 None
 0.72A 5g5gA-4f7zA:
1.4
5g5gB-4f7zA:
undetectable		 5g5gA-4f7zA:
13.36
5g5gB-4f7zA:
16.34
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.
4gaa MGC78867 PROTEIN

(Xenopus laevis) 		PF01433
(Peptidase_M1)
PF09127
(Leuk-A4-hydro_C) 		3 ARG A 171
THR A 216
ASP A 254
 None
 0.86A 5g5gA-4gaaA:
undetectable
5g5gB-4gaaA:
undetectable		 5g5gA-4gaaA:
17.29
5g5gB-4gaaA:
19.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4k24 ANTI-UPAR ANTIBODY,
HEAVY CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 ARG H  66
THR H  83
ASP H  86
 None
 0.95A 5g5gA-4k24H:
undetectable
5g5gB-4k24H:
undetectable		 5g5gA-4k24H:
21.51
5g5gB-4k24H:
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.
4k3c OUTER MEMBRANE
PROTEIN ASSEMBLY
FACTOR BAMA

([Haemophilus]
ducreyi) 		PF01103
(Bac_surface_Ag)
PF07244
(POTRA) 		3 ARG A 496
THR A 461
ASP A 462
 None
 0.89A 5g5gA-4k3cA:
undetectable
5g5gB-4k3cA:
undetectable		 5g5gA-4k3cA:
17.55
5g5gB-4k3cA:
21.62
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.
4kxb GLUTAMYL
AMINOPEPTIDASE

(Homo sapiens) 		PF01433
(Peptidase_M1)
PF11838
(ERAP1_C) 		3 ARG A 368
THR A 852
ASP A 849
 None
 0.70A 5g5gA-4kxbA:
undetectable
5g5gB-4kxbA:
undetectable		 5g5gA-4kxbA:
13.62
5g5gB-4kxbA:
18.01
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.
4lej VICILIN

(Pinus
koraiensis) 		PF00190
(Cupin_1) 		3 ARG A 286
THR A 400
ASP A 397
 None
 0.80A 5g5gA-4lejA:
undetectable
5g5gB-4lejA:
undetectable		 5g5gA-4lejA:
18.98
5g5gB-4lejA:
22.86
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.
4lmv GLUTATHIONE
TRANSFERASE

(Phanerochaete
chrysosporium) 		PF13417
(GST_N_3) 		3 ARG A 104
THR A 110
ASP A 111
 None
 0.81A 5g5gA-4lmvA:
undetectable
5g5gB-4lmvA:
undetectable		 5g5gA-4lmvA:
21.38
5g5gB-4lmvA:
20.25
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.
4mh0 RAP GUANINE
NUCLEOTIDE EXCHANGE
FACTOR 4

(Mus musculus) 		PF00027
(cNMP_binding)
PF00617
(RasGEF)
PF00618
(RasGEF_N) 		3 ARG E 785
THR E 715
ASP E 796
 None
 0.80A 5g5gA-4mh0E:
1.9
5g5gB-4mh0E:
undetectable		 5g5gA-4mh0E:
15.80
5g5gB-4mh0E:
20.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mvc CHOLINE-PHOSPHATE
CYTIDYLYLTRANSFERASE
A

(Rattus
norvegicus) 		PF01467
(CTP_transf_like) 		3 ARG A 132
THR A 118
ASP A 115
 None
 0.96A 5g5gA-4mvcA:
undetectable
5g5gB-4mvcA:
undetectable		 5g5gA-4mvcA:
21.12
5g5gB-4mvcA:
22.03
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.
4o48 UNCHARACTERIZED
PROTEIN

(Cavia porcellus) 		PF01112
(Asparaginase_2) 		3 ARG A 196
THR A 186
ASP A  78
 ASP  A 402 (-2.7A)
ASP  A 402 (-3.7A)
None
 0.84A 5g5gA-4o48A:
undetectable
5g5gB-4o48A:
undetectable		 5g5gA-4o48A:
22.22
5g5gB-4o48A:
23.10
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.
4onz PUTATIVE GLYCOSIDE
HYDROLASE

(Bacteroides
ovatus) 		PF04041
(Glyco_hydro_130) 		3 ARG A  62
THR A 103
ASP A  93
 None
 0.97A 5g5gA-4onzA:
undetectable
5g5gB-4onzA:
undetectable		 5g5gA-4onzA:
17.86
5g5gB-4onzA:
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.
4oqs CYP105AS1

(Amycolatopsis
orientalis) 		PF00067
(p450) 		3 ARG A 104
THR A 223
ASP A 224
 None
 0.93A 5g5gA-4oqsA:
undetectable
5g5gB-4oqsA:
undetectable		 5g5gA-4oqsA:
22.82
5g5gB-4oqsA:
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.
4pka PATATIN-17

(Solanum
cardiophyllum) 		PF01734
(Patatin) 		3 ARG X 380
THR X  30
ASP X  71
 None
 0.79A 5g5gA-4pkaX:
undetectable
5g5gB-4pkaX:
undetectable		 5g5gA-4pkaX:
20.68
5g5gB-4pkaX:
22.48
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.
4q7e RESPONSE REGULATOR
OF A TWO COMPONENT
REGULATORY SYSTEM

(Leptospira
biflexa) 		PF00072
(Response_reg) 		3 ARG A  55
THR A  81
ASP A  53
 None
 0.90A 5g5gA-4q7eA:
undetectable
5g5gB-4q7eA:
undetectable		 5g5gA-4q7eA:
17.99
5g5gB-4q7eA:
16.36
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.
4qhk UCA HEAVY CHAIN

(Homo sapiens) 		no annotation 3 ARG M  66
THR M  83
ASP M  86
 None
 0.96A 5g5gA-4qhkM:
undetectable
5g5gB-4qhkM:
undetectable		 5g5gA-4qhkM:
20.56
5g5gB-4qhkM:
22.36
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.
4qme AMINOPEPTIDASE N

(Neisseria
meningitidis) 		PF01433
(Peptidase_M1)
PF11940
(DUF3458)
PF17432
(DUF3458_C) 		3 ARG A 726
THR A 759
ASP A 758
 None
 0.59A 5g5gA-4qmeA:
0.0
5g5gB-4qmeA:
undetectable		 5g5gA-4qmeA:
14.20
5g5gB-4qmeA:
18.52
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.
4qmk TYPE III SECRETION
SYSTEM EFFECTOR
PROTEIN EXOU

(Pseudomonas
fluorescens) 		PF01734
(Patatin) 		3 ARG A 206
THR A 214
ASP A 217
 None
 0.73A 5g5gA-4qmkA:
undetectable
5g5gB-4qmkA:
undetectable		 5g5gA-4qmkA:
17.16
5g5gB-4qmkA:
20.90
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.
4xee NEUROTENSIN RECEPTOR
TYPE 1, ENDOLYSIN
CHIMERA

(Rattus
norvegicus;
Escherichia
virus T4) 		PF00001
(7tm_1)
PF00959
(Phage_lysozyme) 		3 ARG A 328
THR A 153
ASP A 150
 None
 0.89A 5g5gA-4xeeA:
undetectable
5g5gB-4xeeA:
undetectable		 5g5gA-4xeeA:
18.08
5g5gB-4xeeA:
22.08
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.
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei) 		PF09818
(ABC_ATPase) 		3 ARG A 606
THR A 347
ASP A 345
 None
 0.95A 5g5gA-4yj1A:
undetectable
5g5gB-4yj1A:
undetectable		 5g5gA-4yj1A:
16.89
5g5gB-4yj1A:
20.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4z3o DNA TOPOISOMERASE 4
SUBUNIT
B,PARE30-PARC55
FUSED TOPO IV FROM
S. PNEUMONIAE

(Streptococcus
pneumoniae) 		PF00521
(DNA_topoisoIV)
PF00986
(DNA_gyraseB_C)
PF01751
(Toprim) 		3 ARG A1028
THR A 509
ASP A 510
 None
 0.74A 5g5gA-4z3oA:
1.1
5g5gB-4z3oA:
undetectable		 5g5gA-4z3oA:
14.84
5g5gB-4z3oA:
20.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zxs VIRION EGRESS
PROTEIN UL31

(Human
alphaherpesvirus
1) 		PF02718
(Herpes_UL31) 		3 ARG B 257
THR B 209
ASP B 207
 None
 0.89A 5g5gA-4zxsB:
undetectable
5g5gB-4zxsB:
undetectable		 5g5gA-4zxsB:
24.56
5g5gB-4zxsB:
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.
5ayp FARNESYL DIPHOSPHATE
SYNTHASE

(Geobacillus
stearothermophilus) 		PF00348
(polyprenyl_synt) 		3 ARG A 146
THR A 206
ASP A 210
 None
 0.81A 5g5gA-5aypA:
undetectable
5g5gB-5aypA:
undetectable		 5g5gA-5aypA:
22.08
5g5gB-5aypA:
24.64
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.
5bwd BENZYLSUCCINATE
SYNTHASE ALPHA CHAIN

(Thauera
aromatica) 		PF01228
(Gly_radical)
PF02901
(PFL-like) 		3 ARG A 437
THR A 411
ASP A 412
 None
 0.71A 5g5gA-5bwdA:
0.6
5g5gB-5bwdA:
undetectable		 5g5gA-5bwdA:
14.14
5g5gB-5bwdA:
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.
5c08 1E6 TCR ALPHA CHAIN
1E6 TCR BETA CHAIN

(Homo sapiens;
Homo sapiens) 		PF07686
(V-set)
PF09291
(DUF1968)
PF07654
(C1-set)
PF07686
(V-set) 		3 ARG E 195
THR D 156
ASP E 175
 None
 0.96A 5g5gA-5c08E:
undetectable
5g5gB-5c08E:
undetectable		 5g5gA-5c08E:
22.39
5g5gB-5c08E:
22.77
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.
5cju ISOBUTYRYL-COA
MUTASE FUSED

(Cupriavidus
metallidurans) 		PF01642
(MM_CoA_mutase)
PF02310
(B12-binding)
PF03308
(ArgK) 		3 ARG A 571
THR A 948
ASP A 949
 None
 0.85A 5g5gA-5cjuA:
undetectable
5g5gB-5cjuA:
undetectable		 5g5gA-5cjuA:
11.77
5g5gB-5cjuA:
15.00
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.
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL

(Homo sapiens) 		PF00117
(GATase)
PF00988
(CPSase_sm_chain)
PF02142
(MGS)
PF02786
(CPSase_L_D2)
PF02787
(CPSase_L_D3) 		3 ARG A 906
THR A 804
ASP A 135
 EDO  A1604 (-3.8A)
EDO  A1604 ( 4.7A)
EDO  A1604 (-4.3A)
 0.93A 5g5gA-5dotA:
undetectable
5g5gB-5dotA:
undetectable		 5g5gA-5dotA:
9.82
5g5gB-5dotA:
13.09
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.
5e84 78 KDA
GLUCOSE-REGULATED
PROTEIN

(Homo sapiens) 		PF00012
(HSP70) 		3 ARG A 289
THR A  38
ASP A  94
 None
ATP  A 801 (-3.5A)
None
 0.91A 5g5gA-5e84A:
undetectable
5g5gB-5e84A:
undetectable		 5g5gA-5e84A:
18.48
5g5gB-5e84A:
19.84
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.
5ek8 LIPOXYGENASE

(Cyanothece sp.
PCC 8801) 		PF00305
(Lipoxygenase) 		3 ARG A 245
THR A 233
ASP A 237
 None
 0.84A 5g5gA-5ek8A:
undetectable
5g5gB-5ek8A:
undetectable		 5g5gA-5ek8A:
14.80
5g5gB-5ek8A:
20.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5eoe BETA-LACTAMASE

(Pseudomonas
aeruginosa) 		PF13354
(Beta-lactamase2) 		3 ARG A 157
THR A 166
ASP A 169
 None
 0.81A 5g5gA-5eoeA:
undetectable
5g5gB-5eoeA:
undetectable		 5g5gA-5eoeA:
22.10
5g5gB-5eoeA:
23.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5es6 LINEAR GRAMICIDIN
SYNTHASE SUBUNIT A

(Brevibacillus
parabrevis) 		PF00501
(AMP-binding)
PF00551
(Formyl_trans_N) 		3 ARG A 457
THR A 382
ASP A 385
 None
 0.73A 5g5gA-5es6A:
undetectable
5g5gB-5es6A:
undetectable		 5g5gA-5es6A:
17.14
5g5gB-5es6A:
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.
5f83 BETA-LACTAMASE

(Pseudomonas
aeruginosa) 		PF13354
(Beta-lactamase2) 		3 ARG A 159
THR A 168
ASP A 171
 None
 0.84A 5g5gA-5f83A:
undetectable
5g5gB-5f83A:
undetectable		 5g5gA-5f83A:
21.68
5g5gB-5f83A:
23.91
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5g5g PUTATIVE XANTHINE
DEHYDROGENASE YAGT
IRON-SULFUR-BINDING
SUBUNIT
PUTATIVE XANTHINE
DEHYDROGENASE YAGR
MOLYBDENUM-BINDING
SU SUBUNIT

(Escherichia
coli;
Escherichia
coli) 		PF00111
(Fer2)
PF01799
(Fer2_2)
PF00941
(FAD_binding_5)
PF03450
(CO_deh_flav_C) 		3 ARG A 114
THR B  76
ASP B  77
 ACT  A1231 (-3.7A)
ACT  A1231 ( 4.3A)
ACT  A1231 (-3.1A)
 0.00A 5g5gA-5g5gA:
33.2
5g5gB-5g5gA:
undetectable		 5g5gA-5g5gA:
100.00
5g5gB-5g5gA:
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.
5hb3 NUCLEOPORIN NIC96

(Chaetomium
thermophilum) 		PF04097
(Nic96) 		3 ARG A 618
THR A 587
ASP A 585
 None
 0.88A 5g5gA-5hb3A:
undetectable
5g5gB-5hb3A:
undetectable		 5g5gA-5hb3A:
15.97
5g5gB-5hb3A:
19.53
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.
5ie2 OXALATE--COA LIGASE

(Arabidopsis
thaliana) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		3 ARG A 283
THR A 201
ASP A 204
 None
 0.78A 5g5gA-5ie2A:
undetectable
5g5gB-5ie2A:
undetectable		 5g5gA-5ie2A:
20.19
5g5gB-5ie2A:
23.18
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.
5iuy MULTIDRUG EFFLUX
OUTER MEMBRANE
PROTEIN OPRN

(Pseudomonas
aeruginosa) 		PF02321
(OEP) 		3 ARG A 161
THR A  42
ASP A  40
 None
 0.96A 5g5gA-5iuyA:
undetectable
5g5gB-5iuyA:
undetectable		 5g5gA-5iuyA:
20.49
5g5gB-5iuyA:
25.11
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.
5jnf LINEAR GRAMICIDIN
SYNTHASE SUBUNIT A

(Brevibacillus
parabrevis) 		no annotation 3 ARG C 457
THR C 382
ASP C 385
 None
 0.73A 5g5gA-5jnfC:
undetectable
5g5gB-5jnfC:
undetectable		 5g5gA-5jnfC:
18.01
5g5gB-5jnfC:
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.
5jvv BETA-1,3-GLUCOSYLTRA
NSFERASE

(Paecilomyces
sp.
'thermophila') 		no annotation 3 ARG B  75
THR B  28
ASP B  26
 None
 0.88A 5g5gA-5jvvB:
undetectable
5g5gB-5jvvB:
undetectable		 5g5gA-5jvvB:
22.81
5g5gB-5jvvB:
21.31
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.
5kei 2,3-DIHYDROXYBENZOAT
E-AMP LIGASE

(Mycolicibacterium
smegmatis) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		3 ARG A 324
THR A 244
ASP A 247
 None
 0.87A 5g5gA-5keiA:
undetectable
5g5gB-5keiA:
undetectable		 5g5gA-5keiA:
18.26
5g5gB-5keiA:
23.83
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.
5lq3 CMEB

(Campylobacter
jejuni) 		PF00873
(ACR_tran) 		3 ARG A 786
THR A 201
ASP A 204
 None
 0.96A 5g5gA-5lq3A:
0.9
5g5gB-5lq3A:
undetectable		 5g5gA-5lq3A:
12.69
5g5gB-5lq3A:
16.58
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.
5nzg UDP-GLUCOSE
PYROPHOSPHORYLASE

(Leishmania
major) 		no annotation 3 ARG A 146
THR A 105
ASP A 108
 None
 0.82A 5g5gA-5nzgA:
undetectable
5g5gB-5nzgA:
undetectable		 5g5gA-5nzgA:
undetectable
5g5gB-5nzgA:
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.
5oms CYTOCHROME P450

(Amycolatopsis
sp. ATCC 39116) 		no annotation 3 ARG A 385
THR A 404
ASP A 383
 None
 0.92A 5g5gA-5omsA:
undetectable
5g5gB-5omsA:
undetectable		 5g5gA-5omsA:
undetectable
5g5gB-5omsA:
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.
5ou3 INOSINE-5'-MONOPHOSP
HATE
DEHYDROGENASE,INOSIN
E-5'-MONOPHOSPHATE
DEHYDROGENASE

(Mycolicibacterium
thermoresistibile) 		no annotation 3 ARG A  60
THR A 352
ASP A  50
 None
 0.86A 5g5gA-5ou3A:
undetectable
5g5gB-5ou3A:
undetectable		 5g5gA-5ou3A:
undetectable
5g5gB-5ou3A:
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.
5v2i GLYCOSYLASPARAGINASE

(Elizabethkingia
meningoseptica) 		PF01112
(Asparaginase_2) 		3 ARG A 180
THR A 170
ASP A  66
 None
 0.95A 5g5gA-5v2iA:
undetectable
5g5gB-5v2iA:
undetectable		 5g5gA-5v2iA:
21.57
5g5gB-5v2iA:
22.22
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.
5vae ACCESSORY SEC SYSTEM
PROTEIN ASP1

(Streptococcus
gordonii) 		no annotation 3 ARG A 261
THR A  35
ASP A  33
 None
 0.58A 5g5gA-5vaeA:
undetectable
5g5gB-5vaeA:
undetectable		 5g5gA-5vaeA:
undetectable
5g5gB-5vaeA:
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.
5w5y RNA POLYMERASE
I-SPECIFIC
TRANSCRIPTION
INITIATION FACTOR
RRN6

(Saccharomyces
cerevisiae) 		PF10214
(Rrn6) 		3 ARG O 273
THR O 189
ASP O 192
 None
 0.96A 5g5gA-5w5yO:
undetectable
5g5gB-5w5yO:
undetectable		 5g5gA-5w5yO:
14.67
5g5gB-5w5yO:
15.31
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.
6eq8 PERIPLASMIC
ALPHA-GALACTOSIDE-BI
NDING PROTEIN

(Agrobacterium
tumefaciens) 		no annotation 3 ARG D 533
THR D 489
ASP D 490
 BQZ  D 708 (-3.3A)
None
None
 0.90A 5g5gA-6eq8D:
undetectable
5g5gB-6eq8D:
undetectable		 5g5gA-6eq8D:
undetectable
5g5gB-6eq8D:
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.
6erq DIMETHYLADENOSINE
TRANSFERASE 2,
MITOCHONDRIAL

(Homo sapiens) 		no annotation 3 ARG F 157
THR F 215
ASP F 210
 None
 0.93A 5g5gA-6erqF:
undetectable
5g5gB-6erqF:
undetectable		 5g5gA-6erqF:
21.24
5g5gB-6erqF:
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.
6eu0 TRANSCRIPTION FACTOR
IIIB 70 KDA SUBUNIT

(Saccharomyces
cerevisiae) 		no annotation 3 ARG Z  84
THR Z 101
ASP Z 102
 None
 0.97A 5g5gA-6eu0Z:
undetectable
5g5gB-6eu0Z:
undetectable		 5g5gA-6eu0Z:
undetectable
5g5gB-6eu0Z:
undetectable