SIMILAR PATTERNS OF AMINO ACIDS FOR 3RFM_A_CFFA330_1

List of similar pattern of amino acids derived from ASSAM search

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

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

(Escherichia
coli) 		PF00302
(CAT) 		4 VAL A 191
LEU A 210
MET A  59
ILE A  63
 None
 0.92A 3rfmA-1ciaA:
undetectable		 3rfmA-1ciaA:
17.70
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.
1dms DMSO REDUCTASE

(Rhodobacter
capsulatus) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding) 		5 VAL A 158
LEU A 748
ASN A 416
MET A 610
ILE A 607
 None
 1.34A 3rfmA-1dmsA:
undetectable		 3rfmA-1dmsA:
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.
1e0t PYRUVATE KINASE

(Escherichia
coli) 		PF00224
(PK)
PF02887
(PK_C) 		4 VAL A 158
PHE A  93
MET A 132
LEU A 152
 None
 1.01A 3rfmA-1e0tA:
undetectable		 3rfmA-1e0tA:
20.33
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.
1elj MALTODEXTRIN-BINDING
PROTEIN

(Pyrococcus
furiosus) 		PF13416
(SBP_bac_8) 		4 PHE A 196
MET A 204
LEU A 356
ILE A 352
 None
 1.01A 3rfmA-1eljA:
0.0		 3rfmA-1eljA:
20.29
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.
1eu1 DIMETHYL SULFOXIDE
REDUCTASE

(Rhodobacter
sphaeroides) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding) 		5 VAL A 158
LEU A 748
ASN A 416
MET A 610
ILE A 607
 None
 1.31A 3rfmA-1eu1A:
0.0		 3rfmA-1eu1A:
17.85
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.
1ik6 PYRUVATE
DEHYDROGENASE

(Pyrobaculum
aerophilum) 		PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		4 VAL A 173
PHE A  87
LEU A  99
ILE A 140
 None
 0.93A 3rfmA-1ik6A:
undetectable		 3rfmA-1ik6A:
20.20
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.
1l1p TRIGGER FACTOR

(Escherichia
coli) 		PF00254
(FKBP_C) 		4 VAL A  72
PHE A  25
LEU A  44
ILE A  59
 None
 0.95A 3rfmA-1l1pA:
undetectable		 3rfmA-1l1pA:
15.64
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.
1nt2 FIBRILLARIN-LIKE
PRE-RRNA PROCESSING
PROTEIN

(Archaeoglobus
fulgidus) 		PF01269
(Fibrillarin) 		4 VAL A  61
LEU A  55
MET A   5
ILE A  78
 None
 0.97A 3rfmA-1nt2A:
undetectable		 3rfmA-1nt2A:
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.
1ofm CHONDROITINASE B

(Pedobacter
heparinus) 		PF14592
(Chondroitinas_B) 		4 VAL A 200
ASN A 281
MET A 268
ILE A 247
 None
 1.02A 3rfmA-1ofmA:
undetectable		 3rfmA-1ofmA:
21.18
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.
1p1e GLUTAMATE RECEPTOR
INTERACTING PROTEIN

(Rattus
norvegicus) 		PF00595
(PDZ) 		4 VAL A  78
LEU A  98
ASN A  95
ILE A  39
 None
 0.81A 3rfmA-1p1eA:
undetectable		 3rfmA-1p1eA:
15.36
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.
1ua4 ADP-DEPENDENT
GLUCOKINASE

(Pyrococcus
furiosus) 		PF04587
(ADP_PFK_GK) 		4 VAL A 289
LEU A 296
MET A 300
ILE A 299
 None
 0.79A 3rfmA-1ua4A:
0.0		 3rfmA-1ua4A:
20.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1uxe FIBER PROTEIN

(Human
mastadenovirus
D) 		PF00541
(Adeno_knob) 		4 VAL A 225
PHE A 244
LEU A 313
ILE A 233
 None
 1.01A 3rfmA-1uxeA:
undetectable		 3rfmA-1uxeA:
19.11
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.
1vd2 PROTEIN KINASE C,
IOTA TYPE

(Homo sapiens) 		PF00564
(PB1) 		4 VAL A  19
MET A  59
LEU A  77
ILE A  36
 None
 0.89A 3rfmA-1vd2A:
undetectable		 3rfmA-1vd2A:
15.03
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.
1vra ARGININE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
ARGJ

(Bacillus
halodurans) 		PF01960
(ArgJ) 		5 VAL A  33
LEU A 130
ASN A  89
MET A 103
ILE A 135
 None
 1.44A 3rfmA-1vraA:
0.0		 3rfmA-1vraA:
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.
1w2w 5-METHYLTHIORIBOSE-1
-PHOSPHATE ISOMERASE

(Saccharomyces
cerevisiae) 		PF01008
(IF-2B) 		4 VAL A  68
LEU A  99
ASN A  96
ILE A 119
 None
 0.90A 3rfmA-1w2wA:
0.5		 3rfmA-1w2wA:
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.
1y82 HYPOTHETICAL PROTEIN

(Pyrococcus
furiosus) 		PF01850
(PIN) 		4 PHE A  33
MET A 143
MET A 131
ILE A 113
 None
 1.01A 3rfmA-1y82A:
undetectable		 3rfmA-1y82A:
16.72
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.
1z2a RAS-RELATED PROTEIN
RAB-23

(Mus musculus) 		PF00071
(Ras) 		4 VAL A  53
LEU A  60
MET A  12
ILE A  10
 None
 1.03A 3rfmA-1z2aA:
undetectable		 3rfmA-1z2aA:
20.94
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.
1z2o INOSITOL
1,3,4-TRISPHOSPHATE
5/6-KINASE

(Entamoeba
histolytica) 		PF05770
(Ins134_P3_kin) 		4 VAL X 287
LEU X 267
MET X  91
ILE X  97
 None
 0.96A 3rfmA-1z2oX:
undetectable		 3rfmA-1z2oX:
18.58
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.
1z5a TYPE II DNA
TOPOISOMERASE VI
SUBUNIT B

(Sulfolobus
shibatae) 		PF02518
(HATPase_c)
PF05833
(FbpA)
PF09239
(Topo-VIb_trans) 		4 PHE A  90
LEU A  39
ASN A  42
ILE A 174
 ADP  A2001 ( 4.5A)
None
MG  A1001 ( 2.6A)
None
 0.93A 3rfmA-1z5aA:
undetectable		 3rfmA-1z5aA:
19.71
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.
2b4x ANTITHROMBIN-III

(Homo sapiens) 		PF00079
(Serpin) 		4 VAL I 165
LEU I  51
ASN I  55
ILE I 119
 None
 1.02A 3rfmA-2b4xI:
undetectable		 3rfmA-2b4xI:
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.
2bju PLASMEPSIN II

(Plasmodium
falciparum) 		PF00026
(Asp) 		4 VAL A 201
PHE A 299
LEU A 227
ILE A 289
 None
 0.98A 3rfmA-2bjuA:
undetectable		 3rfmA-2bjuA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2cf5 CINNAMYL ALCOHOL
DEHYDROGENASE

(Arabidopsis
thaliana) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		4 MET A 153
LEU A 318
MET A 195
ILE A 199
 None
 0.91A 3rfmA-2cf5A:
undetectable		 3rfmA-2cf5A:
21.25
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.
2fg1 CONSERVED
HYPOTHETICAL PROTEIN
BT1257

(Bacteroides
thetaiotaomicron) 		PF01661
(Macro) 		4 VAL A 118
LEU A 104
MET A 135
ILE A 139
 None
 0.80A 3rfmA-2fg1A:
undetectable		 3rfmA-2fg1A:
18.21
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.
2gwg 4-OXALOMESACONATE
HYDRATASE

(Rhodopseudomonas
palustris) 		PF04909
(Amidohydro_2) 		4 VAL A 138
LEU A  65
MET A   1
ILE A   3
 None
 1.00A 3rfmA-2gwgA:
undetectable		 3rfmA-2gwgA:
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.
2hhi IMMUNOGENIC PROTEIN
MPT64

(Mycobacterium
tuberculosis) 		PF11738
(DUF3298) 		4 VAL A 170
PHE A 177
LEU A 205
ILE A 201
 None
 0.98A 3rfmA-2hhiA:
undetectable		 3rfmA-2hhiA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ibu ACETYL-COA
ACETYLTRANSFERASE

(Homo sapiens) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		4 PHE A 315
MET A 141
LEU A 295
ILE A 133
 None
 1.02A 3rfmA-2ibuA:
undetectable		 3rfmA-2ibuA:
23.02
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.
2j0w LYSINE-SENSITIVE
ASPARTOKINASE 3

(Escherichia
coli) 		PF00696
(AA_kinase)
PF01842
(ACT) 		4 VAL A  33
PHE A   9
LEU A 130
ILE A 180
 None
 0.98A 3rfmA-2j0wA:
undetectable		 3rfmA-2j0wA:
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.
2jf3 ACYL-[ACYL-CARRIER-P
ROTEIN]--UDP-N-ACETY
LGLUCOSAMINE
O-ACYLTRANSFERASE

(Escherichia
coli) 		PF00132
(Hexapep)
PF13720
(Acetyltransf_11) 		4 VAL A 147
LEU A 117
ASN A  90
ILE A 123
 None
 0.99A 3rfmA-2jf3A:
undetectable		 3rfmA-2jf3A:
22.09
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.
2jzj CYANOVIRIN-N HOMOLOG

(Ceratopteris
richardii) 		PF08881
(CVNH) 		4 VAL A  12
PHE A   5
LEU A  37
ILE A  35
 None
 1.00A 3rfmA-2jzjA:
undetectable		 3rfmA-2jzjA:
16.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pmp 2-C-METHYL-D-ERYTHRI
TOL
2,4-CYCLODIPHOSPHATE
SYNTHASE

(Arabidopsis
thaliana) 		PF02542
(YgbB) 		4 VAL A  42
PHE A  10
LEU A 143
ILE A 102
 None
None
PO4  A 701 (-4.7A)
None
 0.93A 3rfmA-2pmpA:
undetectable		 3rfmA-2pmpA:
18.89
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.
2q3o 12-OXOPHYTODIENOATE
REDUCTASE 3

(Arabidopsis
thaliana) 		PF00724
(Oxidored_FMN) 		4 VAL A 237
MET A 263
LEU A 197
ILE A 193
 None
 1.01A 3rfmA-2q3oA:
undetectable		 3rfmA-2q3oA:
20.69
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.
2qp4 BILE SALT
SULFOTRANSFERASE

(Homo sapiens) 		PF00685
(Sulfotransfer_1) 		4 PHE A 109
MET A 173
LEU A  40
ILE A  38
 None
 0.72A 3rfmA-2qp4A:
undetectable		 3rfmA-2qp4A:
17.90
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.
2rvj EPITHELIAL SPLICING
REGULATORY PROTEIN 1

(Homo sapiens) 		PF00076
(RRM_1) 		4 VAL A 520
MET A 513
LEU A 465
ILE A 493
 None
 0.90A 3rfmA-2rvjA:
undetectable		 3rfmA-2rvjA:
15.20
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.
2vzb PUTATIVE
BACTERIOFERRITIN-REL
ATED PROTEIN

(Bacteroides
fragilis) 		PF00210
(Ferritin) 		4 VAL A  51
LEU A 157
ASN A 108
ILE A 160
 None
 1.01A 3rfmA-2vzbA:
2.3		 3rfmA-2vzbA:
17.93
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.
2x7i MEVALONATE KINASE

(Staphylococcus
aureus) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C) 		4 VAL A  30
MET A 174
LEU A 170
ILE A 219
 None
 1.01A 3rfmA-2x7iA:
undetectable		 3rfmA-2x7iA:
24.18
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.
3a1i AMIDASE

(Rhodococcus sp.
N-771) 		PF01425
(Amidase) 		4 VAL A  99
LEU A 128
MET A 243
ILE A 247
 None
 0.99A 3rfmA-3a1iA:
undetectable		 3rfmA-3a1iA:
21.03
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.
3ce1 SUPEROXIDE DISMUTASE
[CU-ZN]

(Naganishia
liquefaciens) 		PF00080
(Sod_Cu) 		4 VAL A 101
MET A  41
LEU A  11
ILE A 121
 None
 0.93A 3rfmA-3ce1A:
undetectable		 3rfmA-3ce1A:
19.45
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.
3d1r FRUCTOSE-1,6-BISPHOS
PHATASE CLASS II
GLPX

(Escherichia
coli) 		PF03320
(FBPase_glpX) 		4 VAL A 103
LEU A 290
MET A 197
ILE A 193
 None
 1.02A 3rfmA-3d1rA:
undetectable		 3rfmA-3d1rA:
22.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dkh LACCASE-1

(Melanocarpus
albomyces) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		5 VAL A 217
PHE A 170
LEU A 242
MET A 247
ILE A 277
 NAG  A 760 (-3.9A)
NAG  A 760 ( 4.9A)
None
None
None
 1.15A 3rfmA-3dkhA:
undetectable		 3rfmA-3dkhA:
18.37
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.
3h2t BASEPLATE STRUCTURAL
PROTEIN GP6

(Escherichia
virus T4) 		no annotation 4 VAL A 468
LEU A 651
ASN A 644
ILE A 653
 None
 0.96A 3rfmA-3h2tA:
undetectable		 3rfmA-3h2tA:
23.02
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.
3hm7 ALLANTOINASE

(Bacillus
halodurans) 		PF01979
(Amidohydro_1) 		4 VAL A 146
LEU A 138
ASN A 134
ILE A 176
 None
 0.86A 3rfmA-3hm7A:
undetectable		 3rfmA-3hm7A:
22.39
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.
3i0z PUTATIVE
TAGATOSE-6-PHOSPHATE
KETOSE/ALDOSE
ISOMERASE

(Streptococcus
pneumoniae) 		PF01380
(SIS) 		4 VAL A 304
LEU A 235
MET A 262
ILE A 233
 None
 0.99A 3rfmA-3i0zA:
undetectable		 3rfmA-3i0zA:
19.65
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.
3ial PROLYL-TRNA
SYNTHETASE

(Giardia
intestinalis) 		PF00587
(tRNA-synt_2b)
PF03129
(HGTP_anticodon)
PF09180
(ProRS-C_1) 		4 VAL A 404
LEU A 356
ASN A 439
ILE A 352
 None
 0.95A 3rfmA-3ialA:
undetectable		 3rfmA-3ialA:
19.70
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.
3jr3 NAD-DEPENDENT
DEACETYLASE

(Thermotoga
maritima) 		PF02146
(SIR2) 		4 VAL A 211
PHE A 235
MET A   3
LEU A  10
 None
 1.00A 3rfmA-3jr3A:
undetectable		 3rfmA-3jr3A:
19.71
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.
3jv9 TRANSCRIPTIONAL
REGULATOR, LYSR
FAMILY

(Neisseria
meningitidis) 		PF03466
(LysR_substrate) 		4 VAL A 101
LEU A 109
MET A 289
ILE A 293
 None
 0.92A 3rfmA-3jv9A:
undetectable		 3rfmA-3jv9A:
20.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nqy SECRETED
METALLOPROTEASE
MCP02

(Pseudoalteromonas
sp. SM9913) 		PF03413
(PepSY)
PF07504
(FTP) 		4 VAL A  95
LEU A 104
MET A  39
ILE A  36
 None
 0.95A 3rfmA-3nqyA:
undetectable		 3rfmA-3nqyA:
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.
3pvd CAPSID

(Norwalk virus) 		PF08435
(Calici_coat_C) 		4 PHE A 512
MET A 494
MET A 237
ILE A 234
 None
 0.98A 3rfmA-3pvdA:
undetectable		 3rfmA-3pvdA:
21.97
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3qak ADENOSINE RECEPTOR
A2A,LYSOZYME CHIMERA

(Escherichia
virus T4;
Homo sapiens) 		PF00001
(7tm_1)
PF00959
(Phage_lysozyme) 		6 VAL A  84
PHE A 168
MET A 177
LEU A 249
ASN A 253
ILE A 274
 None
UKA  A1200 (-3.4A)
UKA  A1200 (-4.8A)
UKA  A1200 (-4.9A)
UKA  A1200 (-3.4A)
UKA  A1200 (-4.9A)
 1.00A 3rfmA-3qakA:
31.9		 3rfmA-3qakA:
65.01
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.
3qay ENDOLYSIN

(Clostridium
virus phiCD27) 		PF01520
(Amidase_3) 		4 PHE A 146
LEU A  33
ASN A  30
ILE A 165
 None
 0.95A 3rfmA-3qayA:
undetectable		 3rfmA-3qayA:
20.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3sqz PUTATIVE
HYDROXYMETHYLGLUTARY
L-COA SYNTHASE

(Streptococcus
mutans) 		PF00195
(Chal_sti_synt_N)
PF08540
(HMG_CoA_synt_C) 		4 VAL A 135
PHE A 283
LEU A 171
ILE A   5
 None
 0.79A 3rfmA-3sqzA:
undetectable		 3rfmA-3sqzA:
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.
3t9w SMALL LACCASE,
MULTI-COPPER OXIDASE

(Amycolatopsis
sp. ATCC 39116) 		PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 VAL A  94
LEU A  89
MET A  41
ILE A  77
 None
 1.01A 3rfmA-3t9wA:
undetectable		 3rfmA-3t9wA:
19.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3te6 REGULATORY PROTEIN
SIR3

(Saccharomyces
cerevisiae) 		no annotation 4 VAL A 592
LEU A 722
ASN A 723
ILE A 720
 None
 1.01A 3rfmA-3te6A:
undetectable		 3rfmA-3te6A:
21.58
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.
3vx4 PUTATIVE ABC
TRANSPORTER,
ATP-BINDING PROTEIN
COMA

(Streptococcus
mutans) 		PF00005
(ABC_tran) 		4 PHE A 530
LEU A 559
MET A 734
ILE A 732
 None
 0.94A 3rfmA-3vx4A:
undetectable		 3rfmA-3vx4A:
23.32
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.
3w1o DNA MIMIC PROTEIN
DMP12

(Neisseria
meningitidis) 		PF16779
(DMP12) 		4 VAL A  56
PHE A 116
LEU A 104
ILE A 100
 None
 0.95A 3rfmA-3w1oA:
undetectable		 3rfmA-3w1oA:
15.20
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.
3zif HEXON PROTEIN

(Bovine
mastadenovirus
B) 		PF01065
(Adeno_hexon)
PF03678
(Adeno_hexon_C) 		4 PHE A 834
LEU A 860
ASN A 631
ILE A 683
 None
 0.99A 3rfmA-3zifA:
undetectable		 3rfmA-3zifA:
15.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zph CHALCONE ISOMERASE

(Eubacterium
ramulus) 		no annotation 4 PHE A 249
MET A 165
LEU A 190
ILE A 189
 None
 0.87A 3rfmA-3zphA:
undetectable		 3rfmA-3zphA:
21.83
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.
4at3 BDNF/NT-3 GROWTH
FACTORS RECEPTOR

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		4 VAL A 706
LEU A 645
ASN A 642
ILE A 762
 None
 1.01A 3rfmA-4at3A:
1.5		 3rfmA-4at3A:
19.94
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.
4b8s ADP-DEPENDENT
GLUCOKINASE

(Thermococcus
litoralis) 		PF04587
(ADP_PFK_GK) 		4 VAL A 302
LEU A 309
MET A 313
ILE A 312
 None
 0.82A 3rfmA-4b8sA:
undetectable		 3rfmA-4b8sA:
19.72
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.
4lxr PROTEIN TOLL

(Drosophila
melanogaster) 		PF00560
(LRR_1)
PF01462
(LRRNT)
PF13306
(LRR_5)
PF13855
(LRR_8) 		4 VAL A 247
PHE A 217
LEU A 228
ILE A 202
 None
 0.96A 3rfmA-4lxrA:
undetectable		 3rfmA-4lxrA:
17.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mn7 PUTATIVE
UNCHARACTERIZED
PROTEIN TA0848

(Thermoplasma
acidophilum) 		PF13185
(GAF_2) 		4 VAL A  94
LEU A  18
ASN A  22
ILE A 127
 None
 0.89A 3rfmA-4mn7A:
undetectable		 3rfmA-4mn7A:
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.
4n02 ISOPENTENYL-DIPHOSPH
ATE DELTA-ISOMERASE

(Streptococcus
pneumoniae) 		PF01070
(FMN_dh) 		4 VAL A 271
LEU A 300
MET A 304
ILE A 261
 None
 1.02A 3rfmA-4n02A:
undetectable		 3rfmA-4n02A:
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.
4p56 PUTATIVE
EXTRACELLULAR
SOLUTE-BINDING
PROTEIN

(Bordetella
bronchiseptica) 		PF03480
(DctP) 		4 VAL A  90
PHE A  99
LEU A 140
ILE A 143
 None
PGE  A 402 ( 4.5A)
None
None
 0.85A 3rfmA-4p56A:
undetectable		 3rfmA-4p56A:
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.
4q85 RIBOSOMAL PROTEIN
S12
METHYLTHIOTRANSFERAS
E ACCESSORY FACTOR
YCAO

(Escherichia
coli) 		PF02624
(YcaO) 		4 VAL A 117
LEU A 399
ASN A 403
ILE A 173
 None
 1.01A 3rfmA-4q85A:
undetectable		 3rfmA-4q85A:
19.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4uap GLYCOSYL HYDROLASE,
FAMILY
31/FIBRONECTIN TYPE
III DOMAIN PROTEIN

(Clostridium
perfringens) 		no annotation 4 VAL A  91
LEU A 141
MET A  38
ILE A 143
 None
 0.88A 3rfmA-4uapA:
undetectable		 3rfmA-4uapA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xri PUTATIVE
UNCHARACTERIZED
PROTEIN

(Chaetomium
thermophilum) 		PF03810
(IBN_N)
PF13513
(HEAT_EZ) 		4 VAL A 528
PHE A 462
LEU A 497
ILE A 482
 None
 0.85A 3rfmA-4xriA:
undetectable		 3rfmA-4xriA:
16.87
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.
4ypj BETA GALACTOSIDASE

(Bacillus
circulans) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF16355
(DUF4982) 		4 VAL A  39
PHE A  49
LEU A 164
ILE A 126
 None
 0.92A 3rfmA-4ypjA:
undetectable		 3rfmA-4ypjA:
16.91
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.
4zda ISOCITRATE
DEHYDROGENASE (NADP)
ICD2

(Mycolicibacterium
smegmatis) 		PF03971
(IDH) 		4 VAL A 216
LEU A 192
MET A 190
ILE A 224
 None
 0.84A 3rfmA-4zdaA:
undetectable		 3rfmA-4zdaA:
17.19
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.
5bn4 NEQ263

(Nanoarchaeum
equitans) 		PF00006
(ATP-synt_ab) 		4 VAL B 151
LEU B 224
MET B 279
ILE B 277
 None
 0.78A 3rfmA-5bn4B:
undetectable		 3rfmA-5bn4B:
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.
5fac ALANINE RACEMASE

(Streptomyces
coelicolor) 		PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N) 		4 VAL A 384
MET A 263
LEU A 351
ILE A 306
 None
 0.99A 3rfmA-5facA:
undetectable		 3rfmA-5facA:
22.57
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5g53 ADENOSINE RECEPTOR
A2A

(Homo sapiens) 		PF00001
(7tm_1) 		5 MET A 174
LEU A 249
ASN A 253
MET A 270
ILE A 274
 NEC  A 400 ( 4.8A)
NEC  A 400 ( 4.6A)
NEC  A 400 (-3.3A)
None
NEC  A 400 (-4.6A)
 1.44A 3rfmA-5g53A:
30.6		 3rfmA-5g53A:
91.19
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5g53 ADENOSINE RECEPTOR
A2A

(Homo sapiens) 		PF00001
(7tm_1) 		6 VAL A  84
PHE A 168
MET A 177
LEU A 249
ASN A 253
ILE A 274
 None
NEC  A 400 (-3.6A)
NEC  A 400 (-4.8A)
NEC  A 400 ( 4.6A)
NEC  A 400 (-3.3A)
NEC  A 400 (-4.6A)
 1.04A 3rfmA-5g53A:
30.6		 3rfmA-5g53A:
91.19
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.
5gkq ALYGC MUTANT - R241A

(Paraglaciecola
chathamensis) 		PF14592
(Chondroitinas_B) 		4 VAL A 129
LEU A 186
ASN A 205
ILE A 188
 None
 0.91A 3rfmA-5gkqA:
undetectable		 3rfmA-5gkqA:
17.53
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.
5h7j ELONGATION FACTOR 2

(Pyrococcus
horikoshii) 		no annotation 4 VAL A 355
LEU A  92
ASN A  94
ILE A  14
 None
 0.99A 3rfmA-5h7jA:
undetectable		 3rfmA-5h7jA:
12.54
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.
5huu ALPHA,ALPHA-TREHALOS
E-PHOSPHATE SYNTHASE
[UDP-FORMING]

(Candida
albicans) 		PF00982
(Glyco_transf_20) 		4 VAL A 185
PHE A  92
LEU A 148
ILE A 119
 None
 1.02A 3rfmA-5huuA:
undetectable		 3rfmA-5huuA:
19.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5kn7 LIPID A BIOSYNTHESIS
LAUROYL
ACYLTRANSFERASE

(Acinetobacter
baumannii) 		PF03279
(Lip_A_acyltrans) 		4 VAL B 116
LEU B 229
MET B 241
ILE B 243
 None
 1.02A 3rfmA-5kn7B:
undetectable		 3rfmA-5kn7B:
21.76
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.
5kvu ISOCITRATE
DEHYDROGENASE

(Mycobacterium
tuberculosis) 		PF03971
(IDH) 		4 VAL A 216
LEU A 192
MET A 190
ILE A 224
 None
 1.00A 3rfmA-5kvuA:
undetectable		 3rfmA-5kvuA:
17.26
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.
5lzk PROTEIN FAM83B

(Homo sapiens) 		PF07894
(DUF1669) 		4 VAL A 199
MET A 191
LEU A 180
ILE A 178
 None
 1.03A 3rfmA-5lzkA:
undetectable		 3rfmA-5lzkA:
20.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5n2s SOLUBLE CYTOCHROME
B562,ADENOSINE
RECEPTOR A1

(Escherichia
coli;
Homo sapiens) 		PF00001
(7tm_1)
PF07361
(Cytochrom_B562) 		5 VAL A1192
PHE A1276
LEU A1355
ASN A1359
ILE A1379
 8K8  A2001 ( 4.1A)
8K8  A2001 ( 3.4A)
8K8  A2001 ( 4.3A)
8K8  A2001 ( 3.1A)
8K8  A2001 ( 4.2A)
 0.87A 3rfmA-5n2sA:
34.0		 3rfmA-5n2sA:
45.45
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5n2s SOLUBLE CYTOCHROME
B562,ADENOSINE
RECEPTOR A1

(Escherichia
coli;
Homo sapiens) 		PF00001
(7tm_1)
PF07361
(Cytochrom_B562) 		5 VAL A1192
PHE A1276
MET A1285
LEU A1355
ASN A1359
 8K8  A2001 ( 4.1A)
8K8  A2001 ( 3.4A)
8K8  A2001 ( 4.5A)
8K8  A2001 ( 4.3A)
8K8  A2001 ( 3.1A)
 0.89A 3rfmA-5n2sA:
34.0		 3rfmA-5n2sA:
45.45
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.
5nug CYTOPLASMIC DYNEIN 1
HEAVY CHAIN 1

(Homo sapiens) 		PF03028
(Dynein_heavy)
PF07728
(AAA_5)
PF08393
(DHC_N2)
PF12774
(AAA_6)
PF12775
(AAA_7)
PF12777
(MT)
PF12780
(AAA_8)
PF12781
(AAA_9) 		4 MET A2755
LEU A2769
ASN A2752
MET A2773
 None
 0.67A 3rfmA-5nugA:
undetectable		 3rfmA-5nugA:
5.32
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.
5o6u UNCHARACTERIZED
PROTEIN

(Shewanella
putrefaciens) 		no annotation 4 VAL F 126
PHE F 255
LEU F 219
ILE F 242
 None
 1.01A 3rfmA-5o6uF:
undetectable		 3rfmA-5o6uF:
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.
5oat SERINE/THREONINE-PRO
TEIN KINASE PINK1,
MITOCHONDRIAL-LIKE
PROTEIN

(Tribolium
castaneum) 		no annotation 4 VAL A 325
LEU A 343
ASN A 342
ILE A 417
 None
 0.97A 3rfmA-5oatA:
undetectable		 3rfmA-5oatA:
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.
5ohs -

(-) 		no annotation 4 VAL A 357
ASN A 420
MET A 377
ILE A 372
 None
 0.94A 3rfmA-5ohsA:
undetectable		 3rfmA-5ohsA:
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.
5ucm PROLINE--TRNA LIGASE

(Pseudomonas
aeruginosa) 		PF00587
(tRNA-synt_2b)
PF03129
(HGTP_anticodon)
PF04073
(tRNA_edit) 		4 PHE A 472
LEU A   7
MET A 522
ILE A 525
 None
 0.98A 3rfmA-5ucmA:
undetectable		 3rfmA-5ucmA:
19.06
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5uen ADENOSINE RECEPTOR
A1,SOLUBLE
CYTOCHROME
B562,ADENOSINE
RECEPTOR A1

(Escherichia
coli;
Homo sapiens) 		PF00001
(7tm_1)
PF07361
(Cytochrom_B562) 		6 VAL A  87
PHE A 171
MET A 180
LEU A 250
ASN A 254
ILE A 274
 DU1  A1201 (-4.7A)
DU1  A1201 (-3.5A)
DU1  A1201 (-3.4A)
DU1  A1201 (-4.4A)
DU1  A1201 (-3.1A)
DU1  A1201 (-4.3A)
 0.94A 3rfmA-5uenA:
34.5		 3rfmA-5uenA:
40.09
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.
5v57 SMOOTHENED
HOMOLOG,FLAVODOXIN,S
MOOTHENED HOMOLOG

(Desulfovibrio
vulgaris;
Homo sapiens) 		PF00258
(Flavodoxin_1)
PF01392
(Fz)
PF01534
(Frizzled) 		4 VAL A 321
LEU A 522
MET A 230
ILE A 234
 None
836  A1201 (-4.6A)
836  A1201 (-3.5A)
None
 0.87A 3rfmA-5v57A:
18.6		 3rfmA-5v57A:
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.
5vc2 SERINE
HYDROXYMETHYLTRANSFE
RASE

(Helicobacter
pylori) 		PF00464
(SHMT) 		4 VAL A 144
PHE A 171
LEU A 315
ASN A 342
 None
 0.97A 3rfmA-5vc2A:
undetectable		 3rfmA-5vc2A:
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.
5w0x TIP41-LIKE PROTEIN

(Mus musculus) 		no annotation 4 VAL A 227
LEU A 242
MET A 196
ILE A 194
 None
 0.80A 3rfmA-5w0xA:
undetectable		 3rfmA-5w0xA:
11.08
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.
5wid -

(-) 		no annotation 4 VAL A  40
MET A  66
LEU A  74
ILE A  51
 None
 0.98A 3rfmA-5widA:
undetectable		 3rfmA-5widA:
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.
5x0y TRANSCRIPTION
REGULATORY PROTEIN
SNF2

(Saccharomyces
cerevisiae) 		PF00176
(SNF2_N)
PF00271
(Helicase_C)
PF14619
(SnAC) 		4 VAL O1011
LEU O1287
ASN O1284
ILE O1095
 None
 0.98A 3rfmA-5x0yO:
undetectable		 3rfmA-5x0yO:
17.05
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.
5ygf GH18329P

(Drosophila
melanogaster) 		no annotation 4 VAL A 265
LEU A 384
MET A 465
ILE A 461
 None
 0.86A 3rfmA-5ygfA:
undetectable		 3rfmA-5ygfA:
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.
5yid PLASMEPSIN II

(Plasmodium
falciparum) 		no annotation 4 VAL A 203
PHE A 301
LEU A 229
ILE A 291
 None
 0.99A 3rfmA-5yidA:
undetectable		 3rfmA-5yidA:
11.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6aqf ADENOSINE RECEPTOR
A2A,SOLUBLE
CYTOCHROME
B562,ADENOSINE
RECEPTOR A2A

(Escherichia
coli;
Homo sapiens) 		no annotation 5 PHE A 168
LEU A 249
ASN A 253
MET A 270
ILE A 274
 ZMA  A1201 (-3.5A)
ZMA  A1201 (-4.1A)
ZMA  A1201 (-3.2A)
ZMA  A1201 (-4.8A)
ZMA  A1201 (-4.8A)
 0.69A 3rfmA-6aqfA:
37.3		 3rfmA-6aqfA:
86.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6aqf ADENOSINE RECEPTOR
A2A,SOLUBLE
CYTOCHROME
B562,ADENOSINE
RECEPTOR A2A

(Escherichia
coli;
Homo sapiens) 		no annotation 6 VAL A  84
PHE A 168
MET A 177
LEU A 249
ASN A 253
ILE A 274
 None
ZMA  A1201 (-3.5A)
None
ZMA  A1201 (-4.1A)
ZMA  A1201 (-3.2A)
ZMA  A1201 (-4.8A)
 0.62A 3rfmA-6aqfA:
37.3		 3rfmA-6aqfA:
86.25
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.
6blb HOLLIDAY JUNCTION
ATP-DEPENDENT DNA
HELICASE RUVB

(Pseudomonas
aeruginosa) 		no annotation 4 VAL A  82
LEU A  56
MET A  42
ILE A  46
 None
 1.03A 3rfmA-6blbA:
undetectable		 3rfmA-6blbA:
21.79
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.
6d9h CHIMERA PROTEIN OF
MUSCARINIC
ACETYLCHOLINE
RECEPTOR M4 AND
ADENOSINE RECEPTOR
A1

(Homo sapiens) 		no annotation 6 VAL R  87
PHE R 171
MET R 180
LEU R 250
ASN R 254
ILE R 274
 ADN  R 400 (-4.8A)
ADN  R 400 (-3.8A)
ADN  R 400 (-4.6A)
ADN  R 400 (-4.5A)
ADN  R 400 (-2.9A)
ADN  R 400 ( 4.9A)
 1.04A 3rfmA-6d9hR:
29.6		 3rfmA-6d9hR:
15.38
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.
6emk SERINE/THREONINE-PRO
TEIN KINASE TOR2

(Saccharomyces
cerevisiae) 		no annotation 4 PHE A 212
LEU A 286
ASN A 266
ILE A 245
 None
 0.92A 3rfmA-6emkA:
undetectable		 3rfmA-6emkA:
10.64
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.
6fi7 RNA POLYMERASE SIGMA
FACTOR RPOS

(Escherichia
coli) 		no annotation 5 PHE A  96
LEU A  85
ASN A  91
MET A  23
ILE A  27
 None
 1.18A 3rfmA-6fi7A:
undetectable		 3rfmA-6fi7A:
12.87
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.
6gdg TRXA,ADENOSINE
RECEPTOR A2A

(Escherichia
coli;
Homo sapiens) 		no annotation 5 MET A 174
LEU A 249
ASN A 253
MET A 270
ILE A 274
 NEC  A 400 ( 4.7A)
NEC  A 400 (-4.9A)
NEC  A 400 (-3.5A)
None
NEC  A 400 (-4.2A)
 1.40A 3rfmA-6gdgA:
28.6		 3rfmA-6gdgA:
13.11
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.
6gdg TRXA,ADENOSINE
RECEPTOR A2A

(Escherichia
coli;
Homo sapiens) 		no annotation 4 MET A 177
LEU A 249
ASN A 253
ILE A 274
 NEC  A 400 (-4.3A)
NEC  A 400 (-4.9A)
NEC  A 400 (-3.5A)
NEC  A 400 (-4.2A)
 0.65A 3rfmA-6gdgA:
28.6		 3rfmA-6gdgA:
13.11