SIMILAR PATTERNS OF AMINO ACIDS FOR 3FAL_A_REAA501_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.
1air PECTATE LYASE C

(Dickeya
chrysanthemi)
PF00544
(Pec_lyase_C)
5 ILE A  33
ALA A  36
ALA A  35
ALA A  49
VAL A  82
None
0.91A 3falA-1airA:
undetectable
3falA-1airA:
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.
1al8 GLYCOLATE OXIDASE

(Spinacia
oleracea)
PF01070
(FMN_dh)
5 ILE A 227
ALA A 246
ALA A 241
VAL A 141
ILE A 222
None
1.12A 3falA-1al8A:
undetectable
3falA-1al8A:
21.27
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.
1ebd DIHYDROLIPOAMIDE
DEHYDROGENASE


(Geobacillus
stearothermophilus)
PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2)
5 ALA A 457
ALA A 456
ALA A 440
VAL A 361
ILE A 423
None
1.01A 3falA-1ebdA:
undetectable
3falA-1ebdA:
20.61
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.
1k7h ALKALINE PHOSPHATASE

(Pandalus
borealis)
PF00245
(Alk_phosphatase)
5 ILE A 350
ALA A  28
GLN A  27
ARG A 137
ILE A 458
None
1.13A 3falA-1k7hA:
undetectable
3falA-1k7hA:
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.
1l8w VLSE1

(Borreliella
burgdorferi)
PF00921
(Lipoprotein_2)
5 ILE A 174
PHE A  74
ALA A  78
VAL A 236
ILE A 235
None
1.04A 3falA-1l8wA:
undetectable
3falA-1l8wA:
21.35
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.
1nlu SEDOLISIN

(Pseudomonas sp.)
no annotation 5 ILE A 130
ALA A 121
GLN A 120
VAL A 294
ILE A  88
None
1.05A 3falA-1nluA:
undetectable
3falA-1nluA:
20.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1nmo HYPOTHETICAL PROTEIN
YBGI


(Escherichia
coli)
PF01784
(NIF3)
5 ILE A 179
ALA A 182
ALA A 183
ALA A 169
ILE A 200
None
0.87A 3falA-1nmoA:
undetectable
3falA-1nmoA:
23.37
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.
1onf GLUTATHIONE
REDUCTASE


(Plasmodium
falciparum)
PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2)
5 ALA A  16
ALA A  17
VAL A 295
ILE A 293
CYH A 312
None
0.83A 3falA-1onfA:
undetectable
3falA-1onfA:
18.76
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1uhl RETINOIC ACID
RECEPTOR RXR-BETA


(Homo sapiens)
PF00104
(Hormone_recep)
10 ILE A 339
ALA A 342
ALA A 343
GLN A 346
PHE A 384
ARG A 387
ALA A 398
VAL A 413
ILE A 416
CYH A 503
MEI  A1001 (-3.8A)
MEI  A1001 (-3.1A)
MEI  A1001 (-3.3A)
None
MEI  A1001 (-4.5A)
MEI  A1001 (-3.6A)
MEI  A1001 (-3.4A)
MEI  A1001 (-4.1A)
None
MEI  A1001 (-4.0A)
0.72A 3falA-1uhlA:
29.5
3falA-1uhlA:
88.19
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.
1vkx PROTEIN (NF-KAPPA B
P50 SUBUNIT)


(Mus musculus)
PF00554
(RHD_DNA_bind)
PF16179
(RHD_dimer)
5 ILE B 494
ALA B 497
ALA B 498
GLN B 501
ILE B 460
None
1.13A 3falA-1vkxB:
undetectable
3falA-1vkxB:
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.
1x0u HYPOTHETICAL
METHYLMALONYL-COA
DECARBOXYLASE ALPHA
SUBUNIT


(Sulfurisphaera
tokodaii)
PF01039
(Carboxyl_trans)
5 ILE A 316
ALA A 313
GLN A 314
ARG A 293
ILE A 354
None
1.05A 3falA-1x0uA:
0.5
3falA-1x0uA:
19.85
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.
1xdi RV3303C-LPDA

(Mycobacterium
tuberculosis)
PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2)
5 ALA A 461
ALA A 460
ALA A 444
VAL A 365
ILE A 427
None
1.06A 3falA-1xdiA:
undetectable
3falA-1xdiA:
20.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1xiu RXR-LIKE PROTEIN

(Biomphalaria
glabrata)
PF00104
(Hormone_recep)
10 ILE A 242
ALA A 245
ALA A 246
GLN A 249
PHE A 287
ARG A 290
ALA A 301
VAL A 316
ILE A 319
CYH A 406
9CR  A 201 ( 4.4A)
9CR  A 201 (-3.6A)
9CR  A 201 (-3.6A)
9CR  A 201 (-4.1A)
9CR  A 201 (-4.7A)
9CR  A 201 (-2.8A)
9CR  A 201 (-3.4A)
9CR  A 201 (-4.2A)
None
9CR  A 201 (-3.6A)
0.41A 3falA-1xiuA:
30.1
3falA-1xiuA:
81.17
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1xls RETINOIC ACID
RECEPTOR RXR-ALPHA


(Homo sapiens)
PF00104
(Hormone_recep)
10 ILE A 268
ALA A 271
ALA A 272
GLN A 275
PHE A 313
ARG A 316
ALA A 327
VAL A 342
ILE A 345
CYH A 432
9CR  A 801 (-3.9A)
9CR  A 801 (-3.6A)
9CR  A 801 (-3.5A)
9CR  A 801 (-4.7A)
9CR  A 801 (-4.3A)
9CR  A 801 (-2.6A)
9CR  A 801 (-3.3A)
9CR  A 801 ( 4.3A)
9CR  A 801 ( 4.5A)
9CR  A 801 ( 3.7A)
0.37A 3falA-1xlsA:
29.3
3falA-1xlsA:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zk7 MERCURIC REDUCTASE

(Pseudomonas
aeruginosa)
PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2)
6 ALA A 452
ALA A 451
GLN A 453
ALA A 435
VAL A 356
ILE A 418
None
None
GOL  A3003 ( 3.8A)
None
None
None
1.13A 3falA-1zk7A:
undetectable
3falA-1zk7A:
19.66
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.
2aa4 PUTATIVE
N-ACETYLMANNOSAMINE
KINASE


(Escherichia
coli)
PF00480
(ROK)
5 ILE A 183
ALA A 186
ALA A 187
GLN A 188
VAL A 243
None
1.05A 3falA-2aa4A:
undetectable
3falA-2aa4A:
19.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2eo4 150AA LONG
HYPOTHETICAL
HISTIDINE TRIAD
NUCLEOTIDE-BINDING
PROTEIN


(Sulfurisphaera
tokodaii)
PF01230
(HIT)
5 ILE A  39
ALA A  23
ALA A  24
ARG A   9
ILE A  92
None
None
None
None
PO4  A 202 ( 4.6A)
1.06A 3falA-2eo4A:
undetectable
3falA-2eo4A:
23.55
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.
2eq9 PYRUVATE
DEHYDROGENASE
COMPLEX,
DIHYDROLIPOAMIDE
DEHYDROGENASE E3
COMPONENT


(Thermus
thermophilus)
PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2)
5 ALA A 457
ALA A 456
ALA A 440
VAL A 361
ILE A 423
None
1.11A 3falA-2eq9A:
undetectable
3falA-2eq9A:
20.09
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2gl8 RETINOIC ACID
RECEPTOR RXR-GAMMA


(Homo sapiens)
PF00104
(Hormone_recep)
6 PHE A  92
ARG A  95
ALA A 106
VAL A 121
ILE A 124
CYH A 211
None
0.76A 3falA-2gl8A:
27.7
3falA-2gl8A:
85.66
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.
2iec UNCHARACTERIZED
PROTEIN CONSERVED IN
ARCHAEA


(Methanopyrus
kandleri)
PF04038
(DHNA)
5 ILE A  49
ALA A  52
ALA A  53
GLN A  56
VAL A  66
None
1.13A 3falA-2iecA:
undetectable
3falA-2iecA:
19.51
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.
2k3o TUSP1

(Nephila
antipodiana)
PF12042
(RP1-2)
5 ILE A  81
ALA A  84
ALA A  85
ALA A  60
ILE A  21
None
1.04A 3falA-2k3oA:
undetectable
3falA-2k3oA:
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.
2m64 PHLP5

(Phleum pratense)
PF01620
(Pollen_allerg_2)
5 ILE A 224
ALA A 196
PHE A 220
ALA A 219
ILE A 238
None
1.10A 3falA-2m64A:
undetectable
3falA-2m64A:
23.74
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.
2m64 PHLP5

(Phleum pratense)
PF01620
(Pollen_allerg_2)
5 ILE A 224
ALA A 223
PHE A 220
ALA A 219
ILE A 238
None
1.08A 3falA-2m64A:
undetectable
3falA-2m64A:
23.74
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.
2p6t TRANSCRIPTIONAL
REGULATOR, LRP/ASNC
FAMILY


(Neisseria
meningitidis)
PF01037
(AsnC_trans_reg)
PF13412
(HTH_24)
5 ILE A  72
ALA A  70
ALA A 112
GLN A  69
VAL A 134
None
1.11A 3falA-2p6tA:
undetectable
3falA-2p6tA:
23.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2q60 RETINOID X RECEPTOR

(Polyandrocarpa
misakiensis)
PF00104
(Hormone_recep)
6 PHE A 188
ARG A 191
ALA A 202
VAL A 217
ILE A 220
CYH A 307
None
0.70A 3falA-2q60A:
26.9
3falA-2q60A:
72.03
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.
2yik ENDOGLUCANASE

(Ruminiclostridium
thermocellum)
PF00759
(Glyco_hydro_9)
5 ILE A 328
ALA A 287
ALA A 286
VAL A 405
ILE A 402
None
1.08A 3falA-2yikA:
undetectable
3falA-2yikA:
16.50
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.
2z5x AMINE OXIDASE
[FLAVIN-CONTAINING]
A


(Homo sapiens)
PF01593
(Amino_oxidase)
5 ALA A  28
ALA A  29
ALA A 456
VAL A 244
ILE A 256
None
None
None
FAD  A 600 ( 4.0A)
None
1.13A 3falA-2z5xA:
undetectable
3falA-2z5xA:
18.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3b02 TRANSCRIPTIONAL
REGULATOR, CRP
FAMILY


(Thermus
thermophilus)
PF00027
(cNMP_binding)
PF13545
(HTH_Crp_2)
5 ILE A 145
ARG A 115
ALA A 150
VAL A 176
ILE A 169
None
1.09A 3falA-3b02A:
undetectable
3falA-3b02A:
26.00
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.
3b2g FERREDOXIN-1

(Leptolyngbya
boryana)
PF00111
(Fer2)
5 ILE A  26
ALA A  29
ALA A  30
GLN A  33
ILE A  53
None
1.10A 3falA-3b2gA:
undetectable
3falA-3b2gA:
18.22
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.
3bj1 HEMOGLOBIN ALPHA
HEMOGLOBIN BETA


(Perca
flavescens)
PF00042
(Globin)
5 ILE B 112
ALA B 115
ALA B 116
ARG A  31
VAL B  34
None
1.08A 3falA-3bj1B:
undetectable
3falA-3bj1B:
20.49
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.
3cgd PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE,
CLASS I


(Bacillus
anthracis)
PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2)
5 ALA A  15
ALA A  16
VAL A 266
ILE A 264
CYH A 283
None
0.96A 3falA-3cgdA:
undetectable
3falA-3cgdA:
19.67
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.
3dkn PREPROTEIN
TRANSLOCASE SUBUNIT
SECY


(Canis lupus)
PF00344
(SecY)
5 ILE A 174
ALA A 175
ALA A 176
VAL A  79
ILE A  78
None
0.99A 3falA-3dknA:
undetectable
3falA-3dknA:
19.64
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dzu RETINOIC ACID
RECEPTOR RXR-ALPHA


(Homo sapiens)
PF00104
(Hormone_recep)
PF00105
(zf-C4)
10 ILE A 268
ALA A 271
ALA A 272
GLN A 275
PHE A 313
ARG A 316
ALA A 327
VAL A 342
ILE A 345
CYH A 432
9CR  A7223 (-3.9A)
9CR  A7223 (-3.5A)
9CR  A7223 (-4.2A)
9CR  A7223 (-4.6A)
9CR  A7223 (-4.5A)
9CR  A7223 (-3.7A)
9CR  A7223 ( 4.7A)
9CR  A7223 ( 4.5A)
9CR  A7223 ( 4.9A)
9CR  A7223 (-3.8A)
0.78A 3falA-3dzuA:
29.5
3falA-3dzuA:
51.82
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.
3f8r THIOREDOXIN
REDUCTASE (TRXB-3)


(Sulfolobus
solfataricus)
PF07992
(Pyr_redox_2)
5 ALA A  30
ALA A  31
VAL A 271
ILE A 269
CYH A 288
None
1.03A 3falA-3f8rA:
undetectable
3falA-3f8rA:
20.74
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.
3fmf DETHIOBIOTIN
SYNTHETASE


(Mycobacterium
tuberculosis)
PF13500
(AAA_26)
5 ALA A 133
ALA A 134
ALA A 132
VAL A  33
ILE A  31
None
CSX  A 163 ( 4.9A)
None
None
None
1.05A 3falA-3fmfA:
undetectable
3falA-3fmfA:
22.79
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.
3fq8 GLUTAMATE-1-SEMIALDE
HYDE 2,1-AMINOMUTASE


(Synechococcus
elongatus)
PF00202
(Aminotran_3)
5 ILE A1275
PHE A1119
ALA A1312
VAL A1111
ILE A1114
None
1.06A 3falA-3fq8A:
undetectable
3falA-3fq8A:
19.33
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.
3g23 LD-CARBOXYPEPTIDASE
A


(Novosphingobium
aromaticivorans)
PF02016
(Peptidase_S66)
5 ALA A   9
PHE A  42
ALA A  49
VAL A  22
ILE A  23
None
1.00A 3falA-3g23A:
undetectable
3falA-3g23A:
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.
3h7a SHORT CHAIN
DEHYDROGENASE


(Rhodopseudomonas
palustris)
PF00106
(adh_short)
5 ILE A  21
ALA A  22
ALA A  19
ALA A  34
ILE A 183
ILE  A  21 ( 0.6A)
ALA  A  22 ( 0.0A)
ALA  A  19 ( 0.0A)
ALA  A  34 ( 0.0A)
ILE  A 183 ( 0.7A)
1.09A 3falA-3h7aA:
undetectable
3falA-3h7aA:
23.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3iwa FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULPHID
E OXIDOREDUCTASE


(Desulfovibrio
vulgaris)
PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2)
5 ALA A  17
ALA A  18
VAL A 277
ILE A 275
CYH A 294
None
0.73A 3falA-3iwaA:
undetectable
3falA-3iwaA:
20.21
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.
3iwa FAD-DEPENDENT
PYRIDINE
NUCLEOTIDE-DISULPHID
E OXIDOREDUCTASE


(Desulfovibrio
vulgaris)
PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2)
5 ILE A 321
ALA A  17
ALA A  18
VAL A 277
ILE A 275
None
1.06A 3falA-3iwaA:
undetectable
3falA-3iwaA:
20.21
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.
3j0l RIBOSOMAL PROTEIN
S14


(Oryctolagus
cuniculus)
PF00411
(Ribosomal_S11)
5 ILE K  42
ALA K  77
ALA K  74
GLN K  76
ILE K  95
None
1.09A 3falA-3j0lK:
undetectable
3falA-3j0lK:
24.14
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.
3kyf PUTATIVE
UNCHARACTERIZED
PROTEIN


(Pseudomonas
putida)
PF07238
(PilZ)
PF07317
(YcgR)
5 ALA A 224
GLN A 225
PHE A 217
VAL A 136
ILE A 138
None
1.00A 3falA-3kyfA:
undetectable
3falA-3kyfA:
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.
3lqy PUTATIVE
ISOCHORISMATASE
HYDROLASE


(Oleispira
antarctica)
PF00857
(Isochorismatase)
5 ALA A 146
ALA A  35
GLN A  38
ALA A 182
ILE A  77
None
0.93A 3falA-3lqyA:
undetectable
3falA-3lqyA:
21.10
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.
3o85 RIBOSOMAL PROTEIN
L7AE


(Giardia
intestinalis)
PF01248
(Ribosomal_L7Ae)
5 ILE A 101
ALA A  99
ALA A  39
VAL A 110
ILE A 114
None
1.08A 3falA-3o85A:
undetectable
3falA-3o85A:
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.
3oc4 OXIDOREDUCTASE,
PYRIDINE
NUCLEOTIDE-DISULFIDE
FAMILY


(Enterococcus
faecalis)
PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2)
5 ALA A  15
ALA A  16
VAL A 261
ILE A 259
CYH A 278
None
0.92A 3falA-3oc4A:
undetectable
3falA-3oc4A:
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.
3pfe SUCCINYL-DIAMINOPIME
LATE DESUCCINYLASE


(Legionella
pneumophila)
PF01546
(Peptidase_M20)
PF07687
(M20_dimer)
5 ILE A 141
ALA A 143
GLN A  14
VAL A  91
ILE A 187
None
1.01A 3falA-3pfeA:
undetectable
3falA-3pfeA:
18.83
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.
3r11 ENZYME OF ENOLASE
SUPERFAMILY


(Francisella
philomiragia)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
5 ILE A 282
ALA A 279
GLN A 280
VAL A 257
ILE A 258
None
1.08A 3falA-3r11A:
undetectable
3falA-3r11A:
19.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3s4w FANCONI ANEMIA GROUP
D2 PROTEIN HOMOLOG


(Mus musculus)
PF14631
(FancD2)
5 ILE B 366
ALA B 365
ALA B 297
ILE B 410
CYH B 409
None
1.13A 3falA-3s4wB:
undetectable
3falA-3s4wB:
12.06
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.
3sky COPPER-EXPORTING
P-TYPE ATPASE B


(Archaeoglobus
fulgidus)
PF00702
(Hydrolase)
5 ILE A 433
ALA A 437
ARG A 514
VAL A 469
ILE A 499
None
1.08A 3falA-3skyA:
undetectable
3falA-3skyA:
22.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3u8p CYTOCHROME B562
INTEGRAL FUSION WITH
ENHANCED GREEN
FLUORESCENT PROTEIN


(Aequorea
victoria;
Escherichia
coli)
PF01353
(GFP)
PF07361
(Cytochrom_B562)
5 ALA A  78
ALA A  77
ALA A  82
VAL A  58
ILE A  59
None
1.13A 3falA-3u8pA:
undetectable
3falA-3u8pA:
22.47
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.
3wc3 ENDO-1,
4-BETA-GLUCANASE


(Eisenia fetida)
PF00759
(Glyco_hydro_9)
5 ALA A 177
PHE A  87
ALA A  86
VAL A 335
ILE A 332
None
1.10A 3falA-3wc3A:
undetectable
3falA-3wc3A:
18.14
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.
4atw ALPHA-L-ARABINOFURAN
OSIDASE DOMAIN
PROTEIN


(Thermotoga
maritima)
PF06964
(Alpha-L-AF_C)
5 ALA A 394
ALA A 408
PHE A 471
VAL A 463
ILE A 461
None
1.13A 3falA-4atwA:
undetectable
3falA-4atwA:
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.
4b7x PROBABLE
OXIDOREDUCTASE


(Pseudomonas
aeruginosa)
PF00107
(ADH_zinc_N)
PF16884
(ADH_N_2)
5 ILE A 178
ALA A 179
ALA A 157
ILE A 217
CYH A 213
None
NAP  A 400 (-3.7A)
None
None
None
1.10A 3falA-4b7xA:
undetectable
3falA-4b7xA:
22.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bwc PHOSPHOLIPASE B-LIKE
1


(Bos taurus)
PF04916
(Phospholip_B)
5 ILE A  95
ALA A  98
ALA A  99
ALA A  42
VAL B 263
None
1.11A 3falA-4bwcA:
undetectable
3falA-4bwcA:
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.
4c3y 3-KETOSTEROID
DEHYDROGENASE


(Rhodococcus
erythropolis)
PF00890
(FAD_binding_2)
5 ALA A 228
ALA A  19
ALA A 475
VAL A 210
ILE A 219
FAD  A 551 ( 4.8A)
None
None
None
None
1.05A 3falA-4c3yA:
undetectable
3falA-4c3yA:
19.66
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.
4dix PLECTIN-RELATED
PROTEIN


(Arabidopsis
thaliana)
PF16709
(SCAB-IgPH)
5 ILE A 457
ALA A 458
ALA A 444
GLN A 443
ILE A 411
None
1.05A 3falA-4dixA:
undetectable
3falA-4dixA:
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.
4ds3 PHOSPHORIBOSYLGLYCIN
AMIDE
FORMYLTRANSFERASE


(Brucella
melitensis)
PF00551
(Formyl_trans_N)
5 ALA A  24
ALA A  23
GLN A  25
VAL A 139
ILE A 110
None
0.87A 3falA-4ds3A:
undetectable
3falA-4ds3A:
26.24
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.
4e6u ACYL-[ACYL-CARRIER-P
ROTEIN]--UDP-N-ACETY
LGLUCOSAMINE
O-ACYLTRANSFERASE


(Acinetobacter
baumannii)
PF00132
(Hexapep)
PF13720
(Acetyltransf_11)
5 ILE A 221
ALA A 231
GLN A 234
VAL A 184
ILE A 196
None
1.00A 3falA-4e6uA:
undetectable
3falA-4e6uA:
21.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fdw LEUCINE RICH
HYPOTHETICAL PROTEIN


(Bacteroides
ovatus)
PF07523
(Big_3)
PF13306
(LRR_5)
5 ALA A 290
GLN A 269
VAL A 280
ILE A 277
CYH A 297
None
1.06A 3falA-4fdwA:
undetectable
3falA-4fdwA:
24.40
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.
4itu SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE SDR


(Xanthobacter
autotrophicus)
PF13561
(adh_short_C2)
5 ILE A  12
ALA A  35
ALA A  44
VAL A 230
ILE A 231
None
0.98A 3falA-4ituA:
undetectable
3falA-4ituA:
23.38
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4j5x RETINOIC ACID
RECEPTOR RXR-ALPHA,
NUCLEAR RECEPTOR
COACTIVATOR 1


(Homo sapiens)
no annotation 10 ILE D 268
ALA D 271
ALA D 272
GLN D 275
PHE D 313
ARG D 316
ALA D 327
VAL D 342
ILE D 345
CYH D 432
None
0.57A 3falA-4j5xD:
27.8
3falA-4j5xD:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4j5x RETINOIC ACID
RECEPTOR RXR-ALPHA,
NUCLEAR RECEPTOR
COACTIVATOR 1


(Homo sapiens)
no annotation 7 ILE D 268
ALA D 271
GLN D 275
PHE D 313
VAL D 342
ILE D 345
CYH D 432
None
1.45A 3falA-4j5xD:
27.8
3falA-4j5xD:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jz7 CARBAMATE KINASE

(Giardia
intestinalis)
PF00696
(AA_kinase)
5 ILE A  39
ALA A  36
ALA A  35
ALA A  96
VAL A   7
None
0.83A 3falA-4jz7A:
undetectable
3falA-4jz7A:
22.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4kf7 NUP188

(Thermothelomyces
thermophila)
PF10487
(Nup188)
5 ALA A 822
ALA A 821
VAL A 915
ILE A 840
CYH A 837
None
1.04A 3falA-4kf7A:
undetectable
3falA-4kf7A:
12.71
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.
4n4w CYTOCHROME
B(562),SMOOTHENED
HOMOLOG


(Homo sapiens;
Shigella
flexneri)
PF01534
(Frizzled)
PF07361
(Cytochrom_B562)
5 ALA A  36
ALA A  35
ALA A  40
VAL A  16
ILE A  17
None
1.09A 3falA-4n4wA:
undetectable
3falA-4n4wA:
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.
4nn1 TRANSCRIPTIONAL
REGULATOR


(Mycobacterium
tuberculosis)
PF00440
(TetR_N)
5 ILE A  12
ALA A  15
ALA A  16
GLN A  19
ALA A  35
None
0.49A 3falA-4nn1A:
undetectable
3falA-4nn1A:
26.84
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.
4ntj P2Y PURINOCEPTOR
12,SOLUBLE
CYTOCHROME B562,P2Y
PURINOCEPTOR 12


(Escherichia
coli;
Homo sapiens)
PF00001
(7tm_1)
PF07361
(Cytochrom_B562)
5 ALA A1036
ALA A1035
ALA A1040
VAL A1016
ILE A1017
None
1.12A 3falA-4ntjA:
undetectable
3falA-4ntjA:
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.
4o9r SMOOTHENED
HOMOLOG/SOLUBLE
CYTOCHROME B562
CHIMERIC PROTEIN


(Escherichia
coli;
Homo sapiens)
PF01534
(Frizzled)
PF07361
(Cytochrom_B562)
5 ALA A1036
ALA A1035
ALA A1040
VAL A1016
ILE A1017
None
1.07A 3falA-4o9rA:
undetectable
3falA-4o9rA:
20.64
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.
4p56 PUTATIVE
EXTRACELLULAR
SOLUTE-BINDING
PROTEIN


(Bordetella
bronchiseptica)
PF03480
(DctP)
5 ILE A  53
ALA A  56
ARG A 260
VAL A  87
ILE A 242
None
1.11A 3falA-4p56A:
undetectable
3falA-4p56A:
24.71
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.
4pq9 BETA-1,3-GLUCANASE

(Mycobacterium
marinum)
PF00722
(Glyco_hydro_16)
6 ILE A  90
ALA A 101
ALA A  92
ARG A  55
VAL A 252
ILE A 120
None
1.26A 3falA-4pq9A:
undetectable
3falA-4pq9A:
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.
4qji PHOSPHOPANTOTHENOYLC
YSTEINE
DECARBOXYLASE/PHOSPH
OPANTOTHENATE--CYSTE
INE LIGASE


(Mycolicibacterium
smegmatis)
PF04127
(DFP)
5 ALA A 277
ALA A 196
PHE A 332
ALA A 278
ILE A 405
CTP  A 500 (-4.8A)
None
None
None
None
1.04A 3falA-4qjiA:
undetectable
3falA-4qjiA:
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.
4rt6 HEMOPEXIN

(Oryctolagus
cuniculus)
PF00045
(Hemopexin)
5 ILE B  88
ALA B  76
ALA B  77
PHE B 138
ALA B 122
None
1.03A 3falA-4rt6B:
undetectable
3falA-4rt6B:
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.
4rwa SOLUBLE CYTOCHROME
B562,DELTA-TYPE
OPIOID RECEPTOR


(Escherichia
coli;
Homo sapiens)
PF00001
(7tm_1)
PF07361
(Cytochrom_B562)
5 ALA A1036
ALA A1035
ALA A1040
VAL A1016
ILE A1017
None
1.09A 3falA-4rwaA:
2.4
3falA-4rwaA:
18.47
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.
4tv6 2-DEHYDRO-3-DEOXYGLU
CARATE ALDOLASE


(Staphylococcus
aureus)
PF03328
(HpcH_HpaI)
5 ILE A  33
ALA A  34
ALA A  35
ALA A  65
ILE A 241
None
1.12A 3falA-4tv6A:
undetectable
3falA-4tv6A:
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.
4wop ATP-DEPENDENT
DETHIOBIOTIN
SYNTHETASE BIOD


(Mycobacterium
tuberculosis)
PF13500
(AAA_26)
5 ALA A 133
ALA A 134
ALA A 132
VAL A  33
ILE A  31
None
1.09A 3falA-4wopA:
undetectable
3falA-4wopA:
21.01
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.
4y4n PUTATIVE RIBOSE
1,5-BISPHOSPHATE
ISOMERASE


(Methanotorris
igneus)
PF01946
(Thi4)
5 ALA A  44
ALA A  45
ALA A 252
VAL A 146
ILE A 165
None
1.10A 3falA-4y4nA:
undetectable
3falA-4y4nA:
22.33
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.
4z36 LYSOPHOSPHATIDIC
ACID RECEPTOR
1,SOLUBLE CYTOCHROME
B562


(Escherichia
coli;
Homo sapiens)
PF00001
(7tm_1)
PF07361
(Cytochrom_B562)
5 ALA A1036
ALA A1035
ALA A1040
VAL A1016
ILE A1017
None
1.09A 3falA-4z36A:
undetectable
3falA-4z36A:
19.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zud CHIMERA PROTEIN OF
SOLUBLE CYTOCHROME
B562 AND TYPE-1
ANGIOTENSIN II
RECEPTOR


(Escherichia
coli;
Homo sapiens)
PF00001
(7tm_1)
PF07361
(Cytochrom_B562)
5 ALA A1036
ALA A1035
ALA A1040
VAL A1016
ILE A1017
None
1.12A 3falA-4zudA:
undetectable
3falA-4zudA:
20.83
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.
5g5n LH3
HEXON-INTERLACING
CAPSID PROTEIN


(Snake
atadenovirus A)
PF01696
(Adeno_E1B_55K)
5 ILE A 179
ALA A 145
VAL A 165
ILE A 132
CYH A 127
None
0.89A 3falA-5g5nA:
undetectable
3falA-5g5nA:
18.64
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.
5h3k SLR0280 PROTEIN

(Synechocystis
sp. PCC 6803)
no annotation 5 ALA A 151
ALA A 192
GLN A 152
VAL A 250
ILE A 261
None
1.08A 3falA-5h3kA:
undetectable
3falA-5h3kA:
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.
5hdm GLUTAMATE-1-SEMIALDE
HYDE 2,1-AMINOMUTASE
1, CHLOROPLASTIC


(Arabidopsis
thaliana)
PF00202
(Aminotran_3)
5 ILE A 276
PHE A 120
ALA A 313
VAL A 112
ILE A 115
None
1.03A 3falA-5hdmA:
undetectable
3falA-5hdmA:
20.74
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.
5jbw 3-HYDROXYBUTYRYL-COA
DEHYDRATASE


(Myxococcus
xanthus)
PF00378
(ECH_1)
5 ILE A 102
ALA A 101
ALA A 100
ALA A 190
ILE A 166
None
1.01A 3falA-5jbwA:
undetectable
3falA-5jbwA:
25.87
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.
5jo7 VETISPIRADIENE
SYNTHASE 1


(Hyoscyamus
muticus)
PF01397
(Terpene_synth)
PF03936
(Terpene_synth_C)
5 ILE A 439
ALA A 442
ALA A 494
VAL A 508
ILE A 512
None
0.98A 3falA-5jo7A:
undetectable
3falA-5jo7A:
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.
5l6m RIBONUCLEASE VAPC

(Caulobacter
vibrioides)
PF01850
(PIN)
5 ILE B  82
ALA B 100
ALA B  99
GLN B 101
ALA B  75
None
1.04A 3falA-5l6mB:
undetectable
3falA-5l6mB:
19.01
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.
5n2s SOLUBLE CYTOCHROME
B562,ADENOSINE
RECEPTOR A1


(Escherichia
coli;
Homo sapiens)
PF00001
(7tm_1)
PF07361
(Cytochrom_B562)
5 ALA A1036
ALA A1035
ALA A1040
VAL A1016
ILE A1017
None
1.09A 3falA-5n2sA:
2.1
3falA-5n2sA:
21.41
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.
5nj6 PROTEINASE-ACTIVATED
RECEPTOR 2,SOLUBLE
CYTOCHROME
B562,PROTEINASE-ACTI
VATED RECEPTOR 2


(Escherichia
coli;
Homo sapiens)
PF00001
(7tm_1)
PF07361
(Cytochrom_B562)
5 ALA A2035
ALA A2034
ALA A2039
VAL A2015
ILE A2016
None
1.10A 3falA-5nj6A:
undetectable
3falA-5nj6A:
19.04
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.
5ojl IMINE REDUCTASE

(Aspergillus
terreus)
no annotation 6 ILE A 137
ALA A 135
ALA A 125
ALA A 132
ILE A  68
CYH A  70
None
None
9X5  A 301 ( 4.8A)
None
None
None
1.25A 3falA-5ojlA:
undetectable
3falA-5ojlA:
13.41
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.
5tem 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
REDUCTASE


(Vibrio
vulnificus)
no annotation 5 ALA C  30
ALA C  31
GLN C  68
VAL C  96
ILE C  95
None
1.05A 3falA-5temC:
undetectable
3falA-5temC:
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.
5txr 5-AMINOLEVULINATE
SYNTHASE,
MITOCHONDRIAL


(Saccharomyces
cerevisiae)
no annotation 5 ILE B 331
ALA B 347
ALA B 348
ALA B 168
ILE B 264
None
0.92A 3falA-5txrB:
undetectable
3falA-5txrB:
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.
5u1d ANTIGEN PEPTIDE
TRANSPORTER 1
ANTIGEN PEPTIDE
TRANSPORTER 2


(Homo sapiens)
PF00005
(ABC_tran)
PF00664
(ABC_membrane)
5 ILE B 193
ALA B 192
PHE B 189
ALA B 188
VAL A 424
None
1.11A 3falA-5u1dB:
undetectable
3falA-5u1dB:
16.01
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5uan RETINOIC ACID
RECEPTOR RXR-ALPHA


(Homo sapiens)
no annotation 7 ALA A 271
ALA A 272
GLN A 275
PHE A 313
ARG A 316
ALA A 327
ILE A 428
9CR  A 503 (-3.5A)
9CR  A 503 (-3.5A)
9CR  A 503 (-3.8A)
9CR  A 503 (-4.7A)
9CR  A 503 (-3.0A)
9CR  A 503 (-3.4A)
None
1.40A 3falA-5uanA:
28.7
3falA-5uanA:
66.30
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5uan RETINOIC ACID
RECEPTOR RXR-ALPHA


(Homo sapiens)
no annotation 10 ILE A 268
ALA A 271
ALA A 272
GLN A 275
PHE A 313
ARG A 316
ALA A 327
VAL A 342
ILE A 345
CYH A 432
9CR  A 503 (-4.0A)
9CR  A 503 (-3.5A)
9CR  A 503 (-3.5A)
9CR  A 503 (-3.8A)
9CR  A 503 (-4.7A)
9CR  A 503 (-3.0A)
9CR  A 503 (-3.4A)
None
None
9CR  A 503 (-3.3A)
0.64A 3falA-5uanA:
28.7
3falA-5uanA:
66.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ung CHIMERA PROTEIN OF
TYPE-2 ANGIOTENSIN
II RECEPTOR AND
SOLUBLE CYTOCHROME
B562


(Escherichia
coli;
Homo sapiens)
PF00001
(7tm_1)
PF07361
(Cytochrom_B562)
5 ALA B1036
ALA B1035
ALA B1040
VAL B1016
ILE B1017
None
1.10A 3falA-5ungB:
undetectable
3falA-5ungB:
20.79
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.
6c2h CYSTATHIONINE
BETA-SYNTHASE


(Saccharomyces
cerevisiae)
no annotation 5 ILE A  39
ALA A 315
ALA A  41
PHE A 294
ALA A 293
None
1.04A 3falA-6c2hA:
undetectable
3falA-6c2hA:
15.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6cbo C-6'
AMINOTRANSFERASE


(Micromonospora
echinospora)
no annotation 5 ILE A  45
ALA A  34
PHE A 353
ALA A 352
ILE A 365
None
0.98A 3falA-6cboA:
undetectable
3falA-6cboA:
15.48
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.
6cmz DIHYDROLIPOYL
DEHYDROGENASE


(Burkholderia
cenocepacia)
no annotation 5 ALA A  20
ALA A  21
ALA A 329
VAL A 126
ILE A 137
None
1.03A 3falA-6cmzA:
undetectable
3falA-6cmzA:
26.15
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.
6d95 -

(-)
no annotation 5 ILE A 129
ALA A 132
ALA A 133
ALA A 266
ILE A 180
None
0.87A 3falA-6d95A:
undetectable
3falA-6d95A:
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.
6f4f GLUTATHIONE
TRANSFERASE


(Trametes
versicolor)
no annotation 5 ILE A  88
ALA A  28
ALA A  30
ALA A  95
ILE A  78
None
1.08A 3falA-6f4fA:
undetectable
3falA-6f4fA:
14.88
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.
6gdg TRXA,ADENOSINE
RECEPTOR A2A


(Escherichia
coli;
Homo sapiens)
no annotation 5 ALA A 203
ALA A 204
GLN A 207
VAL A 239
ILE A 238
None
0.94A 3falA-6gdgA:
2.1
3falA-6gdgA:
13.64
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.
6gdg TRXA,ADENOSINE
RECEPTOR A2A


(Escherichia
coli;
Homo sapiens)
no annotation 5 ILE A 200
ALA A 203
ALA A 204
GLN A 207
ILE A 238
None
0.90A 3falA-6gdgA:
2.1
3falA-6gdgA:
13.64