SIMILAR PATTERNS OF AMINO ACIDS FOR 3FRE_X_TOPX300_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.
1a5l UREASE (ALPHA
SUBUNIT)


(Klebsiella
aerogenes)
PF00449
(Urease_alpha)
PF01979
(Amidohydro_1)
5 ASP C 431
LEU C 429
VAL C 421
PHE C 491
THR C 152
None
1.05A 3freX-1a5lC:
undetectable
3freX-1a5lC:
14.73
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.
1a5l UREASE (ALPHA
SUBUNIT)


(Klebsiella
aerogenes)
PF00449
(Urease_alpha)
PF01979
(Amidohydro_1)
5 ASP C 431
LEU C 429
VAL C 421
SER C 509
PHE C 491
None
1.15A 3freX-1a5lC:
undetectable
3freX-1a5lC:
14.73
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.
1c0a ASPARTYL TRNA
SYNTHETASE


(Escherichia
coli)
PF00152
(tRNA-synt_2)
PF01336
(tRNA_anti-codon)
PF02938
(GAD)
5 ALA A 396
LEU A 299
VAL A 295
SER A 366
ILE A 352
AMP  A 800 (-4.1A)
None
None
None
None
1.13A 3freX-1c0aA:
undetectable
3freX-1c0aA:
15.11
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.
1dr6 DIHYDROFOLATE
REDUCTASE


(Gallus gallus)
PF00186
(DHFR_1)
5 ALA A   9
LEU A  22
SER A  59
ILE A  60
THR A 136
HBI  A 198 ( 3.6A)
NAP  A 191 ( 4.7A)
NAP  A 191 ( 4.1A)
None
HBI  A 198 ( 4.5A)
0.91A 3freX-1dr6A:
20.2
3freX-1dr6A:
27.96
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.
1g1a DTDP-D-GLUCOSE
4,6-DEHYDRATASE


(Salmonella
enterica)
PF16363
(GDP_Man_Dehyd)
5 VAL A  77
SER A  62
ILE A  65
PHE A  69
THR A 189
None
1.16A 3freX-1g1aA:
undetectable
3freX-1g1aA:
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.
1ge9 RIBOSOME RECYCLING
FACTOR


(Aquifex
aeolicus)
PF01765
(RRF)
5 ALA A  35
LEU A  39
LEU A  89
VAL A 102
ILE A  43
None
1.23A 3freX-1ge9A:
undetectable
3freX-1ge9A:
22.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1m66 GLYCEROL-3-PHOSPHATE
DEHYDROGENASE


(Leishmania
mexicana)
PF01210
(NAD_Gly3P_dh_N)
PF07479
(NAD_Gly3P_dh_C)
5 LEU A 151
LEU A  30
VAL A  33
ILE A  88
THR A 166
None
0.99A 3freX-1m66A:
undetectable
3freX-1m66A:
17.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1o1y CONSERVED
HYPOTHETICAL PROTEIN
TM1158


(Thermotoga
maritima)
PF00117
(GATase)
5 LEU A 221
LEU A  85
VAL A 168
ILE A 174
PHE A 125
None
1.07A 3freX-1o1yA:
undetectable
3freX-1o1yA:
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.
1o6e CAPSID PROTEIN P40

(Human
gammaherpesvirus
4)
PF00716
(Peptidase_S21)
5 ALA A  52
LEU A 201
LEU A 112
ILE A  85
THR A  45
None
1.29A 3freX-1o6eA:
undetectable
3freX-1o6eA:
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.
1ooe DIHYDROPTERIDINE
REDUCTASE


(Caenorhabditis
elegans)
PF00106
(adh_short)
5 ALA A 112
LEU A 164
LEU A 119
VAL A  76
SER A 218
None
1.29A 3freX-1ooeA:
undetectable
3freX-1ooeA:
19.50
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.
1pca PROCARBOXYPEPTIDASE
A PCPA


(Sus scrofa)
PF00246
(Peptidase_M14)
PF02244
(Propep_M14)
5 ALA A  63
LEU A  29
LEU A  35
VAL A  56
ILE A  15
None
1.26A 3freX-1pcaA:
undetectable
3freX-1pcaA:
17.00
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.
1pyt PROCARBOXYPEPTIDASE
A


(Bos taurus)
PF02244
(Propep_M14)
5 ALA A  63
LEU A  29
LEU A  35
VAL A  56
ILE A  15
None
1.27A 3freX-1pytA:
undetectable
3freX-1pytA:
19.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qc5 PROTEIN (ALPHA1
BETA1 INTEGRIN)


(Homo sapiens)
PF00092
(VWA)
5 LEU B 359
VAL B 395
ILE B 402
PHE B 384
THR B 369
None
1.28A 3freX-1qc5B:
undetectable
3freX-1qc5B:
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.
1qmv PEROXIREDOXIN-2

(Homo sapiens)
PF00578
(AhpC-TSA)
PF10417
(1-cysPrx_C)
5 LEU A  96
ASP A  46
SER A  59
ILE A 101
THR A  82
None
1.22A 3freX-1qmvA:
undetectable
3freX-1qmvA:
20.98
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.
1x3l HYPOTHETICAL PROTEIN
PH0495


(Pyrococcus
horikoshii)
PF05161
(MOFRL)
PF13660
(DUF4147)
5 ALA A 112
LEU A 181
LEU A  56
VAL A  79
SER A 174
None
1.29A 3freX-1x3lA:
undetectable
3freX-1x3lA:
16.82
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1zdr DIHYDROFOLATE
REDUCTASE


(Geobacillus
stearothermophilus)
PF00186
(DHFR_1)
5 ALA A   7
LEU A  20
ASP A  27
ILE A  50
THR A 115
None
None
None
SO4  A3486 ( 4.8A)
None
0.66A 3freX-1zdrA:
26.0
3freX-1zdrA:
48.77
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1zdr DIHYDROFOLATE
REDUCTASE


(Geobacillus
stearothermophilus)
PF00186
(DHFR_1)
5 ALA A   7
LEU A  20
ASP A  27
LEU A  28
THR A 115
None
None
None
SO4  A3486 ( 4.8A)
None
0.58A 3freX-1zdrA:
26.0
3freX-1zdrA:
48.77
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.
2blb DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE


(Plasmodium
vivax)
PF00186
(DHFR_1)
6 ALA A  15
LEU A  45
ASP A  53
SER A 120
ILE A 121
THR A 194
CP7  A1240 (-3.7A)
NDP  A1239 (-4.8A)
CP7  A1240 (-3.1A)
NDP  A1239 (-3.6A)
MES  A1241 ( 4.1A)
CP7  A1240 (-4.1A)
0.83A 3freX-2blbA:
19.7
3freX-2blbA:
28.22
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.
2boa CARBOXYPEPTIDASE A4

(Homo sapiens)
PF00246
(Peptidase_M14)
PF02244
(Propep_M14)
5 ALA A  63
LEU A  29
LEU A  35
VAL A  56
ILE A  15
None
1.29A 3freX-2boaA:
undetectable
3freX-2boaA:
17.91
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.
2cex PROTEIN HI0146

(Haemophilus
influenzae)
PF03480
(DctP)
5 ALA A  93
ASP A 213
LEU A 215
ILE A 107
PHE A  98
None
1.17A 3freX-2cexA:
undetectable
3freX-2cexA:
18.94
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.
2d4e 5-CARBOXYMETHYL-2-HY
DROXYMUCONATE
SEMIALDEHYDE
DEHYDROGENASE


(Thermus
thermophilus)
PF00171
(Aldedh)
5 LEU A  92
LEU A 217
VAL A 221
ILE A 183
THR A  83
None
1.06A 3freX-2d4eA:
undetectable
3freX-2d4eA:
16.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2dmz INAD-LIKE PROTEIN

(Homo sapiens)
PF00595
(PDZ)
5 ALA A  94
LEU A  29
LEU A 100
VAL A  74
ILE A  33
None
1.19A 3freX-2dmzA:
undetectable
3freX-2dmzA:
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.
2ecf DIPEPTIDYL PEPTIDASE
IV


(Stenotrophomonas
maltophilia)
PF00326
(Peptidase_S9)
PF00930
(DPPIV_N)
5 ALA A 143
LEU A  79
VAL A  80
SER A 117
PHE A 125
None
1.07A 3freX-2ecfA:
undetectable
3freX-2ecfA:
12.09
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.
2h2q BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE


(Trypanosoma
cruzi)
PF00186
(DHFR_1)
PF00303
(Thymidylat_synt)
5 ALA A  28
ASP A  48
SER A  83
ILE A  84
THR A 178
NAP  A 523 (-3.7A)
None
NAP  A 523 ( 4.4A)
None
None
0.92A 3freX-2h2qA:
19.2
3freX-2h2qA:
14.96
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.
2ilu ALDEHYDE
DEHYDROGENASE A


(Escherichia
coli)
PF00171
(Aldedh)
5 LEU A 167
LEU A 197
VAL A 192
ILE A 112
PHE A 188
None
1.25A 3freX-2iluA:
undetectable
3freX-2iluA:
15.42
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.
2jik SYNAPTOJANIN-2
BINDING PROTEIN


(Homo sapiens)
PF00595
(PDZ)
5 ALA A  88
LEU A  23
LEU A  94
VAL A  68
ILE A  27
None
1.12A 3freX-2jikA:
undetectable
3freX-2jikA:
22.84
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.
2lf8 TRANSCRIPTION FACTOR
ETV6


(Mus musculus)
PF00178
(Ets)
5 LEU A 394
LEU A 337
VAL A 341
ILE A 402
PHE A 415
None
1.06A 3freX-2lf8A:
undetectable
3freX-2lf8A:
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.
2mzb ADENOSYLCOBINAMIDE-P
HOSPHATE
GUANYLYLTRANSFERASE


(Methanocaldococcus
jannaschii)
PF12804
(NTP_transf_3)
5 ALA A  48
ASP A  83
LEU A  84
PHE A  95
THR A  75
None
1.11A 3freX-2mzbA:
2.1
3freX-2mzbA:
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.
2o1b AMINOTRANSFERASE,
CLASS I


(Staphylococcus
aureus)
PF00155
(Aminotran_1_2)
5 ALA A 273
LEU A 231
VAL A 242
ILE A  74
PHE A  70
None
1.15A 3freX-2o1bA:
undetectable
3freX-2o1bA:
16.71
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.
2oap TYPE II SECRETION
SYSTEM PROTEIN


(Archaeoglobus
fulgidus)
PF00437
(T2SSE)
5 LEU 1 381
VAL 1 383
SER 1 362
ILE 1 264
PHE 1 351
None
1.20A 3freX-2oap1:
undetectable
3freX-2oap1:
16.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2oip CHAIN A, CRYSTAL
STRUCTURE OF DHFR


(Cryptosporidium
hominis)
PF00186
(DHFR_1)
PF00303
(Thymidylat_synt)
7 ALA A  11
LEU A  25
ASP A  32
LEU A  33
SER A  61
ILE A  62
THR A 134
MTX  A 605 ( 3.6A)
MTX  A 605 ( 4.6A)
MTX  A 605 ( 3.0A)
MTX  A 605 ( 4.0A)
NDP  A 606 ( 4.5A)
MTX  A 605 ( 4.6A)
MTX  A 605 ( 4.2A)
0.71A 3freX-2oipA:
21.4
3freX-2oipA:
17.27
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2qk8 DIHYDROFOLATE
REDUCTASE


(Bacillus
anthracis)
PF00186
(DHFR_1)
7 ALA A   8
LEU A  21
LEU A  29
VAL A  32
ILE A  51
PHE A  96
THR A 115
MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.7A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.9A)
MTX  A 200 ( 4.4A)
0.78A 3freX-2qk8A:
25.1
3freX-2qk8A:
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.
2qyv XAA-HIS DIPEPTIDASE

(Histophilus
somni)
PF01546
(Peptidase_M20)
PF07687
(M20_dimer)
5 ALA A 123
LEU A 137
LEU A 480
SER A 162
ILE A 164
None
1.28A 3freX-2qyvA:
undetectable
3freX-2qyvA:
14.14
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.
2rh7 GREEN FLUORESCENT
PROTEIN


(Renilla
reniformis)
PF01353
(GFP)
5 ALA A  57
LEU A 129
VAL A  22
ILE A  97
PHE A 124
None
1.22A 3freX-2rh7A:
undetectable
3freX-2rh7A:
19.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2v0s LR1

(Homo sapiens)
PF03372
(Exo_endo_phos)
5 LEU A 129
LEU A 172
VAL A 206
PHE A 146
THR A 140
None
1.26A 3freX-2v0sA:
undetectable
3freX-2v0sA:
22.32
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2w3w DIHYDROFOLATE
REDUCTASE


(Mycobacterium
avium)
PF00186
(DHFR_1)
5 ALA A  11
ASP A  31
LEU A  32
SER A  53
THR A 121
VG9  A1168 ( 3.8A)
VG9  A1168 (-3.0A)
VG9  A1168 (-4.7A)
NDP  A1169 ( 3.9A)
VG9  A1168 ( 4.7A)
0.83A 3freX-2w3wA:
22.6
3freX-2w3wA:
31.40
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2w9s DIHYDROFOLATE
REDUCTASE TYPE 1
FROM TN4003


(Staphylococcus
aureus)
PF00186
(DHFR_1)
8 ALA A   7
LEU A  20
ASP A  27
LEU A  28
SER A  49
ILE A  50
PHE A  92
THR A 111
TOP  A1160 ( 3.6A)
TOP  A1160 ( 4.2A)
TOP  A1160 (-2.8A)
TOP  A1160 ( 4.6A)
TOP  A1160 (-3.5A)
TOP  A1160 (-4.4A)
TOP  A1160 ( 3.9A)
TOP  A1160 ( 4.5A)
0.43A 3freX-2w9sA:
30.1
3freX-2w9sA:
80.62
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.
3b33 SENSOR PROTEIN

(Vibrio
parahaemolyticus)
PF00989
(PAS)
5 ALA A  16
LEU A  89
VAL A  91
ILE A  53
THR A  15
None
1.02A 3freX-3b33A:
undetectable
3freX-3b33A:
20.37
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.
3ca8 PROTEIN YDCF

(Escherichia
coli)
PF02698
(DUF218)
5 LEU A 256
LEU A 209
VAL A 205
SER A  10
ILE A  14
None
1.26A 3freX-3ca8A:
undetectable
3freX-3ca8A:
18.99
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dfr DIHYDROFOLATE
REDUCTASE


(Lactobacillus
casei)
PF00186
(DHFR_1)
6 ALA A   6
LEU A  19
ASP A  26
LEU A  27
SER A  48
THR A 116
MTX  A 164 (-3.8A)
MTX  A 164 (-4.5A)
MTX  A 164 ( 2.9A)
MTX  A 164 ( 4.5A)
MTX  A 164 (-3.5A)
MTX  A 164 ( 4.3A)
0.67A 3freX-3dfrA:
23.9
3freX-3dfrA:
35.54
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.
3dg8 BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE


(Plasmodium
falciparum)
PF00186
(DHFR_1)
6 ALA A  16
LEU A  46
ASP A  54
SER A 111
ILE A 112
THR A 185
RJ6  A 609 (-3.7A)
RJ6  A 609 (-3.8A)
RJ6  A 609 (-3.0A)
RJ6  A 609 ( 3.8A)
RJ6  A 609 (-4.8A)
RJ6  A 609 ( 4.5A)
0.83A 3freX-3dg8A:
20.2
3freX-3dg8A:
22.58
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.
3fhc NUCLEAR PORE COMPLEX
PROTEIN NUP214


(Homo sapiens)
PF12894
(ANAPC4_WD40)
5 LEU A 144
LEU A 177
VAL A 165
SER A 173
ILE A 174
None
0.96A 3freX-3fhcA:
undetectable
3freX-3fhcA:
15.91
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.
3g04 THYROTROPIN RECEPTOR

(Homo sapiens)
PF13306
(LRR_5)
5 LEU C 246
LEU C 231
VAL C 205
ILE C 216
PHE C 197
None
1.09A 3freX-3g04C:
undetectable
3freX-3g04C:
22.82
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.
3hs0 COBRA VENOM FACTOR

(Naja kaouthia)
PF01835
(A2M_N)
PF07703
(A2M_N_2)
5 ALA A 374
LEU A 376
ILE A 389
PHE A 325
THR A 368
None
1.26A 3freX-3hs0A:
undetectable
3freX-3hs0A:
14.24
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3i8a DIHYDROFOLATE
REDUCTASE


(Staphylococcus
aureus)
PF00186
(DHFR_1)
8 ALA X   7
LEU X  20
ASP X  27
LEU X  28
VAL X  31
ILE X  50
PHE X  92
THR X 111
N22  X 219 ( 3.6A)
N22  X 219 ( 4.6A)
N22  X 219 (-2.8A)
N22  X 219 (-4.4A)
None
N22  X 219 (-4.6A)
N22  X 219 ( 3.7A)
N22  X 219 (-4.4A)
0.54A 3freX-3i8aX:
30.9
3freX-3i8aX:
98.73
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3i8a DIHYDROFOLATE
REDUCTASE


(Staphylococcus
aureus)
PF00186
(DHFR_1)
8 ALA X   7
LEU X  20
ASP X  27
VAL X  31
SER X  49
ILE X  50
PHE X  92
THR X 111
N22  X 219 ( 3.6A)
N22  X 219 ( 4.6A)
N22  X 219 (-2.8A)
None
N22  X 219 (-3.3A)
N22  X 219 (-4.6A)
N22  X 219 ( 3.7A)
N22  X 219 (-4.4A)
0.58A 3freX-3i8aX:
30.9
3freX-3i8aX:
98.73
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ia4 DIHYDROFOLATE
REDUCTASE


(Moritella
profunda)
PF00186
(DHFR_1)
5 ALA A   8
LEU A  29
SER A  50
ILE A  51
THR A 115
MTX  A 164 ( 3.7A)
MTX  A 164 (-4.0A)
NDP  A 163 ( 3.8A)
MTX  A 164 (-4.1A)
MTX  A 164 (-4.3A)
0.56A 3freX-3ia4A:
25.7
3freX-3ia4A:
39.51
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.
3kip 3-DEHYDROQUINASE,
TYPE II


(Candida
albicans)
PF01220
(DHquinase_II)
5 ALA A  78
LEU A  12
VAL A 102
ILE A  31
THR A  82
None
1.26A 3freX-3kipA:
undetectable
3freX-3kipA:
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.
3kjr DIHYDROFOLATE
REDUCTASE/THYMIDYLAT
E SYNTHASE


(Babesia bovis)
PF00186
(DHFR_1)
PF00303
(Thymidylat_synt)
5 ALA A  16
ASP A  37
SER A  72
ILE A  73
THR A 144
NAP  A 512 (-3.7A)
None
NAP  A 512 ( 4.2A)
None
None
0.84A 3freX-3kjrA:
20.6
3freX-3kjrA:
15.47
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.
3ktn CARBOHYDRATE KINASE,
PFKB FAMILY


(Enterococcus
faecalis)
PF00294
(PfkB)
5 ALA A 301
LEU A 254
ILE A 194
PHE A 196
THR A 302
None
1.29A 3freX-3ktnA:
undetectable
3freX-3ktnA:
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.
3la4 UREASE

(Canavalia
ensiformis)
PF00449
(Urease_alpha)
PF00547
(Urease_gamma)
PF00699
(Urease_beta)
PF01979
(Amidohydro_1)
5 ASP A 704
LEU A 702
VAL A 694
PHE A 764
THR A 425
None
0.97A 3freX-3la4A:
undetectable
3freX-3la4A:
10.27
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.
3o44 HEMOLYSIN

(Vibrio cholerae)
PF07968
(Leukocidin)
PF12563
(Hemolysin_N)
PF16458
(Beta-prism_lec)
5 ALA A 583
LEU A 188
VAL A 186
SER A 398
PHE A 446
None
1.29A 3freX-3o44A:
undetectable
3freX-3o44A:
13.12
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.
3p04 UNCHARACTERIZED BCR

(Corynebacterium
glutamicum)
PF04472
(SepF)
5 ALA A  86
LEU A 115
VAL A 133
ILE A 108
PHE A  95
None
1.19A 3freX-3p04A:
undetectable
3freX-3p04A:
16.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qpm PEROXIREDOXIN

(Larimichthys
crocea)
PF00578
(AhpC-TSA)
PF10417
(1-cysPrx_C)
5 LEU A 158
ASP A 108
SER A 121
ILE A 163
THR A 144
None
1.19A 3freX-3qpmA:
undetectable
3freX-3qpmA:
22.45
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.
3s5k FALCILYSIN

(Plasmodium
falciparum)
PF00675
(Peptidase_M16)
PF05193
(Peptidase_M16_C)
PF08367
(M16C_assoc)
5 LEU A 431
LEU A 490
VAL A 493
ILE A 419
PHE A 498
None
1.22A 3freX-3s5kA:
undetectable
3freX-3s5kA:
10.29
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.
3tpa HEME-BINDING PROTEIN
A


(Glaesserella
parasuis)
PF00496
(SBP_bac_5)
5 LEU A 146
VAL A 157
SER A  64
ILE A  63
PHE A  72
None
1.02A 3freX-3tpaA:
undetectable
3freX-3tpaA:
16.63
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3tq9 DIHYDROFOLATE
REDUCTASE


(Coxiella
burnetii)
PF00186
(DHFR_1)
7 ALA A   8
LEU A  21
ASP A  28
LEU A  29
SER A  50
ILE A  51
THR A 115
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 (-4.3A)
0.57A 3freX-3tq9A:
25.2
3freX-3tq9A:
38.76
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.
3vco DIHYDROFOLATE
REDUCTASE


(Schistosoma
mansoni)
PF00186
(DHFR_1)
5 ALA A   8
ASP A  28
SER A  56
ILE A  57
THR A 133
None
0.97A 3freX-3vcoA:
17.6
3freX-3vcoA:
28.92
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.
3wmy EXTRACELLULAR
EXO-ALPHA-L-ARABINOF
URANOSIDASE


(Streptomyces
coelicolor)
PF03664
(Glyco_hydro_62)
5 LEU A 178
LEU A 446
VAL A 441
SER A 390
ILE A 377
None
0.97A 3freX-3wmyA:
undetectable
3freX-3wmyA:
15.53
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.
3wvs PUTATIVE
MONOOXYGENASE


(Streptomyces
sp. SN-593)
PF00067
(p450)
5 ALA A  58
LEU A  38
VAL A 314
ILE A 301
PHE A  67
None
1.23A 3freX-3wvsA:
undetectable
3freX-3wvsA:
19.69
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.
3zrp SERINE-PYRUVATE
AMINOTRANSFERASE
(AGXT)


(Sulfolobus
solfataricus)
PF00266
(Aminotran_5)
5 ALA A  66
LEU A 223
LEU A 202
VAL A 182
SER A 215
None
1.18A 3freX-3zrpA:
undetectable
3freX-3zrpA:
17.71
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.
4g7e UREASE

(Cajanus cajan)
PF00449
(Urease_alpha)
PF00547
(Urease_gamma)
PF00699
(Urease_beta)
PF01979
(Amidohydro_1)
5 ASP B 704
LEU B 702
VAL B 694
PHE B 764
THR B 425
None
0.97A 3freX-4g7eB:
undetectable
3freX-4g7eB:
10.26
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.
4g8z DIHYDROFOLATE
REDUCTASE


(Pneumocystis
jirovecii)
PF00186
(DHFR_1)
5 ALA X  12
LEU X  25
SER X  64
ILE X  65
THR X 144
NDP  X 302 ( 3.8A)
TOP  X 301 ( 4.0A)
TOP  X 301 (-3.3A)
TOP  X 301 ( 4.3A)
TOP  X 301 (-4.5A)
0.56A 3freX-4g8zX:
20.0
3freX-4g8zX:
29.58
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.
4h05 AMINOGLYCOSIDE-O-PHO
SPHOTRANSFERASE VIII


(Streptomyces
rimosus)
PF01636
(APH)
5 ALA A  94
LEU A 185
VAL A 220
SER A 116
PHE A 240
None
1.18A 3freX-4h05A:
undetectable
3freX-4h05A:
18.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4h6x THIAZOLINE
OXIDASE/SUBTILISIN-L
IKE PROTEASE


(Prochloron
didemni)
PF00082
(Peptidase_S8)
5 ALA A 844
LEU A 796
VAL A 839
ILE A 637
THR A 819
None
1.15A 3freX-4h6xA:
undetectable
3freX-4h6xA:
18.08
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4h98 DIHYDROFOLATE
REDUCTASE


([Candida]
glabrata)
PF00186
(DHFR_1)
5 ALA A  11
LEU A  25
SER A  61
ILE A  62
THR A 140
14Q  A 302 ( 3.4A)
14Q  A 302 ( 4.1A)
14Q  A 302 (-2.6A)
14Q  A 302 (-4.2A)
14Q  A 302 (-4.2A)
0.57A 3freX-4h98A:
19.4
3freX-4h98A:
31.39
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.
4jbu VIRULENCE-ASSOCIATED
V ANTIGEN


(Yersinia pestis)
PF04792
(LcrV)
5 LEU A 253
LEU A 280
VAL A 284
SER A 235
ILE A 236
None
1.12A 3freX-4jbuA:
undetectable
3freX-4jbuA:
18.97
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.
4l8l 3-DEHYDROQUINATE
DEHYDRATASE 1


(Pseudomonas
aeruginosa)
PF01220
(DHquinase_II)
5 LEU A  12
LEU A 102
VAL A 100
ILE A  31
THR A  80
None
1.17A 3freX-4l8lA:
undetectable
3freX-4l8lA:
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.
4lr2 BIS(5'-ADENOSYL)-TRI
PHOSPHATASE ENPP4


(Homo sapiens)
PF01663
(Phosphodiest)
5 ALA A  90
ASP A 264
VAL A 268
ILE A 299
PHE A  66
None
0.93A 3freX-4lr2A:
undetectable
3freX-4lr2A:
16.88
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4m7v DIHYDROFOLATE
REDUCTASE


(Enterococcus
faecalis)
PF00186
(DHFR_1)
5 ALA A   7
LEU A  20
ASP A  27
LEU A  28
THR A 116
RAR  A 200 ( 3.6A)
RAR  A 200 ( 3.7A)
RAR  A 200 (-2.6A)
RAR  A 200 (-3.8A)
RAR  A 200 (-4.4A)
0.29A 3freX-4m7vA:
25.4
3freX-4m7vA:
43.27
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.
4mzw GLUTATHIONE
S-TRANSFERASE


(Streptococcus
sanguinis)
PF02798
(GST_N)
PF13410
(GST_C_2)
5 ALA A 123
LEU A 119
LEU A 144
VAL A 140
SER A 211
None
1.21A 3freX-4mzwA:
undetectable
3freX-4mzwA:
21.36
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.
4o8o ALPHA-L-ARABINOFURAN
OSIDASE


(Streptomyces
thermoviolaceus)
PF03664
(Glyco_hydro_62)
5 LEU A  64
LEU A 334
VAL A 329
SER A 278
ILE A 264
None
0.96A 3freX-4o8oA:
undetectable
3freX-4o8oA:
18.13
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.
4oq1 CELL WALL SURFACE
ANCHOR FAMILY
PROTEIN


(Streptococcus
pneumoniae)
no annotation 5 ALA A 141
LEU A  52
VAL A 110
ILE A 103
PHE A 127
None
1.24A 3freX-4oq1A:
undetectable
3freX-4oq1A:
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.
4oxx CINDOXIN

(Citrobacter
braakii)
PF00258
(Flavodoxin_1)
5 LEU A  82
LEU A  45
ILE A  52
PHE A  71
THR A  78
None
1.16A 3freX-4oxxA:
2.2
3freX-4oxxA:
19.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4p68 DIHYDROFOLATE
REDUCTASE


(Escherichia
coli)
PF00186
(DHFR_1)
5 ALA A   7
ASP A  27
SER A  49
ILE A  50
THR A 113
MTX  A 201 ( 4.0A)
MTX  A 201 (-3.0A)
MTX  A 201 ( 3.7A)
MTX  A 201 (-4.7A)
MTX  A 201 ( 4.5A)
0.52A 3freX-4p68A:
25.9
3freX-4p68A:
36.25
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.
4q2n INAD-LIKE PROTEIN

(Homo sapiens)
PF00595
(PDZ)
5 ALA A 441
LEU A 376
LEU A 447
VAL A 421
ILE A 380
None
0.91A 3freX-4q2nA:
undetectable
3freX-4q2nA:
24.49
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.
4qax 2,3-BISPHOSPHOGLYCER
ATE-INDEPENDENT
PHOSPHOGLYCERATE
MUTASE


(Staphylococcus
aureus)
PF01676
(Metalloenzyme)
PF06415
(iPGM_N)
5 ALA A 287
LEU A  97
LEU A 132
SER A  85
ILE A  82
None
1.28A 3freX-4qaxA:
undetectable
3freX-4qaxA:
15.97
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.
4qlb PROBABLE GLYCOGEN
[STARCH] SYNTHASE


(Caenorhabditis
elegans)
PF05693
(Glycogen_syn)
5 ALA A 392
ASP A 475
LEU A 478
VAL A 477
SER A 401
None
1.10A 3freX-4qlbA:
undetectable
3freX-4qlbA:
14.37
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.
4qpp PROTEIN ARGININE
N-METHYLTRANSFERASE
6


(Homo sapiens)
PF13649
(Methyltransf_25)
5 ALA A 173
LEU A  87
LEU A 145
VAL A 143
SER A  97
None
1.29A 3freX-4qppA:
undetectable
3freX-4qppA:
16.90
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.
4r1n 3-HYDROXYBUTYRYL-COA
DEHYDROGENASE


(Clostridium
butyricum)
PF00725
(3HCDH)
PF02737
(3HCDH_N)
5 LEU A  83
VAL A  85
SER A 171
ILE A 172
PHE A 139
None
1.28A 3freX-4r1nA:
undetectable
3freX-4r1nA:
20.07
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.
4r8f VACUOLAR
AMINOPEPTIDASE 1


(Saccharomyces
cerevisiae)
PF02127
(Peptidase_M18)
5 ALA A 422
LEU A 310
VAL A  84
SER A 318
THR A 424
None
1.28A 3freX-4r8fA:
undetectable
3freX-4r8fA:
17.40
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.
4tvm CITRATE SYNTHASE

(Mycobacterium
tuberculosis)
PF00285
(Citrate_synt)
5 ALA A 221
LEU A 376
LEU A 201
VAL A 197
PHE A 226
None
1.18A 3freX-4tvmA:
undetectable
3freX-4tvmA:
16.96
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.
5dst PROTEIN ARGININE
N-METHYLTRANSFERASE
8


(Homo sapiens)
PF06325
(PrmA)
5 ALA A 203
LEU A 116
LEU A 174
VAL A 172
SER A 126
None
1.27A 3freX-5dstA:
undetectable
3freX-5dstA:
21.13
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.
5ezr CGMP-DEPENDENT
PROTEIN KINASE,
PUTATIVE


(Plasmodium
vivax)
PF00027
(cNMP_binding)
PF00069
(Pkinase)
5 ALA A 622
LEU A 665
SER A 640
ILE A 641
PHE A 722
None
1.26A 3freX-5ezrA:
undetectable
3freX-5ezrA:
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.
5ful PROTEIN ARGININE
N-METHYLTRANSFERASE
2


(Mus musculus)
PF05175
(MTS)
5 ALA A 241
LEU A 154
LEU A 213
VAL A 211
SER A 164
None
1.22A 3freX-5fulA:
undetectable
3freX-5fulA:
14.86
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.
5gle ISCHORISMATE LYASE

(Vibrio
anguillarum)
no annotation 5 ALA A 176
LEU A  43
LEU A  57
VAL A  60
ILE A 105
None
0.85A 3freX-5gleA:
undetectable
3freX-5gleA:
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.
5gzh ENDO-BETA-1,2-GLUCAN
ASE


(Chitinophaga
pinensis)
PF10091
(Glycoamylase)
5 LEU A 282
LEU A 430
VAL A 426
ILE A 214
PHE A 420
None
1.18A 3freX-5gzhA:
undetectable
3freX-5gzhA:
16.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5iaa UBIQUITIN-LIKE
MODIFIER-ACTIVATING
ENZYME 5


(Homo sapiens)
PF00899
(ThiF)
5 LEU A 135
LEU A 102
VAL A  81
PHE A 118
THR A  88
None
1.11A 3freX-5iaaA:
undetectable
3freX-5iaaA:
20.34
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.
5loq PUTATIVE
HEME-DEPENDENT
PEROXIDASE LMO2113


(Listeria
monocytogenes)
PF06778
(Chlor_dismutase)
5 LEU A 245
LEU A  70
ILE A  94
PHE A  89
THR A  59
None
1.16A 3freX-5loqA:
undetectable
3freX-5loqA:
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.
5lts RNA-DIRECTED RNA
POLYMERASE L


(Lymphocytic
choriomeningitis
mammarenavirus)
PF17296
(ArenaCapSnatch)
5 LEU A  82
LEU A 129
VAL A 134
SER A  67
ILE A  71
None
1.14A 3freX-5ltsA:
undetectable
3freX-5ltsA:
19.81
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.
5mpd 26S PROTEASOME
REGULATORY SUBUNIT
RPN10


(Saccharomyces
cerevisiae)
PF13519
(VWA_2)
5 ALA W  94
LEU W  91
LEU W 132
VAL W 137
ILE W 158
None
1.25A 3freX-5mpdW:
undetectable
3freX-5mpdW:
19.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5olp PECTATE LYASE

(Bacteroides
thetaiotaomicron)
no annotation 5 ALA A  67
VAL A  91
SER A 147
ILE A 146
PHE A  93
None
1.13A 3freX-5olpA:
undetectable
3freX-5olpA:
16.90
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.
5t0l BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE


(Toxoplasma
gondii)
PF00186
(DHFR_1)
PF00303
(Thymidylat_synt)
5 ALA A  10
LEU A  23
ASP A  31
SER A  86
THR A 172
73X  A 704 (-4.0A)
None
73X  A 704 (-2.8A)
NDP  A 702 (-3.8A)
73X  A 704 (-4.2A)
0.81A 3freX-5t0lA:
20.7
3freX-5t0lA:
15.96
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.
5t13 CYANURIC ACID
AMIDOHYDROLASE


(Enterobacter
cloacae)
PF09663
(Amido_AtzD_TrzD)
5 ALA A  57
VAL A  36
ILE A  23
PHE A  62
THR A  54
None
1.15A 3freX-5t13A:
undetectable
3freX-5t13A:
15.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5t81 EPOB

(Sorangium
cellulosum)
PF00668
(Condensation)
5 LEU A 430
LEU A 198
VAL A 184
ILE A 213
PHE A 115
None
0.96A 3freX-5t81A:
undetectable
3freX-5t81A:
13.84
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.
5veo ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 5


(Mus musculus)
PF01663
(Phosphodiest)
5 ALA A  92
ASP A 265
VAL A 269
ILE A 301
PHE A  68
None
0.92A 3freX-5veoA:
undetectable
3freX-5veoA:
17.89
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.
5y2v RUBISCO OPERON
TRANSCRIPTIONAL
REGULATOR


(Synechocystis
sp. PCC 6803)
no annotation 5 ALA A 204
VAL A 240
ILE A 184
PHE A 209
THR A 201
None
None
None
None
PO4  A 401 (-4.0A)
1.20A 3freX-5y2vA:
undetectable
3freX-5y2vA:
19.62
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.
6e4e -

(-)
no annotation 8 ALA A   7
LEU A  20
ASP A  27
LEU A  28
VAL A  31
ILE A  50
PHE A  92
THR A 111
MMV  A 202 ( 3.5A)
MMV  A 202 (-4.3A)
MMV  A 202 (-2.9A)
MMV  A 202 (-4.2A)
MMV  A 202 (-4.9A)
MMV  A 202 ( 4.9A)
MMV  A 202 ( 3.5A)
MMV  A 202 (-4.3A)
0.44A 3freX-6e4eA:
30.9
3freX-6e4eA:
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.
6e4e -

(-)
no annotation 8 ALA A   7
LEU A  20
ASP A  27
VAL A  31
SER A  49
ILE A  50
PHE A  92
THR A 111
MMV  A 202 ( 3.5A)
MMV  A 202 (-4.3A)
MMV  A 202 (-2.9A)
MMV  A 202 (-4.9A)
NAP  A 201 (-4.2A)
MMV  A 202 ( 4.9A)
MMV  A 202 ( 3.5A)
MMV  A 202 (-4.3A)
0.52A 3freX-6e4eA:
30.9
3freX-6e4eA:
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.
6f0k ACTF
POLYSULPHIDE
REDUCTASE NRFD


(Rhodothermus
marinus)
no annotation 5 ALA C 273
SER F 288
ILE F 285
PHE F 281
THR C 315
None
1.22A 3freX-6f0kC:
undetectable
3freX-6f0kC:
18.42