SIMILAR PATTERNS OF AMINO ACIDS FOR 1SH9_B_RITB301_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.
1ag9 FLAVODOXIN

(Escherichia
coli)
PF00258
(Flavodoxin_1)
5 ALA A  84
ILE A  22
ILE A   6
GLY A  53
ILE A  54
None
1.25A 1sh9A-1ag9A:
0.0
1sh9A-1ag9A:
24.16
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.
1ak2 ADENYLATE KINASE
ISOENZYME-2


(Bos taurus)
PF00406
(ADK)
PF05191
(ADK_lid)
5 ASP A 179
ILE A 140
ILE A 137
ILE A 186
PRO A  25
None
None
None
None
SO4  A 301 ( 4.8A)
1.20A 1sh9A-1ak2A:
0.0
1sh9A-1ak2A:
17.94
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.
1bhy P64K

(Neisseria
meningitidis)
PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2)
5 ALA A 555
ILE A 565
ILE A 579
GLY A 538
ILE A 527
None
1.28A 1sh9A-1bhyA:
0.0
1sh9A-1bhyA:
13.36
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.
1bhy P64K

(Neisseria
meningitidis)
PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2)
5 ALA A 582
ILE A 565
ILE A 535
GLY A 538
ILE A 549
None
1.38A 1sh9A-1bhyA:
0.0
1sh9A-1bhyA:
13.36
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.
1bkh MUCONATE LACTONIZING
ENZYME


(Pseudomonas
putida)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
5 ALA A  11
ILE A   9
ILE A 108
GLY A  49
ILE A 307
None
1.31A 1sh9A-1bkhA:
0.0
1sh9A-1bkhA:
16.06
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.
1bkh MUCONATE LACTONIZING
ENZYME


(Pseudomonas
putida)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
4 ALA A  51
ILE A  71
ILE A 108
ILE A  48
None
0.65A 1sh9A-1bkhA:
0.0
1sh9A-1bkhA:
16.06
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.
1bxz NADP-DEPENDENT
ALCOHOL
DEHYDROGENASE


(Thermoanaerobacter
brockii)
PF00107
(ADH_zinc_N)
PF08240
(ADH_N)
4 ALA A 206
ASP A 205
ILE A 175
ILE A 215
None
0.69A 1sh9A-1bxzA:
undetectable
1sh9A-1bxzA:
17.74
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.
1cij PROTEIN (HALOALKANE
DEHALOGENASE)


(Xanthobacter
autotrophicus)
PF00561
(Abhydrolase_1)
5 ALA A 149
ASP A 124
ILE A 146
GLY A 257
PRO A 281
None
BR  A 401 ( 4.8A)
None
None
None
1.44A 1sh9A-1cijA:
undetectable
1sh9A-1cijA:
15.52
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.
1e0k DNA HELICASE

(Escherichia
virus T7)
PF03796
(DnaB_C)
5 ASP A 526
ASP A 297
ILE A 518
ILE A 295
GLY A 301
None
1.38A 1sh9A-1e0kA:
undetectable
1sh9A-1e0kA:
15.79
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.
1e9y UREASE SUBUNIT BETA

(Helicobacter
pylori)
PF00449
(Urease_alpha)
PF01979
(Amidohydro_1)
4 ALA B 346
ILE B 287
ILE B 536
PRO B 284
None
0.70A 1sh9A-1e9yB:
0.0
1sh9A-1e9yB:
10.54
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.
1eep INOSINE
5'-MONOPHOSPHATE
DEHYDROGENASE


(Borreliella
burgdorferi)
PF00478
(IMPDH)
5 ASP A 172
ILE A 198
ILE A 260
GLY A 222
ILE A 223
None
1.10A 1sh9A-1eepA:
undetectable
1sh9A-1eepA:
15.93
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.
1foh PHENOL HYDROXYLASE

(Cutaneotrichosporon
cutaneum)
PF01494
(FAD_binding_3)
PF07976
(Phe_hydrox_dim)
5 ALA A 358
ASP A 357
GLY A  14
ILE A  12
PRO A 144
None
FAD  A 801 (-2.9A)
FAD  A 801 (-3.1A)
None
FAD  A 801 (-4.3A)
1.38A 1sh9A-1fohA:
undetectable
1sh9A-1fohA:
9.13
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.
1geu GLUTATHIONE
REDUCTASE


(Escherichia
coli)
PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2)
4 ILE A 261
GLY A 154
ILE A 155
PRO A 143
NAD  A 452 (-3.9A)
None
None
None
0.62A 1sh9A-1geuA:
undetectable
1sh9A-1geuA:
12.11
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.
1gkp HYDANTOINASE

(Thermus sp.)
PF01979
(Amidohydro_1)
5 ALA A  13
ASP A  14
ILE A 384
GLY A 382
ILE A  56
None
1.30A 1sh9A-1gkpA:
undetectable
1sh9A-1gkpA:
11.57
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.
1gpr GLUCOSE PERMEASE

(Bacillus
subtilis)
PF00358
(PTS_EIIA_1)
5 ASP A  28
ILE A  23
ILE A 144
GLY A  42
PRO A  18
None
1.40A 1sh9A-1gprA:
undetectable
1sh9A-1gprA:
22.01
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1hvc HIV-1 PROTEASE

(Human
immunodeficiency
virus 1)
PF00077
(RVP)
5 ASP A  25
ALA A  28
ASP A  29
GLY A  48
PRO A  81
A79  A 800 (-2.8A)
A79  A 800 (-3.2A)
A79  A 800 (-2.7A)
A79  A 800 (-4.1A)
A79  A 800 ( 3.4A)
1.08A 1sh9A-1hvcA:
13.3
1sh9A-1hvcA:
89.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1hvc HIV-1 PROTEASE

(Human
immunodeficiency
virus 1)
PF00077
(RVP)
6 ASP A  25
ALA A  28
ASP A  29
ILE A  47
GLY A  49
ILE A  50
A79  A 800 (-2.7A)
A79  A 800 (-3.1A)
A79  A 800 (-2.8A)
A79  A 800 ( 3.2A)
A79  A 800 ( 3.7A)
A79  A 800 (-3.8A)
0.40A 1sh9A-1hvcA:
13.3
1sh9A-1hvcA:
89.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1hvc HIV-1 PROTEASE

(Human
immunodeficiency
virus 1)
PF00077
(RVP)
7 ASP A  25
ALA A  28
ASP A  29
ILE A  47
GLY A  49
ILE A  50
PRO A  81
A79  A 800 (-2.8A)
A79  A 800 (-3.2A)
A79  A 800 (-2.7A)
A79  A 800 ( 3.4A)
A79  A 800 (-3.4A)
A79  A 800 ( 4.0A)
A79  A 800 ( 3.4A)
0.49A 1sh9A-1hvcA:
13.3
1sh9A-1hvcA:
89.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1hvc HIV-1 PROTEASE

(Human
immunodeficiency
virus 1)
PF00077
(RVP)
6 ASP A  25
ALA A  28
ASP A  29
ILE A  47
GLY A  49
PRO A  81
A79  A 800 (-2.7A)
A79  A 800 (-3.1A)
A79  A 800 (-2.8A)
A79  A 800 ( 3.2A)
A79  A 800 ( 3.7A)
A79  A 800 ( 3.9A)
0.40A 1sh9A-1hvcA:
13.3
1sh9A-1hvcA:
89.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1hvc HIV-1 PROTEASE

(Human
immunodeficiency
virus 1)
PF00077
(RVP)
4 ASP A  29
ILE A  84
GLY A  49
ILE A  50
A79  A 800 (-2.8A)
A79  A 800 (-3.6A)
A79  A 800 ( 3.7A)
A79  A 800 (-3.8A)
0.68A 1sh9A-1hvcA:
13.3
1sh9A-1hvcA:
89.90
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.
1i7n SYNAPSIN II

(Rattus
norvegicus)
PF02078
(Synapsin)
PF02750
(Synapsin_C)
5 ALA A 375
ASP A 383
ILE A 248
ILE A 309
GLY A 334
None
1.24A 1sh9A-1i7nA:
undetectable
1sh9A-1i7nA:
14.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1i8d RIBOFLAVIN SYNTHASE

(Escherichia
coli)
PF00677
(Lum_binding)
5 ALA A  88
ASP A  92
ILE A  94
GLY A   4
PRO A 186
None
1.14A 1sh9A-1i8dA:
undetectable
1sh9A-1i8dA:
20.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1iwa RIBULOSE-1,5-BISPHOS
PHATE
CARBOXYLASE/OXYGENAS
E LARGE SUBUNIT


(Galdieria
partita)
PF00016
(RuBisCO_large)
PF02788
(RuBisCO_large_N)
5 ALA A 417
ILE A 413
ILE A 407
GLY A 405
PRO A 410
None
1.49A 1sh9A-1iwaA:
undetectable
1sh9A-1iwaA:
12.37
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.
1j2q PROTEASOME BETA
SUBUNIT


(Archaeoglobus
fulgidus)
PF00227
(Proteasome)
5 ALA H  80
ILE H  59
ILE H  37
GLY H 102
ILE H 110
None
1.43A 1sh9A-1j2qH:
undetectable
1sh9A-1j2qH:
17.33
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.
1j31 HYPOTHETICAL PROTEIN
PH0642


(Pyrococcus
horikoshii)
PF00795
(CN_hydrolase)
5 ALA A 223
ILE A 230
GLY A   5
ILE A 193
PRO A  41
None
1.44A 1sh9A-1j31A:
undetectable
1sh9A-1j31A:
17.13
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.
1j31 HYPOTHETICAL PROTEIN
PH0642


(Pyrococcus
horikoshii)
PF00795
(CN_hydrolase)
5 ILE A 193
ILE A 212
GLY A 231
ILE A 230
PRO A  41
None
1.31A 1sh9A-1j31A:
undetectable
1sh9A-1j31A:
17.13
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.
1jcf ROD
SHAPE-DETERMINING
PROTEIN MREB


(Thermotoga
maritima)
PF06723
(MreB_Mbl)
4 ASP A  72
ILE A  32
ILE A  41
GLY A  39
None
0.66A 1sh9A-1jcfA:
undetectable
1sh9A-1jcfA:
15.22
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.
1jfd INORGANIC
PYROPHOSPHATASE


(Escherichia
coli)
PF00719
(Pyrophosphatase)
5 ALA A 107
ILE A  15
ILE A  58
GLY A  56
ILE A  19
None
1.16A 1sh9A-1jfdA:
undetectable
1sh9A-1jfdA:
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.
1jfl ASPARTATE RACEMASE

(Pyrococcus
horikoshii)
PF01177
(Asp_Glu_race)
5 ALA A  75
ASP A  76
ILE A  78
ILE A  22
PRO A  81
None
1.25A 1sh9A-1jflA:
undetectable
1sh9A-1jflA:
19.82
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.
1jmc PROTEIN (REPLICATION
PROTEIN A (RPA))


(Homo sapiens)
PF01336
(tRNA_anti-codon)
PF16900
(REPA_OB_2)
5 ALA A 358
ILE A 378
ILE A 319
GLY A 321
ILE A 322
None
1.37A 1sh9A-1jmcA:
undetectable
1sh9A-1jmcA:
17.72
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.
1kb0 QUINOHEMOPROTEIN
ALCOHOL
DEHYDROGENASE


(Comamonas
testosteroni)
PF13360
(PQQ_2)
PF13442
(Cytochrome_CBB3)
5 ALA A  37
ILE A 316
GLY A  33
ILE A  32
PRO A 314
None
1.26A 1sh9A-1kb0A:
undetectable
1sh9A-1kb0A:
10.05
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.
1kyh HYPOTHETICAL 29.9
KDA PROTEIN IN
SIGY-CYDD INTERGENIC
REGION


(Bacillus
subtilis)
PF01256
(Carb_kinase)
5 ALA A  87
ILE A 101
ILE A  99
ILE A  60
PRO A 103
None
1.40A 1sh9A-1kyhA:
undetectable
1sh9A-1kyhA:
16.06
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.
1kyi ATP-DEPENDENT HSL
PROTEASE ATP-BINDING
SUBUNIT HSLU


(Haemophilus
influenzae)
PF00004
(AAA)
PF07724
(AAA_2)
PF10431
(ClpB_D2-small)
5 ASP A 428
ALA A 429
ASP A 405
ILE A 421
ILE A 407
None
1.35A 1sh9A-1kyiA:
undetectable
1sh9A-1kyiA:
13.47
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.
1l2q MONOMETHYLAMINE
METHYLTRANSFERASE


(Methanosarcina
barkeri)
PF05369
(MtmB)
5 ALA A 268
ILE A 263
ILE A 301
ILE A 271
PRO A 298
None
1.27A 1sh9A-1l2qA:
undetectable
1sh9A-1l2qA:
11.14
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.
1lnq POTASSIUM CHANNEL
RELATED PROTEIN


(Methanothermobacter
thermautotrophicus)
PF02080
(TrkA_C)
PF02254
(TrkA_N)
PF07885
(Ion_trans_2)
5 ALA A 178
ILE A 198
ILE A 207
ILE A 120
PRO A 164
None
1.12A 1sh9A-1lnqA:
undetectable
1sh9A-1lnqA:
14.91
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.
1m53 ISOMALTULOSE
SYNTHASE


(Klebsiella sp.
LX3)
PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C)
5 ASP A 122
ILE A  92
ILE A  75
GLY A  70
ILE A  69
None
1.18A 1sh9A-1m53A:
undetectable
1sh9A-1m53A:
11.30
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.
1nf5 ALPHA-LACTALBUMIN

(Mus musculus)
PF00062
(Lys)
5 ASP A  78
ASP A  57
ILE A  75
ILE A  55
GLY A  51
None
1.20A 1sh9A-1nf5A:
undetectable
1sh9A-1nf5A:
18.25
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.
1o1y CONSERVED
HYPOTHETICAL PROTEIN
TM1158


(Thermotoga
maritima)
PF00117
(GATase)
5 ALA A 167
ILE A  77
ILE A  74
GLY A  90
ILE A  87
None
None
None
OCS  A  88 ( 3.9A)
OCS  A  88 ( 4.0A)
1.23A 1sh9A-1o1yA:
undetectable
1sh9A-1o1yA:
18.48
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.
1orq POTASSIUM CHANNEL

(Aeropyrum
pernix)
PF00520
(Ion_trans)
5 ILE C 180
ILE C 168
GLY C 209
ILE C 208
PRO C 174
None
1.36A 1sh9A-1orqC:
undetectable
1sh9A-1orqC:
21.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ouv CONSERVED
HYPOTHETICAL
SECRETED PROTEIN


(Helicobacter
pylori)
PF08238
(Sel1)
5 ALA A 163
ASP A 168
ILE A 174
GLY A 141
ILE A 142
None
1.20A 1sh9A-1ouvA:
undetectable
1sh9A-1ouvA:
13.93
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.
1pox PYRUVATE OXIDASE

(Lactobacillus
plantarum)
PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N)
5 ALA A  67
ASP A  96
ILE A 414
GLY A 428
ILE A 430
None
1.26A 1sh9A-1poxA:
undetectable
1sh9A-1poxA:
12.35
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.
1q5a EP-CADHERIN

(Mus musculus)
PF00028
(Cadherin)
4 ASP A  44
ALA A  43
ILE A  38
ILE A  94
None
0.00A 1sh9A-1q5aA:
undetectable
1sh9A-1q5aA:
8.30
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.
1q5a EP-CADHERIN

(Mus musculus)
PF00028
(Cadherin)
4 ILE A 261
ILE A 300
GLY A 280
ILE A 281
None
0.08A 1sh9A-1q5aA:
undetectable
1sh9A-1q5aA:
8.30
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1q9p HIV-1 PROTEASE

(Homo sapiens)
PF00077
(RVP)
4 ASP A  25
ALA A  28
ASP A  29
PRO A  81
None
0.64A 1sh9A-1q9pA:
10.4
1sh9A-1q9pA:
86.32
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.
1qqj FUMARYLACETOACETATE
HYDROLASE


(Mus musculus)
PF01557
(FAA_hydrolase)
PF09298
(FAA_hydrolase_N)
5 ASP A 126
ILE A 259
ILE A 166
GLY A 256
ILE A 173
CA  A 420 (-3.1A)
None
None
None
None
1.27A 1sh9A-1qqjA:
undetectable
1sh9A-1qqjA:
15.09
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.
1qyc PHENYLCOUMARAN
BENZYLIC ETHER
REDUCTASE PT1


(Pinus taeda)
PF05368
(NmrA)
5 ALA A  21
ILE A  82
ILE A 200
GLY A 196
ILE A 195
None
1.36A 1sh9A-1qycA:
undetectable
1sh9A-1qycA:
14.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1rjb FL CYTOKINE RECEPTOR

(Homo sapiens)
PF07714
(Pkinase_Tyr)
6 ALA A 792
ILE A 918
ILE A 921
GLY A 875
ILE A 876
PRO A 911
None
1.11A 1sh9A-1rjbA:
undetectable
1sh9A-1rjbA:
14.24
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.
1sg3 ALLANTOICASE

(Saccharomyces
cerevisiae)
PF03561
(Allantoicase)
5 ALA A 199
ILE A 262
ILE A 259
GLY A 342
ILE A 195
None
1.26A 1sh9A-1sg3A:
undetectable
1sh9A-1sg3A:
14.77
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1siv SIV PROTEASE

(Simian
immunodeficiency
virus)
PF00077
(RVP)
7 ASP A  25
ALA A  28
ASP A  29
ILE A  32
GLY A  49
ILE A  50
PRO A  81
None
0.56A 1sh9A-1sivA:
19.0
1sh9A-1sivA:
49.49
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1siv SIV PROTEASE

(Simian
immunodeficiency
virus)
PF00077
(RVP)
5 ASP A  25
ALA A  28
ILE A  32
GLY A  48
PRO A  81
None
1.01A 1sh9A-1sivA:
19.0
1sh9A-1sivA:
49.49
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.
1sy7 CATALASE 1

(Neurospora
crassa)
PF00199
(Catalase)
PF01965
(DJ-1_PfpI)
PF06628
(Catalase-rel)
5 ALA A 619
ASP A 618
ILE A 578
ILE A 588
PRO A 623
None
1.21A 1sh9A-1sy7A:
undetectable
1sh9A-1sy7A:
9.63
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.
1to6 GLYCERATE KINASE

(Neisseria
meningitidis)
PF02595
(Gly_kinase)
4 ALA A 243
ILE A 259
GLY A 250
ILE A 143
SO4  A 373 ( 4.2A)
None
None
None
0.67A 1sh9A-1to6A:
undetectable
1sh9A-1to6A:
14.95
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.
1tqz NECAP1

(Mus musculus)
PF07933
(DUF1681)
5 ALA A  72
ILE A  96
ILE A  49
ILE A  55
PRO A  78
None
1.16A 1sh9A-1tqzA:
undetectable
1sh9A-1tqzA:
20.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1u1h 5-METHYLTETRAHYDROPT
EROYLTRIGLUTAMATE--H
OMOCYSTEINE
METHYLTRANSFERASE


(Arabidopsis
thaliana)
PF01717
(Meth_synt_2)
PF08267
(Meth_synt_1)
5 ALA A 665
ASP A 664
ILE A 660
GLY A 690
ILE A 726
None
1.04A 1sh9A-1u1hA:
undetectable
1sh9A-1u1hA:
9.24
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.
1u7g PROBABLE AMMONIUM
TRANSPORTER


(Escherichia
coli)
PF00909
(Ammonium_transp)
5 ILE A  28
ILE A 110
GLY A 211
ILE A 210
PRO A  26
None
NH3  A 402 ( 4.8A)
None
None
None
1.18A 1sh9A-1u7gA:
undetectable
1sh9A-1u7gA:
14.44
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.
1usv AHA1

(Saccharomyces
cerevisiae)
PF09229
(Aha1_N)
4 ALA B  33
ILE B 127
ILE B  75
GLY B  77
None
0.51A 1sh9A-1usvB:
undetectable
1sh9A-1usvB:
16.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1v77 HYPOTHETICAL PROTEIN
PH1877


(Pyrococcus
horikoshii)
PF01876
(RNase_P_p30)
5 ASP A 180
ILE A 199
ILE A 182
GLY A 185
ILE A 188
None
1.17A 1sh9A-1v77A:
undetectable
1sh9A-1v77A:
17.45
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.
1vl8 GLUCONATE
5-DEHYDROGENASE


(Thermotoga
maritima)
PF13561
(adh_short_C2)
4 ALA A  94
ILE A  25
ILE A 188
ILE A 141
NAP  A 274 (-4.5A)
None
None
None
0.50A 1sh9A-1vl8A:
undetectable
1sh9A-1vl8A:
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.
1vmd METHYLGLYOXAL
SYNTHASE


(Thermotoga
maritima)
PF02142
(MGS)
4 ALA A  19
ILE A  82
ILE A 118
ILE A 122
None
0.69A 1sh9A-1vmdA:
undetectable
1sh9A-1vmdA:
20.22
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.
1x1o NICOTINATE-NUCLEOTID
E PYROPHOSPHORYLASE


(Thermus
thermophilus)
PF01729
(QRPTase_C)
PF02749
(QRPTase_N)
4 ALA A 107
ILE A  47
GLY A  57
PRO A  76
None
0.59A 1sh9A-1x1oA:
undetectable
1sh9A-1x1oA:
15.81
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.
1x7f OUTER SURFACE
PROTEIN


(Bacillus cereus)
PF05913
(DUF871)
5 ALA A  27
ILE A  23
ILE A  34
GLY A   6
ILE A 225
None
1.44A 1sh9A-1x7fA:
undetectable
1sh9A-1x7fA:
12.07
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.
1xje RIBONUCLEOTIDE
REDUCTASE,
B12-DEPENDENT


(Thermotoga
maritima)
PF00317
(Ribonuc_red_lgN)
PF02867
(Ribonuc_red_lgC)
5 ASP A 339
ALA A 498
ASP A 499
ILE A  88
GLY A 492
None
None
None
None
GDP  A1002 (-3.8A)
1.48A 1sh9A-1xjeA:
undetectable
1sh9A-1xjeA:
10.00
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.
1xmb IAA-AMINO ACID
HYDROLASE HOMOLOG 2


(Arabidopsis
thaliana)
PF01546
(Peptidase_M20)
PF07687
(M20_dimer)
5 ALA A 115
ASP A 114
ILE A 118
GLY A 138
ILE A 403
None
1.40A 1sh9A-1xmbA:
undetectable
1sh9A-1xmbA:
13.38
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.
1xw8 UPF0271 PROTEIN YBGL

(Escherichia
coli)
PF03746
(LamB_YcsF)
5 ALA A 244
ASP A   4
ILE A 135
GLY A  55
ILE A  54
None
1.18A 1sh9A-1xw8A:
undetectable
1sh9A-1xw8A:
18.86
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.
1yw1 PROTEIN YTNJ

(Bacillus
subtilis)
PF00296
(Bac_luciferase)
5 ALA A 383
ILE A 374
ILE A   7
ILE A 387
PRO A 273
None
1.37A 1sh9A-1yw1A:
undetectable
1sh9A-1yw1A:
13.85
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.
1zos 5'-METHYLTHIOADENOSI
NE /
S-ADENOSYLHOMOCYSTEI
NE NUCLEOSIDASE


(Streptococcus
pneumoniae)
PF01048
(PNP_UDP_1)
5 ALA A  56
ILE A 178
ILE A   6
GLY A  49
ILE A  50
None
None
None
None
MTM  A 301 (-4.0A)
1.20A 1sh9A-1zosA:
undetectable
1sh9A-1zosA:
17.98
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.
2b1n SPE31

(Pachyrhizus
erosus)
PF00112
(Peptidase_C1)
5 ASP A 156
ASP A 146
ILE A 202
ILE A 200
GLY A 152
None
NAG  A 600 (-3.5A)
None
None
None
1.18A 1sh9A-2b1nA:
undetectable
1sh9A-2b1nA:
17.67
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.
2cfm THERMOSTABLE DNA
LIGASE


(Pyrococcus
furiosus)
PF01068
(DNA_ligase_A_M)
PF04675
(DNA_ligase_A_N)
PF04679
(DNA_ligase_A_C)
5 ASP A 429
ILE A 503
ILE A 432
GLY A 452
PRO A 525
None
1.41A 1sh9A-2cfmA:
undetectable
1sh9A-2cfmA:
11.45
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.
2czr TBP-INTERACTING
PROTEIN


(Thermococcus
kodakarensis)
PF15517
(TBPIP_N)
5 ASP A  45
ILE A  26
ILE A  31
GLY A  33
ILE A  34
None
1.26A 1sh9A-2czrA:
undetectable
1sh9A-2czrA:
20.41
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.
2db3 ATP-DEPENDENT RNA
HELICASE VASA


(Drosophila
melanogaster)
PF00270
(DEAD)
PF00271
(Helicase_C)
5 ALA A 374
ILE A 388
ILE A 365
GLY A 350
ILE A 349
None
1.26A 1sh9A-2db3A:
undetectable
1sh9A-2db3A:
15.62
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.
2e5v L-ASPARTATE OXIDASE

(Sulfurisphaera
tokodaii)
PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C)
5 ALA A 204
ASP A 340
ILE A 202
GLY A 380
ILE A 381
None
1.14A 1sh9A-2e5vA:
undetectable
1sh9A-2e5vA:
11.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2eb0 MANGANESE-DEPENDENT
INORGANIC
PYROPHOSPHATASE


(Methanocaldococcus
jannaschii)
PF01368
(DHH)
PF02833
(DHHA2)
4 ALA A  22
ILE A  63
GLY A 127
ILE A 122
None
0.70A 1sh9A-2eb0A:
undetectable
1sh9A-2eb0A:
15.77
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.
2ecf DIPEPTIDYL PEPTIDASE
IV


(Stenotrophomonas
maltophilia)
PF00326
(Peptidase_S9)
PF00930
(DPPIV_N)
5 ALA A 204
ASP A 205
ILE A 228
ILE A 199
GLY A 213
None
1.16A 1sh9A-2ecfA:
undetectable
1sh9A-2ecfA:
8.50
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.
2f1n CYTOLETHAL
DISTENDING TOXIN
SUBUNIT B


(Escherichia
coli)
PF03372
(Exo_endo_phos)
4 ASP A 107
ASP A 130
ILE A 125
ILE A  39
None
0.70A 1sh9A-2f1nA:
undetectable
1sh9A-2f1nA:
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.
2fj0 CARBOXYLIC ESTER
HYDROLASE


(Manduca sexta)
PF00135
(COesterase)
5 ASP A 474
ILE A 508
ILE A 249
GLY A 224
ILE A 143
None
1.42A 1sh9A-2fj0A:
0.3
1sh9A-2fj0A:
10.91
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.
2fli RIBULOSE-PHOSPHATE
3-EPIMERASE


(Streptococcus
pyogenes)
PF00834
(Ribul_P_3_epim)
5 ALA A   7
ASP A  65
ILE A  25
ILE A  10
GLY A 198
None
None
None
None
DX5  A1901 (-3.4A)
1.26A 1sh9A-2fliA:
undetectable
1sh9A-2fliA:
20.36
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.
2fmb EQUINE INFECTIOUS
ANEMIA VIRUS
PROTEASE


(Equine
infectious
anemia virus)
PF00077
(RVP)
6 ASP A  25
ALA A  28
ASP A  29
ILE A  53
GLY A  55
PRO A  86
LP1  A 201 (-2.3A)
LP1  A 201 (-3.5A)
LP1  A 201 (-3.6A)
LP1  A 201 (-4.6A)
LP1  A 201 (-3.4A)
LP1  A 201 (-3.9A)
0.42A 1sh9A-2fmbA:
15.3
1sh9A-2fmbA:
27.88
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.
2gbz OLIGORIBONUCLEASE

(Xanthomonas
campestris)
PF00929
(RNase_T)
5 ASP A 169
ILE A  34
ILE A 171
GLY A 109
ILE A 112
None
1.16A 1sh9A-2gbzA:
undetectable
1sh9A-2gbzA:
18.35
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.
2ggs 273AA LONG
HYPOTHETICAL
DTDP-4-DEHYDRORHAMNO
SE REDUCTASE


(Sulfurisphaera
tokodaii)
PF04321
(RmlD_sub_bind)
4 ALA A  64
ILE A 193
ILE A 149
ILE A 102
NDP  A 900 (-4.3A)
None
None
None
0.67A 1sh9A-2ggsA:
undetectable
1sh9A-2ggsA:
15.24
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.
2gpr GLUCOSE-PERMEASE IIA
COMPONENT


(Mycoplasma
capricolum)
PF00358
(PTS_EIIA_1)
5 ASP A  20
ASP A 153
ILE A  45
ILE A  23
GLY A 147
None
1.42A 1sh9A-2gprA:
undetectable
1sh9A-2gprA:
20.28
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.
2i5i UPF0249 PROTEIN
EF_3048


(Enterococcus
faecalis)
PF04794
(YdjC)
4 ILE A 113
ILE A 126
GLY A  61
ILE A  60
None
0.72A 1sh9A-2i5iA:
undetectable
1sh9A-2i5iA:
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.
2idv EUKARYOTIC
TRANSLATION
INITIATION FACTOR
4E-1


(Triticum
aestivum)
PF01652
(IF4E)
5 ALA A 165
ILE A 121
ILE A 194
GLY A 181
ILE A 180
None
1.50A 1sh9A-2idvA:
undetectable
1sh9A-2idvA:
24.54
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.
2ipx RRNA
2'-O-METHYLTRANSFERA
SE FIBRILLARIN


(Homo sapiens)
PF01269
(Fibrillarin)
5 ASP A 232
ALA A 162
ILE A 158
ILE A 181
GLY A 183
None
1.48A 1sh9A-2ipxA:
undetectable
1sh9A-2ipxA:
15.88
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.
2isq CYSTEINE SYNTHASE

(Arabidopsis
thaliana)
PF00291
(PALP)
4 ALA A 189
GLY A 183
ILE A 180
PRO A 296
None
PLP  A 400 (-3.4A)
PLP  A 400 (-4.9A)
PLP  A 400 (-4.0A)
0.59A 1sh9A-2isqA:
undetectable
1sh9A-2isqA:
15.94
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.
2ivp O-SIALOGLYCOPROTEIN
ENDOPEPTIDASE


(Pyrococcus
abyssi)
PF00814
(Peptidase_M22)
4 ASP A 281
ILE A 114
GLY A  16
ILE A  17
None
0.72A 1sh9A-2ivpA:
undetectable
1sh9A-2ivpA:
16.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jg5 FRUCTOSE 1-PHOSPHATE
KINASE


(Staphylococcus
aureus)
PF00294
(PfkB)
5 ALA A 253
ILE A   2
ILE A 130
GLY A  39
ILE A  40
None
1.24A 1sh9A-2jg5A:
undetectable
1sh9A-2jg5A:
16.11
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.
2nvv ACETYL-COA
HYDROLASE/TRANSFERAS
E FAMILY PROTEIN


(Porphyromonas
gingivalis)
PF02550
(AcetylCoA_hydro)
PF13336
(AcetylCoA_hyd_C)
5 ALA A 429
ASP A 430
ILE A 423
ILE A 390
ILE A 362
ALA  A 429 ( 0.0A)
ASP  A 430 ( 0.5A)
ILE  A 423 ( 0.7A)
ILE  A 390 ( 0.7A)
ILE  A 362 ( 0.4A)
1.18A 1sh9A-2nvvA:
undetectable
1sh9A-2nvvA:
9.88
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.
2nx8 TRNA-SPECIFIC
ADENOSINE DEAMINASE


(Streptococcus
pyogenes)
PF14437
(MafB19-deam)
5 ALA A 146
ASP A 148
ILE A  92
ILE A 111
PRO A  94
None
1.43A 1sh9A-2nx8A:
undetectable
1sh9A-2nx8A:
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.
2o0x 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE


(Mycobacterium
tuberculosis)
PF00275
(EPSP_synthase)
5 ALA A 380
ASP A 383
ILE A 405
GLY A 390
ILE A 393
None
1.41A 1sh9A-2o0xA:
undetectable
1sh9A-2o0xA:
12.65
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.
2o0x 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE


(Mycobacterium
tuberculosis)
PF00275
(EPSP_synthase)
5 ASP A 403
ALA A 380
ILE A 405
GLY A 390
PRO A   5
None
1.38A 1sh9A-2o0xA:
undetectable
1sh9A-2o0xA:
12.65
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.
2ogv MACROPHAGE
COLONY-STIMULATING
FACTOR 1 RECEPTOR
PRECURSOR


(Homo sapiens)
PF07714
(Pkinase_Tyr)
5 ILE A 885
ILE A 888
GLY A 842
ILE A 843
PRO A 878
None
1.07A 1sh9A-2ogvA:
undetectable
1sh9A-2ogvA:
15.16
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.
2oz8 MLL7089 PROTEIN

(Mesorhizobium
japonicum)
PF13378
(MR_MLE_C)
4 ASP A 217
ILE A 193
ILE A 211
PRO A 224
None
0.68A 1sh9A-2oz8A:
undetectable
1sh9A-2oz8A:
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.
2pcr INOSITOL-1-MONOPHOSP
HATASE


(Aquifex
aeolicus)
PF00459
(Inositol_P)
5 ASP A  89
ALA A 190
ASP A 193
ILE A 215
ILE A 241
None
1.22A 1sh9A-2pcrA:
undetectable
1sh9A-2pcrA:
18.35
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.
2pgg RNA-DIRECTED RNA
POLYMERASE


(Infectious
bursal disease
virus)
PF04197
(Birna_RdRp)
5 ASP A  76
ILE A  78
GLY A 272
ILE A 271
PRO A 229
None
1.04A 1sh9A-2pggA:
undetectable
1sh9A-2pggA:
8.82
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.
2phc UNCHARACTERIZED
PROTEIN PH0987


(Pyrococcus
horikoshii)
PF02682
(CT_C_D)
5 ILE B  88
ILE B 185
GLY B 183
ILE B 182
PRO B 210
None
1.46A 1sh9A-2phcB:
undetectable
1sh9A-2phcB:
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.
2pt6 SPERMIDINE SYNTHASE

(Plasmodium
falciparum)
PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N)
4 ASP A 196
ILE A 145
ILE A 153
ILE A 163
S4M  A 501 (-2.6A)
None
None
None
0.64A 1sh9A-2pt6A:
undetectable
1sh9A-2pt6A:
13.08
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.
2pyh POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE 4


(Azotobacter
vinelandii)
PF12708
(Pectate_lyase_3)
5 ASP A  13
ASP A  17
ILE A  22
GLY A   9
PRO A  40
None
1.50A 1sh9A-2pyhA:
undetectable
1sh9A-2pyhA:
15.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qqp LARGE CAPSID PROTEIN

(Providence
virus)
PF03566
(Peptidase_A21)
5 ASP A 245
ALA A 240
ILE A 498
ILE A 504
GLY A 437
None
1.18A 1sh9A-2qqpA:
undetectable
1sh9A-2qqpA:
11.81
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.
2qxl HEAT SHOCK PROTEIN
HOMOLOG SSE1


(Saccharomyces
cerevisiae)
PF00012
(HSP70)
5 ASP A 369
ILE A 372
ILE A 341
GLY A 205
PRO A 146
None
None
None
ATP  A1002 (-3.5A)
None
1.09A 1sh9A-2qxlA:
undetectable
1sh9A-2qxlA:
10.20
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.
2r48 PHOSPHOTRANSFERASE
SYSTEM (PTS)
MANNOSE-SPECIFIC
ENZYME IIBCA
COMPONENT


(Bacillus
subtilis)
PF02302
(PTS_IIB)
5 ALA A  26
ILE A  34
ILE A  60
GLY A  85
ILE A  86
None
1.25A 1sh9A-2r48A:
undetectable
1sh9A-2r48A:
23.15