SIMILAR PATTERNS OF AMINO ACIDS FOR 1SH9_B_RITB301

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
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1c30 CARBAMOYL PHOSPHATE
SYNTHETASE: LARGE
SUBUNIT


(Escherichia
coli)
PF02142
(MGS)
PF02786
(CPSase_L_D2)
PF02787
(CPSase_L_D3)
5 GLY A  14
ILE A  45
ILE A  77
ILE A  66
ALA A  61
None
0.92A 1sh9B-1c30A:
undetectable
1sh9B-1c30A:
7.45
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.
1d5c RAB6 GTPASE

(Plasmodium
falciparum)
PF00071
(Ras)
5 GLY A  18
ASP A 108
ILE A 109
ILE A  81
ALA A 120
None
1.03A 1sh9B-1d5cA:
undetectable
1sh9B-1d5cA:
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.
1d7b CELLOBIOSE
DEHYDROGENASE


(Phanerochaete
chrysosporium)
PF16010
(CDH-cyt)
5 ASP A  68
GLY A  62
GLY A  58
PRO A  93
ALA A  87
None
None
HEM  A 401 (-3.5A)
HEM  A 401 (-4.5A)
None
0.99A 1sh9B-1d7bA:
undetectable
1sh9B-1d7bA:
18.44
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.
1gkr NON-ATP DEPENDENT
L-SELECTIVE
HYDANTOINASE


(Paenarthrobacter
aurescens)
PF01979
(Amidohydro_1)
5 GLY A  49
ASP A  21
ILE A  22
ILE A  17
PRO A  54
None
1.00A 1sh9B-1gkrA:
undetectable
1sh9B-1gkrA:
12.33
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 ARG A   8
ASP A  25
GLY A  27
ASP A  30
ILE A  47
PRO A  81
A79  A 800 (-3.4A)
A79  A 800 (-2.7A)
A79  A 800 (-3.0A)
A79  A 800 ( 4.9A)
A79  A 800 ( 3.2A)
A79  A 800 ( 3.9A)
1.39A 1sh9B-1hvcA:
13.3
1sh9B-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 ARG A   8
ASP A  25
GLY A  27
ASP A  30
ILE A  47
PRO A  81
A79  A 800 (-3.6A)
A79  A 800 (-2.8A)
A79  A 800 (-3.0A)
A79  A 800 ( 4.7A)
A79  A 800 ( 3.4A)
A79  A 800 ( 3.4A)
1.14A 1sh9B-1hvcA:
13.3
1sh9B-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
GLY A  27
ASP A  30
ILE A  47
GLY A  49
ILE A  50
PRO A  81
A79  A 800 (-2.7A)
A79  A 800 (-3.0A)
A79  A 800 ( 4.9A)
A79  A 800 ( 3.2A)
A79  A 800 ( 3.7A)
A79  A 800 (-3.8A)
A79  A 800 ( 3.9A)
0.60A 1sh9B-1hvcA:
13.3
1sh9B-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
GLY A  27
ASP A  30
ILE A  47
GLY A  49
ILE A  50
PRO A  81
A79  A 800 (-2.8A)
A79  A 800 (-3.0A)
A79  A 800 ( 4.7A)
A79  A 800 ( 3.4A)
A79  A 800 (-3.4A)
A79  A 800 ( 4.0A)
A79  A 800 ( 3.4A)
0.55A 1sh9B-1hvcA:
13.3
1sh9B-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.
1lxt PHOSPHOGLUCOMUTASE
(DEPHOSPHO FORM)


(Oryctolagus
cuniculus)
PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III)
5 GLY A  20
ILE A 142
ILE A 132
GLY A 110
ILE A 111
None
1.01A 1sh9B-1lxtA:
undetectable
1sh9B-1lxtA:
11.63
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.
1omx ALPHA-1,4-N-ACETYLHE
XOSAMINYLTRANSFERASE
EXTL2


(Mus musculus)
PF09258
(Glyco_transf_64)
5 ILE A 316
ILE A 314
GLY A 262
ILE A 175
ALA A 164
None
EDO  A 401 (-4.7A)
None
None
None
0.93A 1sh9B-1omxA:
undetectable
1sh9B-1omxA:
16.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pox PYRUVATE OXIDASE

(Lactobacillus
plantarum)
PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N)
5 ARG A 515
ILE A 397
ILE A 392
GLY A 425
ILE A 426
None
1.06A 1sh9B-1poxA:
undetectable
1sh9B-1poxA:
12.35
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
GLY A  27
ASP A  30
ILE A  32
GLY A  49
ILE A  50
PRO A  81
None
0.72A 1sh9B-1sivA:
18.9
1sh9B-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.
1vz8 ORNITHINE
ACETYL-TRANSFERASE


(Streptomyces
clavuligerus)
PF01960
(ArgJ)
5 ASP A 365
GLY A 272
ILE A 326
ILE A 310
PRO A 335
None
1.06A 1sh9B-1vz8A:
undetectable
1sh9B-1vz8A:
12.89
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.
1zcc GLYCEROPHOSPHODIESTE
R PHOSPHODIESTERASE


(Agrobacterium
fabrum)
PF03009
(GDPD)
5 ASP A 226
ILE A   4
ILE A 220
GLY A 202
ALA A  25
None
1.07A 1sh9B-1zccA:
undetectable
1sh9B-1zccA:
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.
1zkd DUF185

(Rhodopseudomonas
palustris)
PF02636
(Methyltransf_28)
5 GLY A 291
ILE A 227
ILE A 224
GLY A 284
ALA A 237
None
0.87A 1sh9B-1zkdA:
undetectable
1sh9B-1zkdA:
12.14
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.
2fmb EQUINE INFECTIOUS
ANEMIA VIRUS
PROTEASE


(Equine
infectious
anemia virus)
PF00077
(RVP)
5 ASP A  25
GLY A  27
ILE A  53
GLY A  55
PRO A  86
LP1  A 201 (-2.3A)
LP1  A 201 (-3.8A)
LP1  A 201 (-4.6A)
LP1  A 201 (-3.4A)
LP1  A 201 (-3.9A)
0.36A 1sh9B-2fmbA:
15.3
1sh9B-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.
2fyw CONSERVED
HYPOTHETICAL PROTEIN


(Streptococcus
pneumoniae)
PF01784
(NIF3)
5 GLY A  57
ILE A 250
ILE A 252
ILE A  61
ALA A   3
None
1.00A 1sh9B-2fywA:
undetectable
1sh9B-2fywA:
20.56
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.
2g3n ALPHA-GLUCOSIDASE

(Sulfolobus
solfataricus)
PF01055
(Glyco_hydro_31)
PF13802
(Gal_mutarotas_2)
5 GLY A 115
ILE A 102
GLY A  66
ILE A  65
PRO A 528
None
0.81A 1sh9B-2g3nA:
undetectable
1sh9B-2g3nA:
9.51
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.
2h6t CANDIDAPEPSIN-3

(Candida
albicans)
PF00026
(Asp)
5 GLY A 122
ASP A  32
ILE A  31
ILE A 126
ILE A  99
None
1.08A 1sh9B-2h6tA:
5.4
1sh9B-2h6tA:
16.39
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.
2hj0 PUTATIVE CITRATE
LYASE, ALFA SUBUNIT


(Streptococcus
mutans)
PF04223
(CitF)
5 ASP A 402
GLY A 149
ILE A 432
ILE A 497
PRO A 434
None
1.06A 1sh9B-2hj0A:
undetectable
1sh9B-2hj0A:
11.58
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.
2hoq PUTATIVE
HAD-HYDROLASE PH1655


(Pyrococcus
horikoshii)
PF13419
(HAD_2)
5 GLY A 174
ILE A   5
GLY A 114
ILE A 115
ALA A  99
None
1.02A 1sh9B-2hoqA:
undetectable
1sh9B-2hoqA:
18.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2rkf PROTEASE RETROPEPSIN

(Human
immunodeficiency
virus 1)
PF00077
(RVP)
7 ARG A   8
ASP A  25
GLY A  27
ASP A  30
ILE A  32
PRO A  81
ALA A  82
AB1  A 501 ( 4.7A)
AB1  A 501 (-2.4A)
AB1  A 501 (-3.9A)
AB1  A 501 (-3.8A)
AB1  A 501 (-4.5A)
AB1  A 501 (-4.2A)
AB1  A 501 (-3.6A)
1.25A 1sh9B-2rkfA:
20.7
1sh9B-2rkfA:
85.86
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2rkf PROTEASE RETROPEPSIN

(Human
immunodeficiency
virus 1)
PF00077
(RVP)
8 ASP A  25
GLY A  27
ASP A  30
ILE A  32
GLY A  49
ILE A  50
PRO A  81
ALA A  82
AB1  A 501 (-2.4A)
AB1  A 501 (-3.9A)
AB1  A 501 (-3.8A)
AB1  A 501 (-4.5A)
AB1  A 501 (-3.5A)
AB1  A 501 (-3.8A)
AB1  A 501 (-4.2A)
AB1  A 501 (-3.6A)
0.54A 1sh9B-2rkfA:
20.7
1sh9B-2rkfA:
85.86
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.
2vda TRANSLOCASE SUBUNIT
SECA


(Escherichia
coli)
PF01043
(SecA_PP_bind)
PF07516
(SecA_SW)
PF07517
(SecA_DEAD)
5 GLY A 573
ASP A 568
ILE A 567
GLY A 455
ALA A 507
None
1.05A 1sh9B-2vdaA:
undetectable
1sh9B-2vdaA:
7.82
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.
2vdc GLUTAMATE SYNTHASE
[NADPH] LARGE CHAIN


(Azospirillum
brasilense)
PF00310
(GATase_2)
PF01493
(GXGXG)
PF01645
(Glu_synthase)
PF04898
(Glu_syn_central)
5 GLY A 729
ASP A1180
GLY A 753
ILE A 754
ALA A 733
None
1.03A 1sh9B-2vdcA:
undetectable
1sh9B-2vdcA:
6.08
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.
2y89 PHOSPHORIBOSYL
ISOMERASE A


(Mycobacterium
tuberculosis)
PF00977
(His_biosynth)
5 ASP A 171
GLY A 176
ASP A 184
GLY A 136
ILE A 134
None
0.99A 1sh9B-2y89A:
undetectable
1sh9B-2y89A:
21.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zyz PUTATIVE
UNCHARACTERIZED
PROTEIN PAE0789
TRNA-SPLICING
ENDONUCLEASE


(Pyrobaculum
aerophilum)
PF01974
(tRNA_int_endo)
PF02778
(tRNA_int_endo_N)
no annotation
5 GLY A  44
ASP B 146
ILE B 147
ILE B 142
ALA A  69
None
1.07A 1sh9B-2zyzA:
undetectable
1sh9B-2zyzA:
19.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3a1i AMIDASE

(Rhodococcus sp.
N-771)
PF01425
(Amidase)
6 ARG A 235
GLY A 173
ASP A  97
ILE A  95
GLY A 190
ILE A 196
None
1.27A 1sh9B-3a1iA:
undetectable
1sh9B-3a1iA:
13.53
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.
3c7t ECDYSTEROID-PHOSPHAT
E PHOSPHATASE


(Bombyx mori)
PF00300
(His_Phos_1)
6 ARG A  73
GLY A 299
ASP A 265
ILE A 262
GLY A 259
ILE A 258
None
None
None
CL  A 332 ( 4.3A)
None
None
1.19A 1sh9B-3c7tA:
undetectable
1sh9B-3c7tA:
18.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dfh MANDELATE RACEMASE

(Vibrionales
bacterium
SWAT-3)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
5 GLY A 318
ASP A 101
GLY A  94
PRO A 291
ALA A 292
None
1.04A 1sh9B-3dfhA:
undetectable
1sh9B-3dfhA:
13.72
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.
3euh CHROMOSOME PARTITION
PROTEIN MUKF


(Escherichia
coli)
PF03882
(KicB)
PF17192
(MukF_M)
PF17193
(MukF_C)
5 ASP A 172
ILE A 171
ILE A 263
GLY A 267
ILE A 271
None
0.93A 1sh9B-3euhA:
undetectable
1sh9B-3euhA:
10.16
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.
3fkr L-2-KETO-3-DEOXYARAB
ONATE DEHYDRATASE


(Azospirillum
brasilense)
PF00701
(DHDPS)
5 GLY A 222
ASP A 208
ILE A 183
GLY A 205
ALA A 165
None
None
KPI  A 182 ( 3.8A)
None
None
0.95A 1sh9B-3fkrA:
undetectable
1sh9B-3fkrA:
14.90
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.
3fo8 TAIL SHEATH PROTEIN
GP18


(Escherichia
virus T4)
PF17481
(Phage_sheath_1N)
5 GLY D 258
ILE D 150
ILE D  99
GLY D  97
ALA D 152
None
1.04A 1sh9B-3fo8D:
undetectable
1sh9B-3fo8D:
16.42
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.
3foa TAIL SHEATH PROTEIN
GP18


(Escherichia
virus T4)
PF04984
(Phage_sheath_1)
PF17481
(Phage_sheath_1N)
5 GLY A 258
ILE A 150
ILE A  99
GLY A  97
ALA A 152
None
1.01A 1sh9B-3foaA:
undetectable
1sh9B-3foaA:
12.27
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.
3g1u ADENOSYLHOMOCYSTEINA
SE


(Leishmania
major)
PF00670
(AdoHcyase_NAD)
PF05221
(AdoHcyase)
5 ASP A 129
GLY A 132
ILE A 174
PRO A 124
ALA A  48
None
1.07A 1sh9B-3g1uA:
undetectable
1sh9B-3g1uA:
13.95
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.
3gb0 PEPTIDASE T

(Bacillus cereus)
PF01546
(Peptidase_M20)
PF07687
(M20_dimer)
5 ASP A  18
GLY A  86
ILE A  27
GLY A 105
ILE A 103
GOL  A 376 (-4.8A)
None
None
None
None
1.06A 1sh9B-3gb0A:
undetectable
1sh9B-3gb0A:
15.34
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.
3hee RIBOSE-5-PHOSPHATE
ISOMERASE


(Ruminiclostridium
thermocellum)
PF02502
(LacAB_rpiB)
5 GLY A  33
ILE A  18
ILE A  62
GLY A   4
ILE A  30
None
1.05A 1sh9B-3heeA:
undetectable
1sh9B-3heeA:
22.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hn6 GLUCOSAMINE-6-PHOSPH
ATE DEAMINASE


(Borreliella
burgdorferi)
PF01182
(Glucosamine_iso)
5 GLY A  38
ILE A 202
GLY A 137
ILE A 144
ALA A 235
None
1.03A 1sh9B-3hn6A:
undetectable
1sh9B-3hn6A:
17.61
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.
3j2n TAIL SHEATH PROTEIN
GP18


(Escherichia
virus T4)
PF04984
(Phage_sheath_1)
PF17481
(Phage_sheath_1N)
PF17482
(Phage_sheath_1C)
5 GLY U 258
ILE U 150
ILE U  99
GLY U  97
ALA U 152
None
1.01A 1sh9B-3j2nU:
undetectable
1sh9B-3j2nU:
10.83
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.
3jtf MAGNESIUM AND COBALT
EFFLUX PROTEIN


(Bordetella
parapertussis)
PF00571
(CBS)
5 GLY A 180
ASP A 120
ILE A 122
GLY A 184
ALA A 149
None
1.05A 1sh9B-3jtfA:
undetectable
1sh9B-3jtfA:
21.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3k2i ACYL-COENZYME A
THIOESTERASE 4


(Homo sapiens)
PF04775
(Bile_Hydr_Trans)
PF08840
(BAAT_C)
5 GLY A 168
ILE A 231
GLY A 234
ILE A 237
ALA A 187
None
1.07A 1sh9B-3k2iA:
undetectable
1sh9B-3k2iA:
16.22
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3mws HIV-1 PROTEASE

(Human
immunodeficiency
virus 1)
PF00077
(RVP)
6 ASP A  25
GLY A  27
ASP A  30
ILE A  47
GLY A  49
PRO A  81
None
0.51A 1sh9B-3mwsA:
19.7
1sh9B-3mwsA:
74.75
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3mws HIV-1 PROTEASE

(Human
immunodeficiency
virus 1)
PF00077
(RVP)
6 ASP A  25
GLY A  27
ILE A  47
GLY A  49
ILE A  50
PRO A  81
None
0.48A 1sh9B-3mwsA:
19.7
1sh9B-3mwsA:
74.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ngx BIFUNCTIONAL PROTEIN
FOLD


(Thermoplasma
acidophilum)
PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C)
5 GLY A 251
ILE A 219
GLY A 222
ILE A 223
ALA A 138
None
1.05A 1sh9B-3ngxA:
undetectable
1sh9B-3ngxA:
14.55
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.
3nhv BH2092 PROTEIN

(Bacillus
halodurans)
PF00581
(Rhodanese)
5 ASP A  53
ILE A  65
ILE A 123
GLY A 121
ILE A 120
None
1.05A 1sh9B-3nhvA:
undetectable
1sh9B-3nhvA:
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.
3o3w BH2092 PROTEIN

(Bacillus
halodurans)
PF00581
(Rhodanese)
5 ASP A  53
ILE A  65
ILE A 123
GLY A 121
ILE A 120
None
1.06A 1sh9B-3o3wA:
undetectable
1sh9B-3o3wA:
17.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3os7 GALACTOSE
MUTAROTASE-LIKE
PROTEIN


(Clostridium
acetobutylicum)
PF01263
(Aldose_epim)
5 GLY A 182
ILE A 107
GLY A 109
ILE A 111
PRO A  68
None
1.00A 1sh9B-3os7A:
undetectable
1sh9B-3os7A:
14.62
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.
3p02 UNCHARACTERIZED
PROTEIN


(Bacteroides
ovatus)
PF14274
(DUF4361)
PF16343
(DUF4973)
5 ARG A 221
GLY A 184
ILE A 197
GLY A 314
ILE A 293
EDO  A   3 (-4.1A)
None
None
None
None
0.99A 1sh9B-3p02A:
undetectable
1sh9B-3p02A:
14.83
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.
3ph3 RIBOSE-5-PHOSPHATE
ISOMERASE


(Ruminiclostridium
thermocellum)
PF02502
(LacAB_rpiB)
5 GLY A  33
ILE A  18
ILE A  62
GLY A   4
ILE A  30
None
1.06A 1sh9B-3ph3A:
undetectable
1sh9B-3ph3A:
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.
3q9t CHOLINE
DEHYDROGENASE AND
RELATED
FLAVOPROTEINS


(Aspergillus
oryzae)
PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C)
5 GLY A 310
ASP A 459
ILE A 460
GLY A 466
ALA A 503
None
0.97A 1sh9B-3q9tA:
undetectable
1sh9B-3q9tA:
14.29
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3t3c HIV-1 PROTEASE

(Human
immunodeficiency
virus 1)
PF00077
(RVP)
8 ASP A  25
GLY A  27
ASP A  30
ILE A  47
GLY A  49
ILE A  50
PRO A  81
ALA A  82
017  A 201 (-2.6A)
017  A 201 (-3.4A)
017  A 201 (-4.2A)
None
017  A 201 (-4.0A)
017  A 201 (-3.3A)
None
SO4  A 101 (-3.5A)
0.83A 1sh9B-3t3cA:
18.9
1sh9B-3t3cA:
79.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ttp HIV-1 PROTEASE

(Human
immunodeficiency
virus 1)
PF00077
(RVP)
7 ASP A  25
GLY A  27
ASP A  30
ILE A  32
GLY A  49
ILE A  50
PRO A  81
017  A 201 (-2.6A)
017  A 201 (-3.6A)
017  A 201 (-4.6A)
None
017  A 201 (-3.0A)
017  A 201 (-3.3A)
017  A 201 (-4.1A)
0.49A 1sh9B-3ttpA:
20.2
1sh9B-3ttpA:
82.83
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3u7s POL POLYPROTEIN

(Human
immunodeficiency
virus 1)
PF00077
(RVP)
8 ASP A  25
GLY A  27
ASP A  30
ILE A  32
ILE A  47
GLY A  49
ILE A  50
PRO A  81
017  A 202 ( 2.5A)
017  A 201 ( 3.5A)
017  A 201 ( 4.0A)
None
017  A 202 (-3.6A)
017  A 202 (-2.9A)
017  A 201 ( 3.5A)
017  A 202 (-4.0A)
0.60A 1sh9B-3u7sA:
20.0
1sh9B-3u7sA:
84.85
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.
3vsv XYLOSIDASE

(Thermoanaerobacterium
saccharolyticum)
PF13229
(Beta_helix)
5 GLY A 320
ILE A 256
ILE A 264
GLY A 239
ALA A 224
None
1.00A 1sh9B-3vsvA:
undetectable
1sh9B-3vsvA:
13.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zq6 PUTATIVE ARSENICAL
PUMP-DRIVING ATPASE


(Methanothermobacter
thermautotrophicus)
PF02374
(ArsA_ATPase)
5 ASP A 254
GLY A 255
ILE A 251
GLY A  20
ILE A  19
None
1.01A 1sh9B-3zq6A:
undetectable
1sh9B-3zq6A:
18.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4a3s 6-PHOSPHOFRUCTOKINAS
E


(Bacillus
subtilis)
PF00365
(PFK)
5 ARG A 266
GLY A 138
ASP A 129
GLY A 101
ILE A 100
None
0.96A 1sh9B-4a3sA:
undetectable
1sh9B-4a3sA:
14.71
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.
4aec CYSTEINE SYNTHASE,
MITOCHONDRIAL


(Arabidopsis
thaliana)
PF00291
(PALP)
5 GLY A 270
ILE A 157
GLY A 292
ILE A 294
PRO A 404
None
None
PLP  A 500 (-3.6A)
None
PLP  A 500 (-4.2A)
1.06A 1sh9B-4aecA:
undetectable
1sh9B-4aecA:
12.50
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.
4esw PYRIMIDINE
BIOSYNTHESIS ENZYME
THI13


(Candida
albicans)
PF09084
(NMT1)
5 GLY A 142
ILE A 163
GLY A 159
ILE A 158
ALA A  63
None
None
None
None
CIT  A 900 (-3.1A)
1.01A 1sh9B-4eswA:
undetectable
1sh9B-4eswA:
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.
4h1g MALTOSE BINDING
PROTEIN-CAKAR3 MOTOR
DOMAIN FUSION
PROTEIN


(Candida
albicans;
Escherichia
coli)
PF00225
(Kinesin)
PF13416
(SBP_bac_8)
5 ASP A 568
ASP A 529
ILE A 530
ILE A 528
ILE A 488
None
0.99A 1sh9B-4h1gA:
undetectable
1sh9B-4h1gA:
8.64
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.
4hdj OUTER MEMBRANE
PROTEIN ASSEMBLY
FACTOR BAMB


(Pseudomonas
aeruginosa)
PF13360
(PQQ_2)
5 ASP A 207
GLY A 160
ILE A 159
PRO A 187
ALA A 196
None
0.86A 1sh9B-4hdjA:
undetectable
1sh9B-4hdjA:
13.26
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.
4i4i 6-PHOSPHOFRUCTOKINAS
E


(Geobacillus
stearothermophilus)
PF00365
(PFK)
5 ARG A 266
GLY A 138
ASP A 129
GLY A 101
ILE A 100
None
0.96A 1sh9B-4i4iA:
undetectable
1sh9B-4i4iA:
15.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4j0k TANNASE

(Lactobacillus
plantarum)
no annotation 5 GLY A 416
ASP A 421
ILE A 206
ILE A 413
ALA A 425
None
EGR  A 501 (-3.5A)
EGR  A 501 (-4.0A)
None
None
1.00A 1sh9B-4j0kA:
undetectable
1sh9B-4j0kA:
13.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4lq0 LAGLIDADG HOMING
ENDONUCLEASE


(Leptographium
truncatum)
PF00961
(LAGLIDADG_1)
5 ASP A  53
GLY A 262
ILE A  60
ILE A  15
GLY A 176
None
1.07A 1sh9B-4lq0A:
undetectable
1sh9B-4lq0A:
16.07
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.
4lsw D-2-HYDROXYACID
DEHYDROGENSASE
PROTEIN


(Ketogulonicigenium
vulgare)
PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C)
5 GLY A 285
ILE A 232
ILE A 156
GLY A 102
ALA A 110
None
1.03A 1sh9B-4lswA:
undetectable
1sh9B-4lswA:
14.92
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.
4lxf TREHALOSE SYNTHASE

(Mycobacterium
tuberculosis)
PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C)
5 ASP A 238
ILE A 224
GLY A 234
ILE A 134
ALA A 279
None
1.07A 1sh9B-4lxfA:
undetectable
1sh9B-4lxfA:
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.
4mfv BETA-CATENIN-LIKE
PROTEIN 1


(Homo sapiens)
PF08216
(CTNNBL)
5 ILE A 410
ILE A 382
GLY A 378
ILE A 376
ALA A 360
None
0.97A 1sh9B-4mfvA:
undetectable
1sh9B-4mfvA:
10.49
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4njv PROTEASE

(Human
immunodeficiency
virus 1)
PF00077
(RVP)
6 ARG A   8
ASP A  25
GLY A  27
ASP A  30
ILE A  47
PRO A  81
RIT  A 500 (-3.2A)
RIT  A 500 (-2.4A)
RIT  A 500 (-3.9A)
RIT  A 500 (-4.8A)
RIT  A 500 ( 4.5A)
RIT  A 500 (-3.9A)
1.16A 1sh9B-4njvA:
20.1
1sh9B-4njvA:
86.87
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4njv PROTEASE

(Human
immunodeficiency
virus 1)
PF00077
(RVP)
6 ASP A  25
GLY A  27
ASP A  30
ILE A  47
GLY A  49
PRO A  81
RIT  A 500 (-2.4A)
RIT  A 500 (-3.9A)
RIT  A 500 (-4.8A)
RIT  A 500 ( 4.5A)
RIT  A 500 (-3.4A)
RIT  A 500 (-3.9A)
0.52A 1sh9B-4njvA:
20.1
1sh9B-4njvA:
86.87
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4njv PROTEASE

(Human
immunodeficiency
virus 1)
PF00077
(RVP)
6 ASP A  25
GLY A  27
ILE A  47
GLY A  49
ILE A  50
PRO A  81
RIT  A 500 (-2.4A)
RIT  A 500 (-3.9A)
RIT  A 500 ( 4.5A)
RIT  A 500 (-3.4A)
RIT  A 500 (-4.3A)
RIT  A 500 (-3.9A)
0.54A 1sh9B-4njvA:
20.1
1sh9B-4njvA:
86.87
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.
4o27 SERINE/THREONINE-PRO
TEIN KINASE 24


(Homo sapiens)
PF00069
(Pkinase)
5 ASP B 162
GLY B 164
ILE B 145
GLY B 181
ALA B 148
ADP  B 500 ( 3.4A)
None
None
None
None
1.07A 1sh9B-4o27B:
undetectable
1sh9B-4o27B:
17.78
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.
4oje EFF-1A

(Caenorhabditis
elegans)
PF14884
(EFF-AFF)
5 GLY H 415
ASP H 412
ILE H 410
ILE H 498
ALA H 458
None
0.95A 1sh9B-4ojeH:
undetectable
1sh9B-4ojeH:
11.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ozy POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE


(Pseudomonas
syringae group
genomosp. 3)
PF13229
(Beta_helix)
5 ASP A 368
ILE A 343
ILE A 342
GLY A 364
ILE A 381
None
1.07A 1sh9B-4ozyA:
undetectable
1sh9B-4ozyA:
14.92
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.
4pka PATATIN-17

(Solanum
cardiophyllum)
PF01734
(Patatin)
5 GLY X 261
ILE X  34
GLY X  38
ILE X  39
ALA X  45
None
None
MIS  X  77 ( 3.4A)
None
None
1.00A 1sh9B-4pkaX:
undetectable
1sh9B-4pkaX:
13.76
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.
4qi3 CELLOBIOSE
DEHYDROGENASE


(Crassicarpon
hotsonii)
PF16010
(CDH-cyt)
5 GLY A  72
ILE A  80
GLY A  67
PRO A 102
ALA A  96
None
None
HEM  A 401 (-3.5A)
HEM  A 401 ( 4.7A)
None
1.07A 1sh9B-4qi3A:
undetectable
1sh9B-4qi3A:
18.92
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.
4qiw DNA-DIRECTED RNA
POLYMERASE


(Thermococcus
kodakarensis)
PF00623
(RNA_pol_Rpb1_2)
PF04983
(RNA_pol_Rpb1_3)
PF04997
(RNA_pol_Rpb1_1)
PF04998
(RNA_pol_Rpb1_5)
PF05000
(RNA_pol_Rpb1_4)
5 GLY A 511
ASP A 506
ILE A 504
GLY A 754
ALA A 502
None
1.06A 1sh9B-4qiwA:
undetectable
1sh9B-4qiwA:
7.20
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.
4rk9 CARBOHYDRATE ABC
TRANSPORTER
SUBSTRATE-BINDING
PROTEIN MSME


(Bacillus
licheniformis)
PF01547
(SBP_bac_1)
5 ILE A 303
GLY A 143
ILE A 144
PRO A 300
ALA A 293
None
1.04A 1sh9B-4rk9A:
undetectable
1sh9B-4rk9A:
19.54
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.
4u1r ATP-DEPENDENT
6-PHOSPHOFRUCTOKINAS
E, PLATELET TYPE


(Homo sapiens)
PF00365
(PFK)
5 ARG A 324
GLY A 186
ASP A 177
GLY A 126
ILE A 125
None
None
ATP  A 801 ( 4.8A)
None
None
1.01A 1sh9B-4u1rA:
undetectable
1sh9B-4u1rA:
9.45
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.
4u8g PUTATIVE
UNCHARACTERIZED
PROTEIN GBS1891


(Streptococcus
agalactiae)
PF13561
(adh_short_C2)
5 ASP A  71
ILE A  78
GLY A  21
PRO A 126
ALA A 125
None
1.05A 1sh9B-4u8gA:
undetectable
1sh9B-4u8gA:
15.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4uow OBSCURIN
TITIN


(Homo sapiens)
PF07679
(I-set)
5 GLY 1  89
ILE 0  14
ILE 0  94
ILE 0  65
ALA 1  93
None
1.07A 1sh9B-4uow1:
undetectable
1sh9B-4uow1:
16.00
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.
4y0w YEAZ

(Pseudomonas
aeruginosa)
PF00814
(Peptidase_M22)
5 ASP A   8
GLY A  63
GLY A  67
ILE A 116
ALA A  13
NA  A 302 (-3.6A)
None
None
None
NA  A 302 (-4.1A)
0.93A 1sh9B-4y0wA:
undetectable
1sh9B-4y0wA:
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.
4ym3 GALECTIN-4

(Homo sapiens)
PF00337
(Gal-bind_lectin)
5 ARG A 306
GLY A 281
ASP A 296
ILE A 208
ALA A 234
None
0.82A 1sh9B-4ym3A:
undetectable
1sh9B-4ym3A:
17.88
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.
4yrp HISTIDYL-TRNA
SYNTHETASE


(Trypanosoma
cruzi)
PF03129
(HGTP_anticodon)
PF13393
(tRNA-synt_His)
5 GLY A 361
ILE A 367
GLY A 326
ILE A 207
ALA A 194
HIS  A 501 (-3.8A)
None
None
None
None
1.04A 1sh9B-4yrpA:
undetectable
1sh9B-4yrpA:
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.
5d6n ACYL-COA SYNTHASE

(Mycolicibacterium
smegmatis)
PF00501
(AMP-binding)
5 GLY A 393
ILE A 339
ILE A 317
GLY A 313
ALA A 309
None
1.01A 1sh9B-5d6nA:
undetectable
1sh9B-5d6nA:
12.29
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.
5d9a POLYMERASE ACIDIC
PROTEIN


(Influenza C
virus)
PF00603
(Flu_PA)
5 GLY A 293
ASP A 288
ILE A 287
ILE A 324
ILE A 298
None
1.02A 1sh9B-5d9aA:
undetectable
1sh9B-5d9aA:
9.84
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.
5gkx UNCHARACTERIZED
PROTEIN


(Thermococcus
onnurineus)
PF14336
(DUF4392)
6 ASP A 235
GLY A 236
ILE A 225
ILE A 228
GLY A 232
ALA A 242
None
1.42A 1sh9B-5gkxA:
undetectable
1sh9B-5gkxA:
19.40
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.
5h6s AMIDASE

(Microbacterium
sp. HM58-2)
PF01425
(Amidase)
6 ARG A 225
GLY A 157
ASP A  81
ILE A  79
GLY A 174
ILE A 180
None
1.11A 1sh9B-5h6sA:
undetectable
1sh9B-5h6sA:
11.11
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.
5ibz UNCHARACTERIZED
PROTEIN


(uncultured
organism)
PF04199
(Cyclase)
5 ASP A 266
GLY A 223
GLY A 246
ILE A 196
ALA A 264
None
0.80A 1sh9B-5ibzA:
undetectable
1sh9B-5ibzA:
15.65
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.
5im3 RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE


(Pseudomonas
aeruginosa)
PF00317
(Ribonuc_red_lgN)
PF02867
(Ribonuc_red_lgC)
PF03477
(ATP-cone)
5 ARG A 632
GLY A 659
ILE A 697
ILE A 607
ALA A 699
None
0.98A 1sh9B-5im3A:
undetectable
1sh9B-5im3A:
7.88
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.
5odr METHYL-VIOLOGEN
REDUCING
HYDROGENASE, SUBUNIT
A
METHYL-VIOLOGEN
REDUCING
HYDROGENASE, SUBUNIT
G


(Methanothermococcus
thermolithotrophicus)
PF00374
(NiFeSe_Hases)
PF01058
(Oxidored_q6)
5 GLY F  14
ILE F  60
GLY F  62
ILE E  17
PRO F 374
None
None
None
None
NFU  F 501 (-3.5A)
0.93A 1sh9B-5odrF:
undetectable
1sh9B-5odrF:
12.69
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5t2z PROTEASE

(Human
immunodeficiency
virus 1)
PF00077
(RVP)
6 ARG A   8
ASP A  25
GLY A  27
ASP A  30
ILE A  47
PRO A  81
None
1.11A 1sh9B-5t2zA:
20.9
1sh9B-5t2zA:
83.84
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5t2z PROTEASE

(Human
immunodeficiency
virus 1)
PF00077
(RVP)
7 ASP A  25
GLY A  27
ASP A  30
ILE A  47
GLY A  49
ILE A  50
PRO A  81
None
0.42A 1sh9B-5t2zA:
20.9
1sh9B-5t2zA:
83.84
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.
5t5i TUNGSTEN
FORMYLMETHANOFURAN
DEHYDROGENASE
SUBUNIT B


(Methanothermobacter
sp. CaT2)
PF00384
(Molybdopterin)
5 ARG B 288
ASP B  18
ILE B  19
GLY B  38
ILE B  37
None
None
None
SF4  B 501 ( 4.0A)
SF4  B 501 (-4.5A)
1.05A 1sh9B-5t5iB:
undetectable
1sh9B-5t5iB:
12.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5twb FERREDOXIN--NADP
REDUCTASE


(Staphylococcus
aureus)
PF07992
(Pyr_redox_2)
5 GLY A   9
ILE A 111
ILE A 286
GLY A 116
ILE A 117
FAD  A 401 ( 4.7A)
None
None
FAD  A 401 (-4.0A)
FAD  A 401 (-4.8A)
0.70A 1sh9B-5twbA:
undetectable
1sh9B-5twbA:
16.20
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.
5tzq BCL-2-LIKE PROTEIN
FPV039


(Fowlpox virus)
PF00452
(Bcl-2)
5 ASP A 119
ILE A 117
ILE A 113
GLY A 111
ALA A  14
None
0.99A 1sh9B-5tzqA:
undetectable
1sh9B-5tzqA:
19.08
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.
5vbf NAD-DEPENDENT
SUCCINATE-SEMIALDEHY
DE DEHYDROGENASE


(Burkholderia
vietnamiensis)
PF00171
(Aldedh)
5 GLY A 212
ASP A  50
ILE A  16
ILE A 190
ALA A 152
None
1.00A 1sh9B-5vbfA:
undetectable
1sh9B-5vbfA:
11.78
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.
5vj7 OXIDOREDUCTASE

(Pyrococcus
furiosus)
PF07992
(Pyr_redox_2)
PF14691
(Fer4_20)
5 GLY A 264
ILE A 357
GLY A 259
ILE A 260
PRO A 353
None
0.93A 1sh9B-5vj7A:
undetectable
1sh9B-5vj7A:
15.26
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.
5xoe ATP-DEPENDENT
6-PHOSPHOFRUCTOKINAS
E


(Staphylococcus
aureus)
no annotation 5 ARG A 268
GLY A 140
ASP A 129
GLY A 101
ILE A 100
None
1.05A 1sh9B-5xoeA:
undetectable
1sh9B-5xoeA:
21.50
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.
5xsx CHITINASE

(Thermococcus
chitonophagus)
no annotation 5 ASP A 487
ILE A 488
GLY A 484
ILE A 483
ALA A 530
GOL  A1004 (-3.5A)
None
None
None
None
1.01A 1sh9B-5xsxA:
undetectable
1sh9B-5xsxA:
26.17
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.
6fea NITROGENASE PROTEIN
ALPHA CHAIN


(Azotobacter
vinelandii)
no annotation 5 ASP A 384
GLY A 385
ILE A  34
ILE A  12
ALA A  38
None
1.06A 1sh9B-6feaA:
undetectable
1sh9B-6feaA:
25.74
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6upj HIV-2 PROTEASE

(Human
immunodeficiency
virus 2)
PF00077
(RVP)
7 ASP A  25
GLY A  27
ASP A  30
ILE A  32
GLY A  49
ILE A  50
PRO A  81
NIU  A 100 (-2.8A)
NIU  A 100 (-4.5A)
None
None
NIU  A 100 ( 3.8A)
NIU  A 100 (-3.9A)
None
0.82A 1sh9B-6upjA:
18.7
1sh9B-6upjA:
48.48