SIMILAR PATTERNS OF AMINO ACIDS FOR 5JSD_B_1GNB603_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.
1b63 MUTL

(Escherichia
coli) 		PF01119
(DNA_mis_repair)
PF13589
(HATPase_c_3) 		3 VAL A 301
GLU A  29
GLU A  32
 EDO  A 901 (-4.4A)
ANP  A 380 ( 4.6A)
EDO  A 902 (-3.6A)
 0.73A 5jsdB-1b63A:
0.0
5jsdC-1b63A:
0.0		 5jsdB-1b63A:
19.40
5jsdC-1b63A:
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.
1e08 [FE]-HYDROGENASE
(LARGE SUBUNIT)

(Desulfovibrio
desulfuricans) 		PF02906
(Fe_hyd_lg_C)
PF13187
(Fer4_9) 		3 VAL A 394
GLU A 262
GLU A  83
 None
 0.94A 5jsdB-1e08A:
0.0
5jsdC-1e08A:
0.0		 5jsdB-1e08A:
20.26
5jsdC-1e08A:
20.26
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.
1go3 DNA-DIRECTED RNA
POLYMERASE SUBUNIT E
DNA-DIRECTED RNA
POLYMERASE SUBUNIT F

(Methanocaldococcus
jannaschii) 		PF00575
(S1)
PF03874
(RNA_pol_Rpb4)
PF03876
(SHS2_Rpb7-N) 		3 VAL F  14
GLU E  80
GLU E  83
 None
 0.94A 5jsdB-1go3F:
undetectable
5jsdC-1go3F:
undetectable		 5jsdB-1go3F:
9.84
5jsdC-1go3F:
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.
1gvh FLAVOHEMOPROTEIN

(Escherichia
coli) 		PF00042
(Globin)
PF00175
(NAD_binding_1)
PF00970
(FAD_binding_6) 		3 VAL A  78
GLU A 141
GLU A 137
 None
 0.90A 5jsdB-1gvhA:
0.0
5jsdC-1gvhA:
0.0		 5jsdB-1gvhA:
19.83
5jsdC-1gvhA:
19.83
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.
1hp1 5'-NUCLEOTIDASE

(Escherichia
coli) 		PF00149
(Metallophos)
PF02872
(5_nucleotid_C) 		3 VAL A 310
GLU A  69
GLU A  73
 None
 0.64A 5jsdB-1hp1A:
0.0
5jsdC-1hp1A:
0.0		 5jsdB-1hp1A:
21.62
5jsdC-1hp1A:
21.62
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.
1i7o 4-HYDROXYPHENYLACETA
TE DEGRADATION
BIFUNCTIONAL
ISOMERASE/DECARBOXYL
ASE

(Escherichia
coli) 		PF01557
(FAA_hydrolase) 		3 VAL A 249
GLU A 276
GLU A 278
 None
CA  A1001 (-3.1A)
CA  A1001 (-2.8A)
 0.48A 5jsdB-1i7oA:
0.0
5jsdC-1i7oA:
0.0		 5jsdB-1i7oA:
18.60
5jsdC-1i7oA:
18.60
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.
1pvj PYROGENIC EXOTOXIN B

(Streptococcus
pyogenes) 		PF01640
(Peptidase_C10)
PF13734
(Inhibitor_I69) 		3 VAL A 337
GLU A 126
GLU A 122
 ZFB  A 450 (-3.9A)
None
None
 0.81A 5jsdB-1pvjA:
0.0
5jsdC-1pvjA:
0.0		 5jsdB-1pvjA:
20.62
5jsdC-1pvjA:
20.62
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.
1qdq CATHEPSIN B

(Bos taurus) 		PF00112
(Peptidase_C1) 		3 VAL A 208
GLU A 243
GLU A 157
 None
 0.87A 5jsdB-1qdqA:
0.0
5jsdC-1qdqA:
0.0		 5jsdB-1qdqA:
16.06
5jsdC-1qdqA:
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.
1qsa PROTEIN (SOLUBLE
LYTIC
TRANSGLYCOSYLASE
SLT70)

(Escherichia
coli) 		PF01464
(SLT)
PF14718
(SLT_L) 		3 VAL A 588
GLU A 320
GLU A 577
 None
 0.75A 5jsdB-1qsaA:
undetectable
5jsdC-1qsaA:
undetectable		 5jsdB-1qsaA:
21.66
5jsdC-1qsaA:
21.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qvb BETA-GLYCOSIDASE

(Thermosphaera
aggregans) 		PF00232
(Glyco_hydro_1) 		3 VAL A 111
GLU A 180
GLU A 184
 None
 0.79A 5jsdB-1qvbA:
0.0
5jsdC-1qvbA:
0.0		 5jsdB-1qvbA:
20.52
5jsdC-1qvbA:
20.52
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.
1sp4 CATHEPSIN B

(Bos taurus) 		PF00112
(Peptidase_C1) 		3 VAL B 208
GLU B 243
GLU B 157
 None
 0.84A 5jsdB-1sp4B:
undetectable
5jsdC-1sp4B:
undetectable		 5jsdB-1sp4B:
13.44
5jsdC-1sp4B:
13.44
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.
1u0o BOTROCETIN
VON WILLEBRAND
FACTOR

(Bothrops
jararaca;
Mus musculus) 		PF00059
(Lectin_C)
PF00092
(VWA) 		3 VAL C 591
GLU B 232
GLU B 228
 None
 0.93A 5jsdB-1u0oC:
undetectable
5jsdC-1u0oC:
undetectable		 5jsdB-1u0oC:
14.94
5jsdC-1u0oC:
14.94
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.
1u6r CREATINE KINASE, M
CHAIN

(Oryctolagus
cuniculus) 		PF00217
(ATP-gua_Ptrans)
PF02807
(ATP-gua_PtransN) 		3 VAL A 324
GLU A 230
GLU A 231
 ADP  A1801 (-4.3A)
None
None
 0.84A 5jsdB-1u6rA:
0.0
5jsdC-1u6rA:
undetectable		 5jsdB-1u6rA:
18.62
5jsdC-1u6rA:
18.62
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.
1yt5 INORGANIC
POLYPHOSPHATE/ATP-NA
D KINASE

(Thermotoga
maritima) 		PF01513
(NAD_kinase) 		3 VAL A 246
GLU A 174
GLU A 101
 None
 0.67A 5jsdB-1yt5A:
undetectable
5jsdC-1yt5A:
undetectable		 5jsdB-1yt5A:
15.59
5jsdC-1yt5A:
15.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ani RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE
BETA SUBUNIT

(Chlamydia
trachomatis) 		PF00268
(Ribonuc_red_sm) 		3 VAL A 175
GLU A 256
GLU A 252
 None
 0.77A 5jsdB-2aniA:
undetectable
5jsdC-2aniA:
undetectable		 5jsdB-2aniA:
17.79
5jsdC-2aniA:
17.79
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.
2bg5 PHOSPHOENOLPYRUVATE-
PROTEIN KINASE

(Caldanaerobacter
subterraneus) 		PF02896
(PEP-utilizers_C) 		3 VAL A 418
GLU A 315
GLU A 311
 None
 0.84A 5jsdB-2bg5A:
0.5
5jsdC-2bg5A:
undetectable		 5jsdB-2bg5A:
17.63
5jsdC-2bg5A:
17.63
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.
2c1h DELTA-AMINOLEVULINIC
ACID DEHYDRATASE

(Prosthecochloris
vibrioformis) 		PF00490
(ALAD) 		3 VAL A 149
GLU A 186
GLU A 182
 None
 0.95A 5jsdB-2c1hA:
undetectable
5jsdC-2c1hA:
undetectable		 5jsdB-2c1hA:
19.02
5jsdC-2c1hA:
19.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2c4m GLYCOGEN
PHOSPHORYLASE

(Corynebacterium
callunae) 		PF00343
(Phosphorylase) 		3 VAL A 651
GLU A 671
GLU A 670
 None
 0.68A 5jsdB-2c4mA:
undetectable
5jsdC-2c4mA:
undetectable		 5jsdB-2c4mA:
22.01
5jsdC-2c4mA:
22.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2e8y AMYX PROTEIN

(Bacillus
subtilis) 		PF00128
(Alpha-amylase)
PF02922
(CBM_48) 		3 VAL A 562
GLU A 219
GLU A 269
 None
 0.91A 5jsdB-2e8yA:
undetectable
5jsdC-2e8yA:
undetectable		 5jsdB-2e8yA:
21.86
5jsdC-2e8yA:
21.86
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.
2ftw DIHYDROPYRIMIDINE
AMIDOHYDROLASE

(Dictyostelium
discoideum) 		PF01979
(Amidohydro_1) 		3 VAL A 295
GLU A 225
GLU A 193
 None
 0.70A 5jsdB-2ftwA:
undetectable
5jsdC-2ftwA:
undetectable		 5jsdB-2ftwA:
22.36
5jsdC-2ftwA:
22.36
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.
2hdi COLICIN I RECEPTOR

(Escherichia
coli) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		3 VAL A 135
GLU A 472
GLU A 534
 None
 0.68A 5jsdB-2hdiA:
1.0
5jsdC-2hdiA:
0.0		 5jsdB-2hdiA:
23.88
5jsdC-2hdiA:
23.88
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.
2k5c UNCHARACTERIZED
PROTEIN PF0385

(Pyrococcus
furiosus) 		PF03966
(Trm112p) 		3 VAL A  56
GLU A  26
GLU A  22
 None
 0.79A 5jsdB-2k5cA:
undetectable
5jsdC-2k5cA:
undetectable		 5jsdB-2k5cA:
10.67
5jsdC-2k5cA:
10.67
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.
2l57 UNCHARACTERIZED
PROTEIN

(Clostridium
perfringens) 		PF13098
(Thioredoxin_2) 		3 VAL A  17
GLU A  67
GLU A  68
 None
 0.89A 5jsdB-2l57A:
undetectable
5jsdC-2l57A:
undetectable		 5jsdB-2l57A:
10.01
5jsdC-2l57A:
10.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pa6 ENOLASE

(Methanocaldococcus
jannaschii) 		PF00113
(Enolase_C)
PF03952
(Enolase_N) 		3 VAL A 364
GLU A 213
GLU A 170
 None
 0.91A 5jsdB-2pa6A:
undetectable
5jsdC-2pa6A:
undetectable		 5jsdB-2pa6A:
20.90
5jsdC-2pa6A:
20.90
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.
2pbh PROCATHEPSIN B

(Homo sapiens) 		PF00112
(Peptidase_C1)
PF08127
(Propeptide_C1) 		3 VAL A 208
GLU A 243
GLU A 157
 None
 0.78A 5jsdB-2pbhA:
undetectable
5jsdC-2pbhA:
undetectable		 5jsdB-2pbhA:
17.48
5jsdC-2pbhA:
17.48
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.
2poz PUTATIVE DEHYDRATASE

(Mesorhizobium
japonicum) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 VAL A 308
GLU A 232
GLU A 231
 None
 0.93A 5jsdB-2pozA:
undetectable
5jsdC-2pozA:
undetectable		 5jsdB-2pozA:
19.11
5jsdC-2pozA:
19.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2quy PENICILLIN ACYLASE

(Lysinibacillus
sphaericus) 		PF02275
(CBAH) 		3 VAL A  47
GLU A 131
GLU A  42
 None
 0.91A 5jsdB-2quyA:
0.1
5jsdC-2quyA:
0.7		 5jsdB-2quyA:
18.19
5jsdC-2quyA:
18.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qyv XAA-HIS DIPEPTIDASE

(Histophilus
somni) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		3 VAL A 217
GLU A 425
GLU A 175
 None
 0.93A 5jsdB-2qyvA:
undetectable
5jsdC-2qyvA:
undetectable		 5jsdB-2qyvA:
20.82
5jsdC-2qyvA:
20.82
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.
2vr2 DIHYDROPYRIMIDINASE

(Homo sapiens) 		PF01979
(Amidohydro_1) 		3 VAL A 296
GLU A 226
GLU A 194
 None
 0.63A 5jsdB-2vr2A:
undetectable
5jsdC-2vr2A:
undetectable		 5jsdB-2vr2A:
22.24
5jsdC-2vr2A:
22.24
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.
2vro ALDEHYDE
DEHYDROGENASE

(Paraburkholderia
xenovorans) 		PF00171
(Aldedh) 		3 VAL A 100
GLU A 283
GLU A 287
 None
 0.81A 5jsdB-2vroA:
undetectable
5jsdC-2vroA:
undetectable		 5jsdB-2vroA:
21.36
5jsdC-2vroA:
21.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vwk DNA POLYMERASE

(Thermococcus
gorgonarius) 		PF00136
(DNA_pol_B)
PF03104
(DNA_pol_B_exo1) 		3 VAL A 643
GLU A 730
GLU A 734
 None
 0.89A 5jsdB-2vwkA:
1.4
5jsdC-2vwkA:
1.3		 5jsdB-2vwkA:
22.78
5jsdC-2vwkA:
22.78
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.
2www METHYLMALONIC
ACIDURIA TYPE A
PROTEIN,
MITOCHONDRIAL

(Homo sapiens) 		PF03308
(ArgK) 		3 VAL A 108
GLU A 377
GLU A 373
 None
 0.85A 5jsdB-2wwwA:
undetectable
5jsdC-2wwwA:
undetectable		 5jsdB-2wwwA:
19.78
5jsdC-2wwwA:
19.78
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.
3ah7 [2FE-2S]FERREDOXIN

(Pseudomonas
putida) 		PF00111
(Fer2) 		3 VAL A  54
GLU A  69
GLU A  68
 None
 0.92A 5jsdB-3ah7A:
undetectable
5jsdC-3ah7A:
undetectable		 5jsdB-3ah7A:
9.17
5jsdC-3ah7A:
9.17
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.
3aj2 CELLULOSE SYNTHASE
OPERON PROTEIN D

(Komagataeibacter
xylinus) 		PF03500
(Cellsynth_D) 		3 VAL A 127
GLU A  36
GLU A  32
 None
 0.90A 5jsdB-3aj2A:
undetectable
5jsdC-3aj2A:
undetectable		 5jsdB-3aj2A:
12.66
5jsdC-3aj2A:
12.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ble CITRAMALATE SYNTHASE
FROM LEPTOSPIRA
INTERROGANS

(Leptospira
interrogans) 		PF00682
(HMGL-like) 		3 VAL A  13
GLU A   9
GLU A 205
 None
 0.93A 5jsdB-3bleA:
undetectable
5jsdC-3bleA:
undetectable		 5jsdB-3bleA:
20.25
5jsdC-3bleA:
20.25
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.
3d8k PROTEIN PHOSPHATASE
2C

(Toxoplasma
gondii) 		PF00481
(PP2C) 		3 VAL A 111
GLU A  84
GLU A 410
 None
 0.93A 5jsdB-3d8kA:
0.0
5jsdC-3d8kA:
0.0		 5jsdB-3d8kA:
20.25
5jsdC-3d8kA:
20.25
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.
3dfy MUCONATE
CYCLOISOMERASE

(Thermotoga
maritima) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 VAL A 328
GLU A  48
GLU A  34
 None
 0.82A 5jsdB-3dfyA:
undetectable
5jsdC-3dfyA:
0.0		 5jsdB-3dfyA:
19.69
5jsdC-3dfyA:
19.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3e49 UNCHARACTERIZED
PROTEIN DUF849 WITH
A TIM BARREL FOLD

(Paraburkholderia
xenovorans) 		PF05853
(BKACE) 		3 VAL A  13
GLU A 171
GLU A 169
 None
ZN  A 500 ( 4.5A)
None
 0.85A 5jsdB-3e49A:
0.2
5jsdC-3e49A:
undetectable		 5jsdB-3e49A:
17.76
5jsdC-3e49A:
17.76
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.
3ear HERA

(Thermus
thermophilus) 		PF00271
(Helicase_C) 		3 VAL A 235
GLU A 214
GLU A 216
 None
 0.76A 5jsdB-3earA:
undetectable
5jsdC-3earA:
undetectable		 5jsdB-3earA:
13.26
5jsdC-3earA:
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.
3f6a HYDROLASE, NUDIX
FAMILY

(Clostridium
perfringens) 		PF00293
(NUDIX) 		3 VAL A   7
GLU A 116
GLU A  51
 None
 0.93A 5jsdB-3f6aA:
undetectable
5jsdC-3f6aA:
undetectable		 5jsdB-3f6aA:
12.43
5jsdC-3f6aA:
12.43
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.
3h0g DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB1

(Schizosaccharomyces
pombe) 		PF00623
(RNA_pol_Rpb1_2)
PF04983
(RNA_pol_Rpb1_3)
PF04990
(RNA_pol_Rpb1_7)
PF04992
(RNA_pol_Rpb1_6)
PF04997
(RNA_pol_Rpb1_1)
PF04998
(RNA_pol_Rpb1_5)
PF05000
(RNA_pol_Rpb1_4) 		3 VAL A 447
GLU A 384
GLU A 501
 None
 0.79A 5jsdB-3h0gA:
undetectable
5jsdC-3h0gA:
undetectable		 5jsdB-3h0gA:
17.07
5jsdC-3h0gA:
17.07
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.
3h0g DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB2
DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB3

(Schizosaccharomyces
pombe) 		PF00562
(RNA_pol_Rpb2_6)
PF01000
(RNA_pol_A_bac)
PF01193
(RNA_pol_L)
PF04560
(RNA_pol_Rpb2_7)
PF04561
(RNA_pol_Rpb2_2)
PF04563
(RNA_pol_Rpb2_1)
PF04565
(RNA_pol_Rpb2_3)
PF04566
(RNA_pol_Rpb2_4)
PF04567
(RNA_pol_Rpb2_5) 		3 VAL B1041
GLU C 201
GLU C 195
 None
 0.78A 5jsdB-3h0gB:
undetectable
5jsdC-3h0gB:
undetectable		 5jsdB-3h0gB:
20.47
5jsdC-3h0gB:
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.
3i32 HEAT RESISTANT RNA
DEPENDENT ATPASE

(Thermus
thermophilus) 		PF00271
(Helicase_C) 		3 VAL A 235
GLU A 214
GLU A 216
 None
 0.77A 5jsdB-3i32A:
undetectable
5jsdC-3i32A:
undetectable		 5jsdB-3i32A:
17.03
5jsdC-3i32A:
17.03
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.
3ip1 ALCOHOL
DEHYDROGENASE,
ZINC-CONTAINING

(Thermotoga
maritima) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		3 VAL A 315
GLU A 127
GLU A 193
 None
None
CD  A 501 (-2.9A)
 0.73A 5jsdB-3ip1A:
undetectable
5jsdC-3ip1A:
undetectable		 5jsdB-3ip1A:
21.70
5jsdC-3ip1A:
21.70
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.
3lrv PRE-MRNA-SPLICING
FACTOR 19

(Saccharomyces
cerevisiae) 		no annotation 3 VAL A 480
GLU A 392
GLU A 379
 None
 0.92A 5jsdB-3lrvA:
undetectable
5jsdC-3lrvA:
undetectable		 5jsdB-3lrvA:
17.80
5jsdC-3lrvA:
17.80
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.
3o8o 6-PHOSPHOFRUCTOKINAS
E SUBUNIT BETA

(Saccharomyces
cerevisiae) 		PF00365
(PFK) 		3 VAL B 910
GLU B 560
GLU B 563
 None
 0.90A 5jsdB-3o8oB:
undetectable
5jsdC-3o8oB:
undetectable		 5jsdB-3o8oB:
22.34
5jsdC-3o8oB:
22.34
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.
3o8s ADP-RIBOSE
PYROPHOSPHATASE

(Streptococcus
suis) 		PF00293
(NUDIX) 		3 VAL A 147
GLU A 116
GLU A 112
 None
EDO  A 210 (-3.7A)
None
 0.85A 5jsdB-3o8sA:
undetectable
5jsdC-3o8sA:
undetectable		 5jsdB-3o8sA:
14.06
5jsdC-3o8sA:
14.06
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.
3ogh PROTEIN YCIE

(Escherichia
coli) 		no annotation 3 VAL B  54
GLU B 137
GLU B 136
 None
MG  B 501 ( 2.5A)
None
 0.91A 5jsdB-3oghB:
undetectable
5jsdC-3oghB:
undetectable		 5jsdB-3oghB:
12.40
5jsdC-3oghB:
12.40
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.
3p4s FUMARATE REDUCTASE
FLAVOPROTEIN SUBUNIT

(Escherichia
coli) 		PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C) 		3 VAL A 171
GLU A 422
GLU A 426
 None
 0.77A 5jsdB-3p4sA:
undetectable
5jsdC-3p4sA:
undetectable		 5jsdB-3p4sA:
21.73
5jsdC-3p4sA:
21.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qnk PUTATIVE LIPOPROTEIN

(Bacteroides
fragilis) 		PF07980
(SusD_RagB)
PF14322
(SusD-like_3) 		3 VAL A 439
GLU A 340
GLU A 309
 None
 0.82A 5jsdB-3qnkA:
undetectable
5jsdC-3qnkA:
undetectable		 5jsdB-3qnkA:
21.95
5jsdC-3qnkA:
21.95
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.
3r6o 2-HYDROXYHEPTA-2,4-D
IENE-1,
7-DIOATEISOMERASE

(Mycobacteroides
abscessus) 		PF01557
(FAA_hydrolase) 		3 VAL A 110
GLU A 137
GLU A 139
 None
MG  A 400 (-3.5A)
MG  A 400 (-2.7A)
 0.66A 5jsdB-3r6oA:
undetectable
5jsdC-3r6oA:
undetectable		 5jsdB-3r6oA:
19.31
5jsdC-3r6oA:
19.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3s1s RESTRICTION
ENDONUCLEASE BPUSI

(Bacillus
pumilus) 		PF02384
(N6_Mtase)
PF15516
(BpuSI_N) 		3 VAL A  75
GLU A 533
GLU A  21
 None
MN  A 930 ( 4.3A)
MN  A 930 (-2.6A)
 0.80A 5jsdB-3s1sA:
undetectable
5jsdC-3s1sA:
undetectable		 5jsdB-3s1sA:
20.95
5jsdC-3s1sA:
20.95
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.
3s1s RESTRICTION
ENDONUCLEASE BPUSI

(Bacillus
pumilus) 		PF02384
(N6_Mtase)
PF15516
(BpuSI_N) 		3 VAL A  84
GLU A 533
GLU A  21
 None
MN  A 930 ( 4.3A)
MN  A 930 (-2.6A)
 0.87A 5jsdB-3s1sA:
undetectable
5jsdC-3s1sA:
undetectable		 5jsdB-3s1sA:
20.95
5jsdC-3s1sA:
20.95
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.
3v7p AMIDOHYDROLASE
FAMILY PROTEIN

(Nitratiruptor
sp. SB155-2) 		PF01979
(Amidohydro_1) 		3 VAL A  85
GLU A 124
GLU A  65
 None
 0.94A 5jsdB-3v7pA:
undetectable
5jsdC-3v7pA:
undetectable		 5jsdB-3v7pA:
20.41
5jsdC-3v7pA:
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.
3vsj 2-AMINO-5-CHLOROPHEN
OL 1,6-DIOXYGENASE
ALPHA SUBUNIT

(Comamonas
testosteroni) 		PF02900
(LigB) 		3 VAL A 214
GLU A 149
GLU A 152
 None
 0.91A 5jsdB-3vsjA:
undetectable
5jsdC-3vsjA:
undetectable		 5jsdB-3vsjA:
17.81
5jsdC-3vsjA:
17.81
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.
3wsb FARNESYLTRANSFERASE,
PUTATIVE

(Trypanosoma
cruzi) 		PF00494
(SQS_PSY) 		3 VAL A 107
GLU A 214
GLU A 218
 None
 0.90A 5jsdB-3wsbA:
undetectable
5jsdC-3wsbA:
undetectable		 5jsdB-3wsbA:
21.96
5jsdC-3wsbA:
21.96
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.
4d4z DEOXYHYPUSINE
HYDROXYLASE

(Homo sapiens) 		PF13646
(HEAT_2) 		3 VAL A 212
GLU A  90
GLU A  93
 None
GOL  A 305 (-2.5A)
GOL  A 305 (-2.7A)
 0.74A 5jsdB-4d4zA:
undetectable
5jsdC-4d4zA:
undetectable		 5jsdB-4d4zA:
17.52
5jsdC-4d4zA:
17.52
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.
4g8d ALPHA/BETA HYDROLASE
FOLD PROTEIN

(Ochrobactrum
sp. T63) 		PF00561
(Abhydrolase_1) 		3 VAL A 204
GLU A 132
GLU A 133
 None
 0.90A 5jsdB-4g8dA:
undetectable
5jsdC-4g8dA:
undetectable		 5jsdB-4g8dA:
16.57
5jsdC-4g8dA:
16.57
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.
4hsb PROBABLE
DNA-3-METHYLADENINE
GLYCOSYLASE 2

(Schizosaccharomyces
pombe) 		PF00730
(HhH-GPD) 		3 VAL A 184
GLU A 126
GLU A 145
 None
 0.76A 5jsdB-4hsbA:
undetectable
5jsdC-4hsbA:
undetectable		 5jsdB-4hsbA:
13.59
5jsdC-4hsbA:
13.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4i05 CATHEPSIN B-LIKE
PEPTIDASE (C01
FAMILY)

(Schistosoma
mansoni) 		PF00112
(Peptidase_C1) 		3 VAL A 279
GLU A 314
GLU A 228
 None
 0.93A 5jsdB-4i05A:
undetectable
5jsdC-4i05A:
undetectable		 5jsdB-4i05A:
17.09
5jsdC-4i05A:
17.09
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.
4jn7 ENOLASE

(Agrobacterium
tumefaciens) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 VAL A 268
GLU A 216
GLU A 217
 None
NA  A 401 (-3.2A)
None
 0.91A 5jsdB-4jn7A:
undetectable
5jsdC-4jn7A:
undetectable		 5jsdB-4jn7A:
18.01
5jsdC-4jn7A:
18.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4l8j PUTATIVE EFFLUX
TRANSPORTER

(Bacteroides
eggerthii) 		PF16576
(HlyD_D23) 		3 VAL A  54
GLU A 226
GLU A 225
 None
 0.73A 5jsdB-4l8jA:
undetectable
5jsdC-4l8jA:
undetectable		 5jsdB-4l8jA:
19.30
5jsdC-4l8jA:
19.30
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.
4mks ENOLASE 2

(Lactobacillus
gasseri) 		PF00113
(Enolase_C)
PF03952
(Enolase_N) 		3 VAL A 364
GLU A 205
GLU A 164
 None
None
MG  A 502 ( 4.7A)
 0.91A 5jsdB-4mksA:
undetectable
5jsdC-4mksA:
undetectable		 5jsdB-4mksA:
20.80
5jsdC-4mksA:
20.80
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.
4okd ISOAMYLASE

(Chlamydomonas
reinhardtii) 		PF00128
(Alpha-amylase)
PF02922
(CBM_48) 		3 VAL A 686
GLU A 263
GLU A 302
 None
 0.94A 5jsdB-4okdA:
undetectable
5jsdC-4okdA:
undetectable		 5jsdB-4okdA:
24.61
5jsdC-4okdA:
24.61
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.
4p37 PUTATIVE POLY(A)
POLYMERASE CATALYTIC
SUBUNIT

(Megavirus
chiliensis) 		no annotation 3 VAL B 121
GLU B  43
GLU B  48
 None
 0.93A 5jsdB-4p37B:
undetectable
5jsdC-4p37B:
undetectable		 5jsdB-4p37B:
23.22
5jsdC-4p37B:
23.22
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.
4psm SSDNA BINDING
PROTEIN

(Pyrococcus
furiosus) 		PF10015
(DUF2258) 		3 VAL A  61
GLU A 105
GLU A 102
 None
 0.90A 5jsdB-4psmA:
undetectable
5jsdC-4psmA:
undetectable		 5jsdB-4psmA:
12.99
5jsdC-4psmA:
12.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4r9x COPPER HOMEOSTASIS
PROTEIN CUTC

(Bacillus
anthracis) 		PF03932
(CutC) 		3 VAL A 179
GLU A  24
GLU A   3
 None
 0.95A 5jsdB-4r9xA:
undetectable
5jsdC-4r9xA:
undetectable		 5jsdB-4r9xA:
15.19
5jsdC-4r9xA:
15.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rco PUTATIVE
UNCHARACTERIZED
PROTEIN

(Staphylococcus
aureus) 		PF02876
(Stap_Strp_tox_C)
PF09199
(SSL_OB) 		3 VAL A 209
GLU A 133
GLU A 244
 None
 0.94A 5jsdB-4rcoA:
undetectable
5jsdC-4rcoA:
undetectable		 5jsdB-4rcoA:
19.01
5jsdC-4rcoA:
19.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4wj3 ASPARTYL/GLUTAMYL-TR
NA(ASN/GLN)
AMIDOTRANSFERASE
SUBUNIT B

(Pseudomonas
aeruginosa) 		PF02637
(GatB_Yqey)
PF02934
(GatB_N) 		3 VAL B 319
GLU B 325
GLU B 363
 None
 0.91A 5jsdB-4wj3B:
undetectable
5jsdC-4wj3B:
undetectable		 5jsdB-4wj3B:
18.39
5jsdC-4wj3B:
18.39
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.
4xgc ORIGIN RECOGNITION
COMPLEX SUBUNIT 4
ORIGIN RECOGNITION
COMPLEX SUBUNIT 5

(Drosophila
melanogaster) 		PF13191
(AAA_16)
PF14629
(ORC4_C)
PF14630
(ORC5_C) 		3 VAL D 327
GLU E  20
GLU E  24
 None
 0.81A 5jsdB-4xgcD:
undetectable
5jsdC-4xgcD:
undetectable		 5jsdB-4xgcD:
20.50
5jsdC-4xgcD:
20.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xzc NUCLEOPROTEIN

(Nairobi sheep
disease
orthonairovirus) 		PF02477
(Nairo_nucleo) 		3 VAL A 233
GLU A 119
GLU A 121
 None
 0.83A 5jsdB-4xzcA:
undetectable
5jsdC-4xzcA:
undetectable		 5jsdB-4xzcA:
23.15
5jsdC-4xzcA:
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.
5d0f UNCHARACTERIZED
PROTEIN

([Candida]
glabrata) 		PF06202
(GDE_C)
PF14699
(hGDE_N)
PF14701
(hDGE_amylase)
PF14702
(hGDE_central) 		3 VAL A 979
GLU A 632
GLU A 648
 None
 0.74A 5jsdB-5d0fA:
undetectable
5jsdC-5d0fA:
1.1		 5jsdB-5d0fA:
18.95
5jsdC-5d0fA:
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.
5fg3 PROBABLE TRANSLATION
INITIATION FACTOR
IF-2

(Aeropyrum
pernix) 		PF00009
(GTP_EFTU)
PF03144
(GTP_EFTU_D2)
PF11987
(IF-2)
PF14578
(GTP_EFTU_D4) 		3 VAL A 104
GLU A 381
GLU A 377
 None
 0.69A 5jsdB-5fg3A:
undetectable
5jsdC-5fg3A:
undetectable		 5jsdB-5fg3A:
20.79
5jsdC-5fg3A:
20.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5gp0 NUDIX HYDROLASE 1

(Arabidopsis
thaliana) 		no annotation 3 VAL E  12
GLU E 107
GLU E  59
 None
 0.93A 5jsdB-5gp0E:
undetectable
5jsdC-5gp0E:
undetectable		 5jsdB-5gp0E:
11.28
5jsdC-5gp0E:
11.28
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.
5gvb WD REPEAT AND
HMG-BOX DNA-BINDING
PROTEIN 1

(Homo sapiens) 		PF12341
(Mcl1_mid) 		3 VAL A 782
GLU A 822
GLU A 818
 None
 0.88A 5jsdB-5gvbA:
undetectable
5jsdC-5gvbA:
undetectable		 5jsdB-5gvbA:
20.65
5jsdC-5gvbA:
20.65
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.
5gzs GGDEF FAMILY PROTEIN

(Vibrio cholerae) 		PF00497
(SBP_bac_3) 		3 VAL A  90
GLU A 163
GLU A 165
 None
 0.94A 5jsdB-5gzsA:
undetectable
5jsdC-5gzsA:
undetectable		 5jsdB-5gzsA:
18.74
5jsdC-5gzsA:
18.74
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.
5h12 DEEP VENT DNA
POLYMERASE

(Pyrococcus) 		PF00136
(DNA_pol_B)
PF03104
(DNA_pol_B_exo1) 		3 VAL A 644
GLU A 731
GLU A 735
 None
 0.92A 5jsdB-5h12A:
undetectable
5jsdC-5h12A:
2.0		 5jsdB-5h12A:
21.76
5jsdC-5h12A:
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.
5hfi UNCHARACTERIZED
PROTEIN, CYTOSOLIC
DISULFIDE REDUCTASE
DSBM

(Pseudomonas
aeruginosa) 		PF01323
(DSBA) 		3 VAL A 122
GLU A 135
GLU A 139
 VAL  A 122 ( 0.6A)
GLU  A 135 ( 0.6A)
GLU  A 139 ( 0.6A)
 0.82A 5jsdB-5hfiA:
undetectable
5jsdC-5hfiA:
undetectable		 5jsdB-5hfiA:
15.74
5jsdC-5hfiA:
15.74
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.
5jxk ASP/GLU-SPECIFIC
DIPEPTIDYL-PEPTIDASE

(Porphyromonas
endodontalis) 		PF10459
(Peptidase_S46) 		3 VAL A 308
GLU A 405
GLU A 450
 None
 0.78A 5jsdB-5jxkA:
undetectable
5jsdC-5jxkA:
undetectable		 5jsdB-5jxkA:
20.74
5jsdC-5jxkA:
20.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5k3j ACYL-COENZYME A
OXIDASE

(Caenorhabditis
elegans) 		PF01756
(ACOX)
PF02770
(Acyl-CoA_dh_M)
PF14749
(Acyl-CoA_ox_N) 		3 VAL A 328
GLU A  17
GLU A  16
 None
 0.84A 5jsdB-5k3jA:
undetectable
5jsdC-5k3jA:
undetectable		 5jsdB-5k3jA:
21.58
5jsdC-5k3jA:
21.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5k6o B-GLUCOSIDASE

(metagenome) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		3 VAL A 180
GLU A 115
GLU A 160
 None
 0.77A 5jsdB-5k6oA:
undetectable
5jsdC-5k6oA:
undetectable		 5jsdB-5k6oA:
21.82
5jsdC-5k6oA:
21.82
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.
5m10 CYCLOHEXANONE
MONOOXYGENASE FROM
THERMOCRISPUM
MUNICIPALE

(Thermocrispum
municipale) 		PF07992
(Pyr_redox_2) 		3 VAL A 241
GLU A 446
GLU A 442
 None
 0.90A 5jsdB-5m10A:
undetectable
5jsdC-5m10A:
undetectable		 5jsdB-5m10A:
22.68
5jsdC-5m10A:
22.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5n0c TETANUS TOXIN

(Clostridium
tetani) 		PF01742
(Peptidase_M27)
PF07951
(Toxin_R_bind_C)
PF07952
(Toxin_trans)
PF07953
(Toxin_R_bind_N) 		3 VAL A 494
GLU A 717
GLU A 713
 None
 0.94A 5jsdB-5n0cA:
undetectable
5jsdC-5n0cA:
undetectable		 5jsdB-5n0cA:
21.67
5jsdC-5n0cA:
21.67
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.
5odo ISOMERASE

(Rhodococcus
erythropolis) 		no annotation 3 VAL A 512
GLU A 157
GLU A 160
 None
 0.84A 5jsdB-5odoA:
undetectable
5jsdC-5odoA:
undetectable		 5jsdB-5odoA:
23.17
5jsdC-5odoA:
23.17
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.
5t0h 26S PROTEASOME
NON-ATPASE
REGULATORY SUBUNIT 2

(Homo sapiens) 		PF00004
(AAA) 		3 VAL f 450
GLU f 422
GLU f 465
 None
 0.73A 5jsdB-5t0hf:
undetectable
5jsdC-5t0hf:
undetectable		 5jsdB-5t0hf:
22.00
5jsdC-5t0hf:
22.00
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.
5u0s MEDIATOR COMPLEX
SUBUNIT 18
MEDIATOR COMPLEX
SUBUNIT 8

(Schizosaccharomyces
pombe) 		PF09637
(Med18)
PF10232
(Med8) 		3 VAL R  18
GLU H 180
GLU H 181
 None
 0.79A 5jsdB-5u0sR:
undetectable
5jsdC-5u0sR:
undetectable		 5jsdB-5u0sR:
14.74
5jsdC-5u0sR:
14.74
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.
5u1b MTRE
PROTEIN,FERRITIN
CHIMERA

(Helicobacter
pylori;
Neisseria
gonorrhoeae) 		no annotation 3 VAL A 124
GLU A  50
GLU A  17
 None
 0.91A 5jsdB-5u1bA:
undetectable
5jsdC-5u1bA:
undetectable		 5jsdB-5u1bA:
14.05
5jsdC-5u1bA:
14.05
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.
5u22 N2152

(Neocallimastix
frontalis) 		PF01229
(Glyco_hydro_39) 		3 VAL A  74
GLU A 110
GLU A 151
 None
 0.92A 5jsdB-5u22A:
undetectable
5jsdC-5u22A:
undetectable		 5jsdB-5u22A:
24.60
5jsdC-5u22A:
24.60
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.
5uju NAD-DEPENDENT
ALDEHYDE
DEHYDROGENASE

(Burkholderia
multivorans) 		PF00171
(Aldedh) 		3 VAL A 438
GLU A 474
GLU A 470
 None
 0.91A 5jsdB-5ujuA:
undetectable
5jsdC-5ujuA:
undetectable		 5jsdB-5ujuA:
22.03
5jsdC-5ujuA:
22.03
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.
5uxv SENSORY TRANSDUCTION
REGULATORY PROTEIN

(Bartonella
quintana) 		no annotation 3 VAL A 237
GLU A 148
GLU A 146
 None
 0.85A 5jsdB-5uxvA:
undetectable
5jsdC-5uxvA:
undetectable		 5jsdB-5uxvA:
8.79
5jsdC-5uxvA:
8.79
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.
5wug BETA-GLUCOSIDASE

(Paenibacillus
barengoltzii) 		no annotation 3 VAL A 205
GLU A 140
GLU A 185
 None
 0.77A 5jsdB-5wugA:
undetectable
5jsdC-5wugA:
0.6		 5jsdB-5wugA:
9.32
5jsdC-5wugA:
9.32
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.
5x9u THERMOSOME, ALPHA
SUBUNIT

(Carboxydothermus
hydrogenoformans) 		no annotation 3 VAL A 429
GLU A 421
GLU A 102
 None
 0.79A 5jsdB-5x9uA:
undetectable
5jsdC-5x9uA:
undetectable		 5jsdB-5x9uA:
21.88
5jsdC-5x9uA:
21.88
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.
5yjj POLYRIBONUCLEOTIDE
NUCLEOTIDYLTRANSFERA
SE

(Staphylococcus
epidermidis) 		no annotation 3 VAL A   7
GLU A 332
GLU A 334
 None
 0.59A 5jsdB-5yjjA:
undetectable
5jsdC-5yjjA:
1.0		 5jsdB-5yjjA:
10.22
5jsdC-5yjjA:
10.22
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.
5zvs PUTATIVE CORE
PROTEIN NTPASE/VP5

(Aquareovirus C) 		no annotation 3 VAL 4 631
GLU 4 649
GLU 4 713
 None
 0.87A 5jsdB-5zvs4:
undetectable
5jsdC-5zvs4:
undetectable		 5jsdB-5zvs4:
10.33
5jsdC-5zvs4:
10.33
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.
6amn HEAT SHOCK PROTEIN
104

(Saccharomyces
cerevisiae) 		no annotation 3 VAL A 345
GLU A 191
GLU A 192
 None
 0.91A 5jsdB-6amnA:
undetectable
5jsdC-6amnA:
undetectable		 5jsdB-6amnA:
6.82
5jsdC-6amnA:
6.82
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.
6b4m MONOTREME LACTATION
PROTEIN

(Ornithorhynchus
anatinus) 		no annotation 3 VAL A 153
GLU A 174
GLU A 173
 GOL  A 404 (-4.7A)
None
None
 0.95A 5jsdB-6b4mA:
undetectable
5jsdC-6b4mA:
undetectable		 5jsdB-6b4mA:
8.12
5jsdC-6b4mA:
8.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6c66 CRISPR-ASSOCIATED
PROTEIN, CSE1 FAMILY

(Thermobifida
fusca) 		no annotation 3 VAL A 485
GLU A 411
GLU A 406
 None
 0.72A 5jsdB-6c66A:
undetectable
5jsdC-6c66A:
undetectable		 5jsdB-6c66A:
6.60
5jsdC-6c66A:
6.60
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.
6cfw MEMBRANE-BOUND
HYDROGENASE SUBUNIT
ALPHA

(Pyrococcus
furiosus) 		no annotation 3 VAL L 365
GLU L  21
GLU L  20
 None
 0.92A 5jsdB-6cfwL:
undetectable
5jsdC-6cfwL:
undetectable		 5jsdB-6cfwL:
7.76
5jsdC-6cfwL:
7.76
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.
6d0n CLC-TYPE
FLUORIDE/PROTON
ANTIPORTER

(Enterococcus
casseliflavus) 		no annotation 3 VAL A  82
GLU A 318
GLU A 118
 None
 0.66A 5jsdB-6d0nA:
undetectable
5jsdC-6d0nA:
undetectable		 5jsdB-6d0nA:
9.16
5jsdC-6d0nA:
9.16
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.
6exv DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB2

(Sus scrofa) 		no annotation 3 VAL B 207
GLU B 611
GLU B 609
 None
 0.92A 5jsdB-6exvB:
undetectable
5jsdC-6exvB:
undetectable		 5jsdB-6exvB:
7.56
5jsdC-6exvB:
7.56