SIMILAR PATTERNS OF AMINO ACIDS FOR 4OBW_D_SAMD601

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.
1aor ALDEHYDE FERREDOXIN
OXIDOREDUCTASE

(Pyrococcus
furiosus) 		PF01314
(AFOR_C)
PF02730
(AFOR_N) 		5 ALA A 174
GLY A 188
ILE A 163
GLY A 341
ARG A 392
 None
 1.07A 4obwD-1aorA:
undetectable		 4obwD-1aorA:
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.
1b25 PROTEIN
(FORMALDEHYDE
FERREDOXIN
OXIDOREDUCTASE)

(Pyrococcus
furiosus) 		PF01314
(AFOR_C)
PF02730
(AFOR_N) 		5 ALA A 172
GLY A 186
ILE A 161
GLY A 336
ARG A 380
 None
 1.07A 4obwD-1b25A:
undetectable		 4obwD-1b25A:
18.99
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.
1bxz NADP-DEPENDENT
ALCOHOL
DEHYDROGENASE

(Thermoanaerobacter
brockii) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 ALA A 242
GLY A 174
ILE A 240
GLY A 155
ASN A 264
 None
 1.11A 4obwD-1bxzA:
6.9		 4obwD-1bxzA:
22.07
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.
1ehi D-ALANINE:D-LACTATE
LIGASE

(Leuconostoc
mesenteroides) 		PF01820
(Dala_Dala_lig_N)
PF07478
(Dala_Dala_lig_C) 		5 LYS A 116
ALA A 125
GLY A 124
ARG A 128
ASN A 295
 None
 1.27A 4obwD-1ehiA:
undetectable		 4obwD-1ehiA:
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.
1hme HIGH MOBILITY GROUP
PROTEIN FRAGMENT-B

(Rattus
norvegicus) 		PF00505
(HMG_box) 		5 ALA A  38
GLY A  35
ASN A  46
GLY A  42
PHE A  14
 None
 1.24A 4obwD-1hmeA:
undetectable		 4obwD-1hmeA:
16.53
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.
1ig0 THIAMIN
PYROPHOSPHOKINASE

(Saccharomyces
cerevisiae) 		PF04263
(TPK_catalytic)
PF04265
(TPK_B1_binding) 		5 TYR A 109
ALA A  71
GLY A  70
ILE A  48
GLY A 190
 None
 0.95A 4obwD-1ig0A:
undetectable		 4obwD-1ig0A:
20.24
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.
1mw7 HYPOTHETICAL PROTEIN
HP0162

(Helicobacter
pylori) 		PF01709
(Transcrip_reg) 		5 ALA A 119
GLY A 118
ILE A 121
GLY A  85
ARG A 225
 None
 1.13A 4obwD-1mw7A:
undetectable		 4obwD-1mw7A:
22.74
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.
1ofu CELL DIVISION
PROTEIN FTSZ

(Pseudomonas
aeruginosa) 		PF00091
(Tubulin)
PF12327
(FtsZ_C) 		5 ALA A  49
ILE A  53
ASN A  52
ASN A  28
GLY A  24
 None
 1.28A 4obwD-1ofuA:
4.6		 4obwD-1ofuA:
22.96
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.
1q8f PYRIMIDINE
NUCLEOSIDE HYDROLASE

(Escherichia
coli) 		PF01156
(IU_nuc_hydro) 		5 ALA A 153
GLY A 188
ILE A 167
ASN A 166
MET A 150
 None
None
None
GOL  A3001 (-3.3A)
GOL  A3001 (-3.4A)
 1.24A 4obwD-1q8fA:
3.0		 4obwD-1q8fA:
21.91
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.
1qle CYTOCHROME C OXIDASE
POLYPEPTIDE I-BETA
CYTOCHROME C OXIDASE
POLYPEPTIDE II

(Paracoccus
denitrificans;
Paracoccus
denitrificans) 		PF00115
(COX1)
PF00116
(COX2)
PF02790
(COX2_TM) 		5 GLY A 467
ASN B  15
GLY B  16
ARG A  54
ASN A 486
 None
None
None
HEA  A 601 (-3.1A)
None
 1.14A 4obwD-1qleA:
undetectable		 4obwD-1qleA:
20.99
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.
1rzv GLYCOGEN SYNTHASE 1

(Agrobacterium
tumefaciens) 		PF00534
(Glycos_transf_1)
PF08323
(Glyco_transf_5) 		5 TYR A 472
ALA A 465
GLY A 466
ASN A 246
GLY A 247
 None
 1.02A 4obwD-1rzvA:
3.0		 4obwD-1rzvA:
19.88
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.
1t3q QUINOLINE
2-OXIDOREDUCTASE
SMALL SUBUNIT

(Pseudomonas
putida) 		PF00111
(Fer2)
PF01799
(Fer2_2) 		5 ALA A  14
GLY A  77
ILE A  16
ARG A  11
PHE A  23
 None
 1.29A 4obwD-1t3qA:
undetectable		 4obwD-1t3qA:
24.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1t3q QUINOLINE
2-OXIDOREDUCTASE
SMALL SUBUNIT
QUINOLINE
2-OXIDOREDUCTASE
LARGE SUBUNIT

(Pseudomonas
putida;
Pseudomonas
putida) 		PF00111
(Fer2)
PF01799
(Fer2_2)
PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2) 		5 ALA B 684
GLY B 681
ILE B 713
GLY B 688
ARG A 134
 None
 1.21A 4obwD-1t3qB:
undetectable		 4obwD-1t3qB:
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.
1u11 PURE
(N5-CARBOXYAMINOIMID
AZOLE RIBONUCLEOTIDE
MUTASE)

(Acetobacter
aceti) 		PF00731
(AIRC) 		5 ALA A 140
GLY A 139
ILE A  81
GLY A  83
ARG A  38
 None
 1.31A 4obwD-1u11A:
undetectable		 4obwD-1u11A:
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.
1ukf AVIRULENCE PROTEIN
AVRPPH3

(Pseudomonas
savastanoi) 		PF03543
(Peptidase_C58) 		5 ALA A  99
ILE A  97
ASN A  96
GLY A 131
ASN A 139
 None
 1.21A 4obwD-1ukfA:
undetectable		 4obwD-1ukfA:
24.62
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.
1uwy CARBOXYPEPTIDASE M

(Homo sapiens) 		PF00246
(Peptidase_M14)
PF13620
(CarboxypepD_reg) 		5 ALA A 176
GLY A 175
ASN A 227
ASN A 230
PHE A 231
 None
 1.31A 4obwD-1uwyA:
undetectable		 4obwD-1uwyA:
20.96
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.
1v0z NEURAMINIDASE

(Influenza A
virus) 		PF00064
(Neur) 		5 ALA A 208
GLY A 203
ILE A 229
ASN A 228
GLY A 227
 None
 1.32A 4obwD-1v0zA:
undetectable		 4obwD-1v0zA:
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.
1v3t LEUKOTRIENE B4
12-HYDROXYDEHYDROGEN
ASE/PROSTAGLANDIN
15-KETO REDUCTASE

(Cavia porcellus) 		PF00107
(ADH_zinc_N)
PF16884
(ADH_N_2) 		5 TYR A 214
ALA A 172
GLY A 171
ASN A 217
GLY A 174
 None
None
None
NAP  A1350 (-3.9A)
NAP  A1350 (-3.2A)
 0.88A 4obwD-1v3tA:
5.6		 4obwD-1v3tA:
24.79
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.
1ve3 HYPOTHETICAL PROTEIN
PH0226

(Pyrococcus
horikoshii) 		PF13649
(Methyltransf_25) 		5 TYR A   7
ALA A  46
ILE A  68
MET A  72
PHE A 116
 SAM  A 302 (-4.6A)
SAM  A 302 (-3.4A)
SAM  A 302 (-3.7A)
SAM  A 302 (-3.9A)
SAM  A 302 (-4.4A)
 1.23A 4obwD-1ve3A:
18.1		 4obwD-1ve3A:
24.36
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.
1xf1 C5A PEPTIDASE

(Streptococcus
pyogenes) 		PF00082
(Peptidase_S8)
PF02225
(PA)
PF06280
(fn3_5)
PF13585
(CHU_C) 		5 LYS A 579
ALA A 572
GLY A 573
ILE A 485
ASN A 484
 None
 1.30A 4obwD-1xf1A:
undetectable		 4obwD-1xf1A:
13.11
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.
1ydx TYPE I RESTRICTION
ENZYME SPECIFICITY
PROTEIN MG438

(Mycoplasma
genitalium) 		PF01420
(Methylase_S) 		5 ALA A 234
GLY A 235
ASN A 273
GLY A 274
ASN A 257
 None
 1.26A 4obwD-1ydxA:
undetectable		 4obwD-1ydxA:
25.24
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.
1zem XYLITOL
DEHYDROGENASE

(Gluconobacter
oxydans) 		PF13561
(adh_short_C2) 		5 TYR A 157
GLY A  93
ILE A  19
GLY A  17
ARG A 198
 NAD  A2263 (-4.4A)
NAD  A2263 (-3.6A)
NAD  A2263 (-3.8A)
NAD  A2263 (-3.1A)
None
 1.07A 4obwD-1zemA:
6.6		 4obwD-1zemA:
19.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2c0l PEROXISOMAL
TARGETING SIGNAL 1
RECEPTOR
NONSPECIFIC
LIPID-TRANSFER
PROTEIN

(Homo sapiens;
Homo sapiens) 		PF00515
(TPR_1)
PF13432
(TPR_16)
PF02036
(SCP2) 		5 GLY B 139
ILE A 567
GLY A 563
ARG A 608
PHE A 579
 None
 1.11A 4obwD-2c0lB:
undetectable		 4obwD-2c0lB:
18.68
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.
2e54 ACETYLORNITHINE
AMINOTRANSFERASE

(Thermotoga
maritima) 		PF00202
(Aminotran_3) 		5 ALA A 239
GLY A  94
ILE A 248
ASN A  92
GLY A 241
 PLP  A1001 ( 4.9A)
PLP  A1001 (-3.4A)
None
None
None
 1.32A 4obwD-2e54A:
2.5		 4obwD-2e54A:
23.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fff PENICILLIN-BINDING
PROTEIN 1B

(Streptococcus
pneumoniae) 		PF00905
(Transpeptidase) 		5 ALA B 471
GLY B 469
MET B 616
ASN B 759
GLY B 475
 None
 1.26A 4obwD-2fffB:
undetectable		 4obwD-2fffB:
20.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2htv NEURAMINIDASE

(Influenza A
virus) 		PF00064
(Neur) 		5 ALA A 201
GLY A 196
ILE A 222
ASN A 221
GLY A 220
 None
 1.21A 4obwD-2htvA:
undetectable		 4obwD-2htvA:
22.11
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.
2i3o GAMMA-GLUTAMYLTRANSF
ERASE RELATED
PROTEIN

(Thermoplasma
acidophilum) 		PF01019
(G_glu_transpept) 		5 GLY A  79
ILE A 112
GLY A  58
ARG A 201
PHE A 203
 None
 1.10A 4obwD-2i3oA:
undetectable		 4obwD-2i3oA:
18.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jft SER-THR PHOSPHATASE
MSPP

(Mycolicibacterium
smegmatis) 		PF13672
(PP2C_2) 		5 ALA A 158
GLY A 110
ILE A 165
ASN A  73
GLY A 160
 None
 1.22A 4obwD-2jftA:
undetectable		 4obwD-2jftA:
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.
2o1b AMINOTRANSFERASE,
CLASS I

(Staphylococcus
aureus) 		PF00155
(Aminotran_1_2) 		5 TYR A 126
ALA A 202
ASN A 212
GLY A 204
ASN A 172
 None
PLP  A 400 (-3.5A)
None
None
PLP  A 400 (-4.0A)
 1.20A 4obwD-2o1bA:
3.1		 4obwD-2o1bA:
24.69
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.
2oby PUTATIVE QUINONE
OXIDOREDUCTASE

(Homo sapiens) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 ALA A 120
ILE A 326
ASN A 322
GLY A 324
ASN A  40
 None
None
NAP  A1400 (-3.6A)
None
None
 1.24A 4obwD-2obyA:
7.1		 4obwD-2obyA:
23.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pcr INOSITOL-1-MONOPHOSP
HATASE

(Aquifex
aeolicus) 		PF00459
(Inositol_P) 		5 TYR A 127
ALA A 102
ILE A 100
ASN A  93
GLY A  90
 None
 1.09A 4obwD-2pcrA:
undetectable		 4obwD-2pcrA:
23.03
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.
2uvk YJHT

(Escherichia
coli) 		PF01344
(Kelch_1) 		5 ALA A 110
GLY A  73
ASN A  86
ASN A 167
GLY A 125
 None
 1.20A 4obwD-2uvkA:
undetectable		 4obwD-2uvkA:
22.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vaw CELL DIVISION
PROTEIN FTSZ

(Pseudomonas
aeruginosa) 		PF00091
(Tubulin)
PF12327
(FtsZ_C) 		5 ALA A  49
ILE A  53
ASN A  52
ASN A  28
GLY A  24
 None
 1.21A 4obwD-2vawA:
4.4		 4obwD-2vawA:
21.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vun ENAMIDASE

(Eubacterium
barkeri) 		PF01979
(Amidohydro_1) 		5 GLY A  92
ILE A 356
GLY A 358
ARG A 374
ASN A 375
 None
 1.03A 4obwD-2vunA:
undetectable		 4obwD-2vunA:
21.77
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.
2wnb -

(Sus scrofa) 		PF00777
(Glyco_transf_29) 		5 ALA A  91
GLY A 129
ILE A 120
ASN A 117
ASN A  93
 None
 1.25A 4obwD-2wnbA:
undetectable		 4obwD-2wnbA:
20.71
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.
2x05 EXO-BETA-D-GLUCOSAMI
NIDASE

(Amycolatopsis
orientalis) 		PF00703
(Glyco_hydro_2)
PF02837
(Glyco_hydro_2_N) 		5 ALA A 535
GLY A 534
ASN A 634
GLY A 638
ARG A 627
 None
 0.98A 4obwD-2x05A:
undetectable		 4obwD-2x05A:
13.15
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.
2y05 PROSTAGLANDIN
REDUCTASE 1

(Homo sapiens) 		PF00107
(ADH_zinc_N)
PF16884
(ADH_N_2) 		5 TYR A 214
ALA A 172
GLY A 171
ASN A 217
GLY A 174
 None
None
None
NAP  A 701 (-3.8A)
NAP  A 701 (-3.3A)
 0.97A 4obwD-2y05A:
7.3		 4obwD-2y05A:
25.64
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.
2zbl PUTATIVE ISOMERASE

(Salmonella
enterica) 		PF07221
(GlcNAc_2-epim) 		5 ALA A 120
GLY A 119
ILE A  79
ASN A  83
ARG A 132
 None
 1.20A 4obwD-2zblA:
undetectable		 4obwD-2zblA:
19.58
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.
3clk TRANSCRIPTION
REGULATOR

(Lactobacillus
plantarum) 		PF13377
(Peripla_BP_3) 		5 ALA A 184
GLY A 185
ILE A 216
GLY A 182
PHE A 233
 None
 1.06A 4obwD-3clkA:
undetectable		 4obwD-3clkA:
21.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fid PUTATIVE OUTER
MEMBRANE PROTEIN
(LPXR)

(Salmonella
enterica) 		PF09982
(DUF2219) 		5 ALA A 112
GLY A 113
ILE A 108
GLY A 106
ASN A 139
 None
 1.29A 4obwD-3fidA:
undetectable		 4obwD-3fidA:
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.
3fpl NADP-DEPENDENT
ALCOHOL
DEHYDROGENASE

(Clostridium
beijerinckii;
Thermoanaerobacter
brockii) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 ALA A 242
GLY A 174
ILE A 240
GLY A 155
ASN A 264
 None
 1.20A 4obwD-3fplA:
6.8		 4obwD-3fplA:
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.
3fsr NADP-DEPENDENT
ALCOHOL
DEHYDROGENASE

(Clostridium
beijerinckii;
Thermoanaerobacter
brockii) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 LYS A 340
GLY A 176
ILE A 240
GLY A 155
ASN A 266
 None
 1.16A 4obwD-3fsrA:
7.0		 4obwD-3fsrA:
20.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3g5i PYRIMIDINE-SPECIFIC
RIBONUCLEOSIDE
HYDROLASE RIHA

(Escherichia
coli) 		PF01156
(IU_nuc_hydro) 		5 ALA A 153
GLY A 188
ILE A 167
ASN A 166
MET A 150
 None
None
None
DNB  A 502 (-3.4A)
DNB  A 502 (-3.4A)
 1.30A 4obwD-3g5iA:
undetectable		 4obwD-3g5iA:
20.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gjy SPERMIDINE SYNTHASE

(Corynebacterium
glutamicum) 		no annotation 5 ALA A 166
GLY A 167
ILE A  47
ASN A  48
GLY A  96
 None
None
None
None
FMT  A 315 ( 4.2A)
 1.32A 4obwD-3gjyA:
13.4		 4obwD-3gjyA:
23.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hrd NICOTINATE
DEHYDROGENASE MEDIUM
MOLYBDOPTERIN
SUBUNIT

(Eubacterium
barkeri) 		PF02738
(Ald_Xan_dh_C2) 		5 ALA B  25
GLY B 160
ILE B  92
ASN B  95
GLY B  81
 None
 1.21A 4obwD-3hrdB:
undetectable		 4obwD-3hrdB:
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.
3khp MAOC FAMILY PROTEIN

(Mycobacterium
tuberculosis) 		PF01575
(MaoC_dehydratas)
PF13452
(MaoC_dehydrat_N) 		5 ALA A  67
GLY A  65
GLY A  71
ASN A  74
PHE A  73
 None
 1.07A 4obwD-3khpA:
undetectable		 4obwD-3khpA:
24.01
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.
3l8k DIHYDROLIPOYL
DEHYDROGENASE

(Sulfolobus
solfataricus) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 ALA A  13
GLY A 305
ILE A 135
MET A 294
GLY A   9
 ADP  A 465 (-3.2A)
ADP  A 465 (-3.3A)
None
None
ADP  A 465 (-3.4A)
 1.22A 4obwD-3l8kA:
undetectable		 4obwD-3l8kA:
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.
3r0z D-SERINE DEHYDRATASE

(Salmonella
enterica) 		PF00291
(PALP) 		5 ALA A 117
GLY A 119
ILE A 111
GLY A 113
ARG A 252
 None
 1.31A 4obwD-3r0zA:
undetectable		 4obwD-3r0zA:
19.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tsd INOSINE-5'-MONOPHOSP
HATE DEHYDROGENASE

(Bacillus
anthracis) 		PF00478
(IMPDH)
PF00571
(CBS) 		5 ALA A 295
GLY A 294
ILE A 277
ASN A 275
GLY A 279
 None
 1.05A 4obwD-3tsdA:
undetectable		 4obwD-3tsdA:
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.
3wtb PUTATIVE
OXIDOREDUCTASE

(Gluconobacter
oxydans) 		PF13561
(adh_short_C2) 		5 TYR A 135
ALA A 167
GLY A 232
ILE A 175
GLY A 171
 None
 1.18A 4obwD-3wtbA:
6.3		 4obwD-3wtbA:
24.13
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.
3zu0 NAD NUCLEOTIDASE

(Haemophilus
influenzae) 		PF00149
(Metallophos)
PF02872
(5_nucleotid_C) 		5 LYS A 545
ALA A 131
GLY A 132
GLY A 106
PHE A 102
 None
 1.31A 4obwD-3zu0A:
undetectable		 4obwD-3zu0A:
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.
4aip FE-REGULATED PROTEIN
B

(Neisseria
meningitidis) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		5 ALA A 162
GLY A 161
ASN A 482
ASN A 536
GLY A 152
 None
 1.08A 4obwD-4aipA:
undetectable		 4obwD-4aipA:
15.99
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.
4aip FE-REGULATED PROTEIN
B

(Neisseria
meningitidis) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		5 ALA A 593
GLY A 592
ASN A 542
ARG A 596
PHE A 548
 None
 1.19A 4obwD-4aipA:
undetectable		 4obwD-4aipA:
15.99
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.
4cak INTEGRIN ALPHA-IIB
INTEGRIN BETA-3

(Homo sapiens;
Homo sapiens) 		PF01839
(FG-GAP)
PF08441
(Integrin_alpha2)
PF00362
(Integrin_beta)
PF07965
(Integrin_B_tail)
PF07974
(EGF_2)
PF17205
(PSI_integrin) 		5 ALA B 252
ILE B 516
ASN B 316
MET A 285
GLY B 518
 None
None
NAG  B3320 (-4.6A)
NAG  B3320 (-3.6A)
None
 1.21A 4obwD-4cakB:
undetectable		 4obwD-4cakB:
14.51
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.
4gc5 DIMETHYLADENOSINE
TRANSFERASE 1,
MITOCHONDRIAL

(Mus musculus) 		PF00398
(RrnaAD) 		5 GLY A 168
ILE A 125
ASN A 135
ASN A 124
GLY A 123
 None
 1.22A 4obwD-4gc5A:
11.1		 4obwD-4gc5A:
22.66
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.
4jrm 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 2

(Vibrio cholerae) 		no annotation 5 LYS D 337
GLY D 345
ILE D 105
ASN D 170
GLY D  78
 None
 1.32A 4obwD-4jrmD:
undetectable		 4obwD-4jrmD:
20.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ktp GLYCOSIDE HYDROLASE
FAMILY 65 CENTRAL
CATALYTIC

([Bacillus]
selenitireducens) 		PF03632
(Glyco_hydro_65m)
PF03633
(Glyco_hydro_65C)
PF03636
(Glyco_hydro_65N) 		5 ALA A 633
ILE A 631
GLY A 685
ARG A 644
ASN A 645
 None
 1.20A 4obwD-4ktpA:
undetectable		 4obwD-4ktpA:
15.58
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.
4l4y TRANSCRIPTIONAL
REGULATOR LSRR

(Escherichia
coli) 		PF04198
(Sugar-bind) 		5 TYR A 156
GLY A 125
ILE A 207
MET A 129
GLY A 281
 None
 1.24A 4obwD-4l4yA:
5.0		 4obwD-4l4yA:
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.
4mag SIALIC ACID BINDING
PROTEIN

(Vibrio cholerae) 		PF03480
(DctP) 		5 LYS A 150
ALA A  77
GLY A  71
GLY A 101
PHE A 100
 None
 1.23A 4obwD-4magA:
undetectable		 4obwD-4magA:
23.49
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.
4mi4 SPERMIDINE
N1-ACETYLTRANSFERASE

(Vibrio cholerae) 		PF13302
(Acetyltransf_3) 		5 ALA A  90
ILE A  88
GLY A  69
ASN A  20
PHE A  17
 None
 1.00A 4obwD-4mi4A:
undetectable		 4obwD-4mi4A:
22.71
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.
4o6r ALDEHYDE
DEHYDROGENASE

(Burkholderia
cenocepacia) 		PF00171
(Aldedh) 		5 ALA A 189
GLY A 192
GLY A   9
ARG A 183
PHE A   6
 None
 1.21A 4obwD-4o6rA:
4.0		 4obwD-4o6rA:
19.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4o6r ALDEHYDE
DEHYDROGENASE

(Burkholderia
cenocepacia) 		PF00171
(Aldedh) 		5 TYR A 111
ALA A 116
GLY A 113
ASN A 167
GLY A 166
 None
 1.31A 4obwD-4o6rA:
4.0		 4obwD-4o6rA:
19.96
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4obw 2-METHOXY-6-POLYPREN
YL-1,4-BENZOQUINOL
METHYLASE,
MITOCHONDRIAL

(Saccharomyces
cerevisiae) 		PF01209
(Ubie_methyltran) 		6 TYR A  78
GLY A 121
ILE A 149
ASN A 179
GLY A 180
ASN A 202
 SAM  A 602 (-3.9A)
None
SAM  A 602 (-3.8A)
SAM  A 602 (-3.7A)
SAM  A 602 (-3.5A)
SAM  A 602 ( 4.9A)
 0.97A 4obwD-4obwA:
41.0		 4obwD-4obwA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4obw 2-METHOXY-6-POLYPREN
YL-1,4-BENZOQUINOL
METHYLASE,
MITOCHONDRIAL

(Saccharomyces
cerevisiae) 		PF01209
(Ubie_methyltran) 		12 TYR A  78
LYS A  94
ALA A 119
GLY A 120
ILE A 149
ASN A 150
MET A 153
ASN A 179
GLY A 180
ARG A 201
ASN A 202
PHE A 203
 SAM  A 602 (-3.9A)
SAM  A 602 (-3.3A)
SAM  A 602 (-3.2A)
SAM  A 602 (-3.4A)
SAM  A 602 (-3.8A)
SAM  A 602 (-4.9A)
SAM  A 602 (-3.7A)
SAM  A 602 (-3.7A)
SAM  A 602 (-3.5A)
None
SAM  A 602 ( 4.9A)
SAM  A 602 (-3.9A)
 0.26A 4obwD-4obwA:
41.0		 4obwD-4obwA:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qn3 NEURAMINIDASE

(Influenza A
virus) 		PF00064
(Neur) 		5 ALA A 120
GLY A 115
ILE A 141
ASN A 140
GLY A 139
 None
 1.32A 4obwD-4qn3A:
undetectable		 4obwD-4qn3A:
20.75
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.
4r8e 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 2

(Yersinia pestis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 ALA A  79
GLY A  81
MET A 237
ASN A  18
PHE A  56
 None
 1.07A 4obwD-4r8eA:
undetectable		 4obwD-4r8eA:
23.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rdc AMINO ACID/AMIDE ABC
TRANSPORTER
SUBSTRATE-BINDING
PROTEIN, HAAT FAMILY

(Trichormus
variabilis) 		PF13458
(Peripla_BP_6) 		5 ALA A 167
GLY A 389
ILE A 159
ASN A 154
GLY A 151
 None
MG  A 502 ( 4.4A)
None
None
None
 1.05A 4obwD-4rdcA:
undetectable		 4obwD-4rdcA:
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.
4tn3 TRIM5/CYCLOPHILIN A
FUSION PROTEIN/T4
LYSOZYME CHIMERA

(Macaca mulatta;
Escherichia
virus T4) 		PF00643
(zf-B_box)
PF00959
(Phage_lysozyme) 		5 TYR A 464
ILE A 306
MET A 304
ASN A 404
PHE A 407
 None
 1.30A 4obwD-4tn3A:
undetectable		 4obwD-4tn3A:
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.
4u48 PUTATIVE INNER
MEMBRANE LIPOPROTEIN

(Salmonella
enterica) 		PF00207
(A2M)
PF01835
(A2M_N)
PF07703
(A2M_N_2)
PF10569
(Thiol-ester_cl)
PF11974
(MG1) 		5 TYR A1615
ALA A1081
GLY A1025
ILE A1113
GLY A1088
 None
 1.31A 4obwD-4u48A:
undetectable		 4obwD-4u48A:
10.25
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.
4wr2 PYRIMIDINE-SPECIFIC
RIBONUCLEOSIDE
HYDROLASE RIHA

(Shewanella
loihica) 		PF01156
(IU_nuc_hydro) 		5 ALA A 199
GLY A 234
ILE A 213
ASN A 212
MET A 196
 1PE  A 402 ( 4.4A)
None
None
CA  A 401 ( 4.4A)
None
 1.26A 4obwD-4wr2A:
undetectable		 4obwD-4wr2A:
21.92
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.
4wva UNCHARACTERIZED
PROTEIN

(Thermus
thermophilus) 		PF01204
(Trehalase) 		5 ALA A 412
ILE A  39
GLY A  42
ARG A  14
ASN A  15
 None
 1.07A 4obwD-4wvaA:
undetectable		 4obwD-4wvaA:
22.77
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.
4z3y BENZOYL-COA
REDUCTASE, PUTATIVE

(Geobacter
metallireducens) 		PF01314
(AFOR_C)
PF02730
(AFOR_N) 		5 ALA A 175
GLY A 188
ILE A 164
GLY A 350
ARG A 398
 None
 1.07A 4obwD-4z3yA:
undetectable		 4obwD-4z3yA:
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.
4z9r OMEGA-3
POLYUNSATURATED
FATTY ACID SYNTHASE
SUBUNIT PFAD

(Shewanella
oneidensis) 		PF03060
(NMO) 		5 LYS A 294
ALA A 311
GLY A 310
ILE A 315
GLY A 313
 None
None
None
None
FMN  A 602 (-3.4A)
 1.00A 4obwD-4z9rA:
undetectable		 4obwD-4z9rA:
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.
5b04 TRANSLATION
INITIATION FACTOR
EIF-2B SUBUNIT ALPHA

(Schizosaccharomyces
pombe) 		PF01008
(IF-2B) 		5 ALA A  81
GLY A  82
ILE A  77
ASN A  76
GLY A 213
 None
 1.07A 4obwD-5b04A:
4.8		 4obwD-5b04A:
20.86
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.
5c5g SPHERULIN-4

(Aspergillus
clavatus) 		PF12138
(Spherulin4) 		5 TYR A 131
ALA A 128
ASN A 202
ASN A  93
GLY A  97
 None
None
EDO  A 401 (-3.3A)
None
None
 1.04A 4obwD-5c5gA:
undetectable		 4obwD-5c5gA:
21.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5e84 78 KDA
GLUCOSE-REGULATED
PROTEIN

(Homo sapiens) 		PF00012
(HSP70) 		5 GLY A 216
ILE A 220
ASN A 219
GLY A 210
PHE A 242
 None
 1.24A 4obwD-5e84A:
undetectable		 4obwD-5e84A:
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.
5e9u GLYCOSYLTRANSFERASE-
STABILIZING PROTEIN
GTF2

(Streptococcus
gordonii) 		no annotation 5 TYR B 354
GLY B 379
ILE B 297
ASN B 358
GLY B 299
 None
 1.21A 4obwD-5e9uB:
undetectable		 4obwD-5e9uB:
18.98
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.
5emi CELL WALL
HYDROLASE/AUTOLYSIN

(Nostoc
punctiforme) 		PF01520
(Amidase_3) 		5 ALA A 454
GLY A 453
ASN A 588
GLY A 456
ASN A 517
 None
 1.28A 4obwD-5emiA:
undetectable		 4obwD-5emiA:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5eyw TRIOSEPHOSPHATE
ISOMERASE

(Litopenaeus
vannamei) 		PF00121
(TIM) 		5 ALA A  64
ILE A  93
ASN A  12
GLY A  43
ASN A  66
 None
None
PGA  A 301 (-4.1A)
None
None
 1.24A 4obwD-5eywA:
undetectable		 4obwD-5eywA:
21.17
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.
5fse UREASE SUBUNIT ALPHA

(Sporosarcina
pasteurii) 		PF00449
(Urease_alpha)
PF01979
(Amidohydro_1) 		5 TYR C  79
ALA C 421
GLY C 425
ASN C 413
GLY C 419
 None
 1.32A 4obwD-5fseC:
undetectable		 4obwD-5fseC:
17.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5grh ISOCITRATE
DEHYDROGENASE [NAD]
SUBUNIT GAMMA,
MITOCHONDRIAL

(Homo sapiens) 		PF00180
(Iso_dh) 		5 ALA B 256
GLY B 257
ASN B 285
GLY B 253
ARG B 310
 None
 1.25A 4obwD-5grhB:
undetectable		 4obwD-5grhB:
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.
5itw DIHYDROANTICAPSIN
7-DEHYDROGENASE

(Bacillus
subtilis) 		PF13561
(adh_short_C2) 		5 TYR A 154
GLY A  91
ILE A  19
GLY A  18
ASN A 192
 None
None
SO4  A 302 (-3.9A)
SO4  A 302 (-3.5A)
None
 1.24A 4obwD-5itwA:
6.9		 4obwD-5itwA:
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.
5mfd YIIIM''6AII
CAPSID DECORATION
PROTEIN,PD_(KR)5

(synthetic
construct;
Escherichia
virus Lambda) 		PF00514
(Arm)
PF02924
(HDPD) 		5 ALA A 123
ILE A  88
ASN A  85
GLY A 126
ARG B 118
 None
 1.19A 4obwD-5mfdA:
undetectable		 4obwD-5mfdA:
22.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mfd YIIIM''6AII
CAPSID DECORATION
PROTEIN,PD_(KR)5

(synthetic
construct;
Escherichia
virus Lambda) 		PF00514
(Arm)
PF02924
(HDPD) 		5 ALA A 165
ILE A 130
ASN A 127
ARG B 118
ASN A 163
 None
 1.29A 4obwD-5mfdA:
undetectable		 4obwD-5mfdA:
22.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mfd YIIIM''6AII
CAPSID DECORATION
PROTEIN,PD_(KR)5

(synthetic
construct;
Escherichia
virus Lambda) 		PF00514
(Arm)
PF02924
(HDPD) 		5 ALA A 165
ILE A 130
ASN A 127
GLY A 168
ARG B 116
 None
None
None
None
CA  A 406 ( 4.9A)
 1.25A 4obwD-5mfdA:
undetectable		 4obwD-5mfdA:
22.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mfd YIIIM''6AII
CAPSID DECORATION
PROTEIN,PD_(KR)5

(synthetic
construct;
Escherichia
virus Lambda) 		PF00514
(Arm)
PF02924
(HDPD) 		5 ALA A 165
ILE A 130
ASN A 127
GLY A 168
ARG B 118
 None
 1.28A 4obwD-5mfdA:
undetectable		 4obwD-5mfdA:
22.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mln ALCOHOL
DEHYDROGENASE 3

([Candida]
magnoliae) 		no annotation 5 TYR A 141
ALA A 172
GLY A 230
ILE A 180
GLY A 176
 None
 1.29A 4obwD-5mlnA:
6.0		 4obwD-5mlnA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5n6u BETA-MANNOSIDASE

(Dictyoglomus
thermophilum) 		PF00703
(Glyco_hydro_2)
PF02837
(Glyco_hydro_2_N) 		5 GLY A 582
ILE A 506
ASN A 485
GLY A 595
ASN A 502
 None
 1.12A 4obwD-5n6uA:
undetectable		 4obwD-5n6uA:
15.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5o7o DESFERRIOXAMINE
SIDEROPHORE
BIOSYNTHESIS PROTEIN
DFOC

(Erwinia
amylovora) 		no annotation 5 GLY A  69
ILE A 106
MET A  79
ARG A  11
PHE A 116
 None
 0.90A 4obwD-5o7oA:
undetectable		 4obwD-5o7oA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5tjz 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
REDUCTASE

(Mycobacterium
tuberculosis) 		no annotation 5 ALA A   8
GLY A   7
ILE A  50
GLY A   4
ARG A  18
 None
NAP  A 304 (-3.4A)
None
None
None
 1.30A 4obwD-5tjzA:
2.6		 4obwD-5tjzA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5u1o GLUTATHIONE
REDUCTASE

(Vibrio
parahaemolyticus) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 TYR A 103
LYS A 116
GLY A  17
GLY A 323
ASN A  25
 None
None
FAD  A 501 (-3.2A)
None
None
 1.23A 4obwD-5u1oA:
undetectable		 4obwD-5u1oA:
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.
5u9p GLUCONATE
5-DEHYDROGENASE

(Burkholderia
cenocepacia) 		PF13561
(adh_short_C2) 		5 TYR A 161
GLY A  98
ILE A  24
GLY A  23
ASN A 199
 TLA  A 302 ( 4.0A)
NAP  A 301 (-3.8A)
NAP  A 301 (-3.9A)
NAP  A 301 (-3.5A)
TLA  A 302 ( 3.0A)
 1.15A 4obwD-5u9pA:
6.4		 4obwD-5u9pA:
21.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5uyt ICE-BINDING PROTEIN

(Flavobacteriaceae
bacterium
3519-10) 		no annotation 5 ALA A  77
GLY A  76
GLY A  55
ASN A  32
PHE A  33
 None
 1.13A 4obwD-5uytA:
undetectable		 4obwD-5uytA:
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.
5voh NADH OXIDASE

(Lactobacillus
brevis) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 TYR A 318
ALA A 277
GLY A 304
ASN A 299
GLY A 112
 None
None
None
None
FAD  A 501 (-2.6A)
 1.25A 4obwD-5vohA:
undetectable		 4obwD-5vohA:
19.77
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.
5yat MITOCHONDRIAL
ALCOHOL
DEHYDROGENASE
ISOZYME III

(Komagataella
phaffii) 		no annotation 5 ALA A 181
GLY A 186
ILE A 203
GLY A 205
PHE A 221
 None
 1.24A 4obwD-5yatA:
6.4		 4obwD-5yatA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5yl7 PSEUDOALTEROMONAS
ARCTICA PAMC 21717

(Pseudoalteromonas
arctica) 		no annotation 5 ALA A 263
GLY A 264
ASN A 197
GLY A 261
ASN A 257
 None
None
None
CA  A 801 ( 4.3A)
None
 1.24A 4obwD-5yl7A:
2.2		 4obwD-5yl7A:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6c3p ATP-BINDING CASSETTE
SUB-FAMILY C MEMBER
8

(Homo sapiens) 		no annotation 5 ALA E1472
GLY E1468
ASN E1438
GLY E1433
ASN E1480
 None
None
None
None
ATP  E2004 (-4.4A)
 1.14A 4obwD-6c3pE:
undetectable		 4obwD-6c3pE:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6c3p ATP-BINDING CASSETTE
SUB-FAMILY C MEMBER
8

(Homo sapiens) 		no annotation 5 ALA E1472
GLY E1468
ILE E1435
ASN E1438
GLY E1433
 None
 1.23A 4obwD-6c3pE:
undetectable		 4obwD-6c3pE:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6cij HIGH MOBILITY GROUP
PROTEIN B1

(Homo sapiens) 		no annotation 5 ALA N 126
GLY N 123
ASN N 134
GLY N 130
PHE N 102
 None
 1.31A 4obwD-6cijN:
undetectable		 4obwD-6cijN:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6eoe 78 KDA
GLUCOSE-REGULATED
PROTEIN

(Cricetulus
griseus) 		no annotation 5 GLY A 216
ILE A 220
ASN A 219
GLY A 210
PHE A 242
 None
 1.22A 4obwD-6eoeA:
undetectable		 4obwD-6eoeA:
20.75
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.
1a0d XYLOSE ISOMERASE

(Geobacillus
stearothermophilus) 		PF01261
(AP_endonuc_2) 		3 ASN A 140
ASP A 101
ASP A 336
 None
None
MN  A 491 ( 3.1A)
 0.86A 4obwD-1a0dA:
1.4		 4obwD-1a0dA:
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.
1a0e XYLOSE ISOMERASE

(Thermotoga
neapolitana) 		PF01261
(AP_endonuc_2) 		3 ASN A 142
ASP A 103
ASP A 338
 None
None
CO  A 491 ( 3.0A)
 0.88A 4obwD-1a0eA:
1.4		 4obwD-1a0eA:
19.64
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.
1aun PR-5D

(Nicotiana
tabacum) 		PF00314
(Thaumatin) 		3 ASN A  89
ASP A  95
ASP A 199
 None
 0.87A 4obwD-1aunA:
undetectable		 4obwD-1aunA:
21.93
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.
1bhw XYLOSE ISOMERASE

(Actinoplanes
missouriensis) 		PF01261
(AP_endonuc_2) 		3 ASN A  92
ASP A  57
ASP A 292
 None
 0.88A 4obwD-1bhwA:
undetectable		 4obwD-1bhwA:
22.83
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.
1biy LACTOFERRIN

(Bubalus bubalis) 		PF00405
(Transferrin) 		3 ASN A   5
ASP A  55
ASP A 261
 None
 0.74A 4obwD-1biyA:
undetectable		 4obwD-1biyA:
15.61
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.
1ea9 CYCLOMALTODEXTRINASE

(Bacillus sp.
(in: Bacteria)) 		PF00128
(Alpha-amylase)
PF02903
(Alpha-amylase_N)
PF16657
(Malt_amylase_C) 		3 ASN C 346
ASP C 320
ASP C 226
 None
 0.84A 4obwD-1ea9C:
undetectable		 4obwD-1ea9C:
19.19
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.
1g1a DTDP-D-GLUCOSE
4,6-DEHYDRATASE

(Salmonella
enterica) 		PF16363
(GDP_Man_Dehyd) 		3 ASN A 196
ASP A 134
ASP A 139
 None
 0.85A 4obwD-1g1aA:
5.8		 4obwD-1g1aA:
22.62
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.
1g5g FUSION PROTEIN

(Avian
avulavirus 1) 		PF00523
(Fusion_gly) 		3 ASN A 294
ASP A 344
ASP A  47
 None
 0.56A 4obwD-1g5gA:
undetectable		 4obwD-1g5gA:
18.24
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.
1ivh ISOVALERYL-COA
DEHYDROGENASE

(Homo sapiens) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		3 ASN A 357
ASP A  40
ASP A 212
 None
 0.71A 4obwD-1ivhA:
undetectable		 4obwD-1ivhA:
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.
1kgs DNA BINDING RESPONSE
REGULATOR D

(Thermotoga
maritima) 		PF00072
(Response_reg)
PF00486
(Trans_reg_C) 		3 ASN A  94
ASP A  85
ASP A  98
 None
 0.76A 4obwD-1kgsA:
undetectable		 4obwD-1kgsA:
24.44
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.
1pk8 RAT SYNAPSIN I

(Rattus
norvegicus) 		PF02078
(Synapsin)
PF02750
(Synapsin_C) 		3 ASN A 322
ASP A 402
ASP A 397
 None
 0.63A 4obwD-1pk8A:
undetectable		 4obwD-1pk8A:
22.31
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.
1q5a EP-CADHERIN

(Mus musculus) 		PF00028
(Cadherin) 		3 ASN A 518
ASP A 463
ASP A 395
 None
CA  A 914 ( 3.4A)
CA  A 913 (-2.1A)
 0.00A 4obwD-1q5aA:
undetectable		 4obwD-1q5aA:
14.89
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.
1qhb HALOPEROXIDASE

(Corallina
officinalis) 		PF01569
(PAP2) 		3 ASN A 114
ASP A 300
ASP A  65
 None
 0.82A 4obwD-1qhbA:
undetectable		 4obwD-1qhbA:
17.73
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.
1rpm RECEPTOR PROTEIN
TYROSINE PHOSPHATASE
MU

(Homo sapiens) 		PF00102
(Y_phosphatase) 		3 ASN A 950
ASP A 952
ASP A 936
 None
 0.85A 4obwD-1rpmA:
undetectable		 4obwD-1rpmA:
19.52
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.
1s9c PEROXISOMAL
MULTIFUNCTIONAL
ENZYME TYPE 2

(Homo sapiens) 		PF01575
(MaoC_dehydratas)
PF13452
(MaoC_dehydrat_N) 		3 ASN A 234
ASP A  43
ASP A 178
 None
 0.68A 4obwD-1s9cA:
undetectable		 4obwD-1s9cA:
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.
1sbd SOYBEAN AGGLUTININ

(Glycine max) 		PF00139
(Lectin_legB) 		3 ASN A 130
ASP A  88
ASP A 215
 CA  A 601 ( 2.9A)
GAL  A 847 (-2.8A)
GAL  A 847 ( 2.9A)
 0.82A 4obwD-1sbdA:
undetectable		 4obwD-1sbdA:
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.
1sl6 C-TYPE LECTIN
DC-SIGNR

(Homo sapiens) 		PF00059
(Lectin_C) 		3 ASN A 362
ASP A 367
ASP A 382
 CA  A   1 (-3.1A)
CA  A   3 ( 2.2A)
None
 0.85A 4obwD-1sl6A:
undetectable		 4obwD-1sl6A:
18.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1suv TRANSFERRIN RECEPTOR
PROTEIN 1

(Homo sapiens) 		PF02225
(PA)
PF04253
(TFR_dimer)
PF04389
(Peptidase_M28) 		3 ASN A 236
ASP A 284
ASP A 562
 None
 0.87A 4obwD-1suvA:
undetectable		 4obwD-1suvA:
17.87
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.
1uik ALPHA PRIME SUBUNIT
OF BETA-CONGLYCININ

(Glycine max) 		PF00190
(Cupin_1) 		3 ASN A 225
ASP A 227
ASP A 357
 None
 0.86A 4obwD-1uikA:
undetectable		 4obwD-1uikA:
21.15
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.
1xea OXIDOREDUCTASE,
GFO/IDH/MOCA FAMILY

(Vibrio cholerae) 		PF01408
(GFO_IDH_MocA) 		3 ASN A 122
ASP A  93
ASP A  12
 None
 0.83A 4obwD-1xeaA:
4.8		 4obwD-1xeaA:
19.88
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.
1yyr TRICHODIENE SYNTHASE

(Fusarium
sporotrichioides) 		PF06330
(TRI5) 		3 ASN A 185
ASP A 100
ASP A 239
 None
 0.84A 4obwD-1yyrA:
undetectable		 4obwD-1yyrA:
19.64
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.
1z3v CELLULASE

(Phanerochaete
chrysosporium) 		PF00840
(Glyco_hydro_7) 		3 ASN A 132
ASP A 129
ASP A 270
 None
 0.77A 4obwD-1z3vA:
undetectable		 4obwD-1z3vA:
21.40
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.
2epk N-ACETYL-BETA-D-GLUC
OSAMINIDASE

(Streptococcus
gordonii) 		PF00728
(Glyco_hydro_20) 		3 ASN X 320
ASP X 308
ASP X 312
 None
 0.79A 4obwD-2epkX:
undetectable		 4obwD-2epkX:
19.06
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.
2h36 HYPOTHETICAL PROTEIN
SIFV0014

(Sulfolobus
islandicus
filamentous
virus) 		PF07118
(DUF1374) 		3 ASN X  58
ASP X  60
ASP X  80
 None
 0.76A 4obwD-2h36X:
undetectable		 4obwD-2h36X:
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.
2i0o SER/THR PHOSPHATASE

(Anopheles
gambiae) 		PF00481
(PP2C) 		3 ASN A 472
ASP A 425
ASP A  38
 None
ZN  A 579 (-2.2A)
ZN  A 581 (-2.1A)
 0.85A 4obwD-2i0oA:
undetectable		 4obwD-2i0oA:
22.59
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.
2iv2 FORMATE
DEHYDROGENASE H

(Escherichia
coli) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4) 		3 ASN X 114
ASP X 343
ASP X 459
 None
 0.85A 4obwD-2iv2X:
2.5		 4obwD-2iv2X:
15.90
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.
2nya PERIPLASMIC NITRATE
REDUCTASE

(Escherichia
coli) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4) 		3 ASN A 446
ASP A 473
ASP A  59
 MGD  A3001 (-4.5A)
MGD  A3001 (-2.9A)
None
 0.82A 4obwD-2nyaA:
2.7		 4obwD-2nyaA:
14.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ox9 COLLECTIN PLACENTA 1

(Mus musculus) 		PF00059
(Lectin_C) 		3 ASN A 697
ASP A 707
ASP A 723
 CA  A 801 (-3.2A)
CA  A 803 ( 2.1A)
None
 0.86A 4obwD-2ox9A:
undetectable		 4obwD-2ox9A:
17.58
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.
2q1f CHONDROITINASE

(Bacteroides
thetaiotaomicron) 		PF02278
(Lyase_8)
PF09092
(Lyase_N)
PF09093
(Lyase_catalyt) 		3 ASN A 503
ASP A 593
ASP A 557
 None
 0.79A 4obwD-2q1fA:
undetectable		 4obwD-2q1fA:
13.98
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.
2rjo TWIN-ARGININE
TRANSLOCATION
PATHWAY SIGNAL
PROTEIN

(Paraburkholderia
phytofirmans) 		PF13407
(Peripla_BP_4) 		3 ASN A 131
ASP A 105
ASP A 266
 GAL  A 368 (-3.7A)
GAL  A 368 (-2.9A)
GAL  A 368 (-2.9A)
 0.74A 4obwD-2rjoA:
undetectable		 4obwD-2rjoA:
20.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2uvj ABC TYPE PERIPLASMIC
SUGAR-BINDING
PROTEIN

(Yersinia
enterocolitica) 		PF13416
(SBP_bac_8) 		3 ASN A  90
ASP A 388
ASP A 190
 ADA  A1433 (-3.0A)
ADA  A1432 ( 4.7A)
ADA  A1431 (-3.0A)
 0.75A 4obwD-2uvjA:
undetectable		 4obwD-2uvjA:
23.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wy3 MHC CLASS I
POLYPEPTIDE-RELATED
SEQUENCE B

(Homo sapiens) 		PF00129
(MHC_I) 		3 ASN A 113
ASP A  82
ASP A  15
 None
 0.85A 4obwD-2wy3A:
undetectable		 4obwD-2wy3A:
21.57
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.
2xpi ANAPHASE-PROMOTING
COMPLEX SUBUNIT CUT9

(Schizosaccharomyces
pombe) 		PF12895
(ANAPC3)
PF13181
(TPR_8)
PF13424
(TPR_12) 		3 ASN A 338
ASP A 306
ASP A 238
 None
 0.88A 4obwD-2xpiA:
undetectable		 4obwD-2xpiA:
19.43
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.
2zux YESW PROTEIN

(Bacillus
subtilis) 		no annotation 3 ASN A 300
ASP A 178
ASP A 401
 None
None
CA  A 629 (-2.5A)
 0.69A 4obwD-2zuxA:
undetectable		 4obwD-2zuxA:
17.90
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.
3bt7 TRNA
(URACIL-5-)-METHYLTR
ANSFERASE

(Escherichia
coli) 		PF05958
(tRNA_U5-meth_tr) 		3 ASN A 251
ASP A 169
ASP A 166
 None
 0.87A 4obwD-3bt7A:
10.2		 4obwD-3bt7A:
22.55
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.
3cji POLYPROTEIN
POLYPROTEIN

(Senecavirus A;
Senecavirus A) 		no annotation
PF00073
(Rhv) 		3 ASN A 243
ASP A  38
ASP B  20
 None
 0.81A 4obwD-3cjiA:
undetectable		 4obwD-3cjiA:
22.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3frm UNCHARACTERIZED
CONSERVED PROTEIN

(Staphylococcus
epidermidis) 		PF13673
(Acetyltransf_10) 		3 ASN A  14
ASP A  12
ASP A 160
 None
 0.87A 4obwD-3frmA:
undetectable		 4obwD-3frmA:
22.51
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.
3ham AMINOGLYCOSIDE
PHOSPHOTRANSFERASE

(Enterococcus
faecium) 		PF01636
(APH) 		3 ASN A 196
ASP A 233
ASP A 222
 LLL  A 500 (-3.3A)
None
None
 0.88A 4obwD-3hamA:
undetectable		 4obwD-3hamA:
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.
3jy6 TRANSCRIPTIONAL
REGULATOR, LACI
FAMILY

(Lactobacillus
brevis) 		PF13407
(Peripla_BP_4) 		3 ASN A 167
ASP A 152
ASP A 278
 None
 0.82A 4obwD-3jy6A:
2.6		 4obwD-3jy6A:
23.36
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.
3lij CALCIUM/CALMODULIN
DEPENDENT PROTEIN
KINASE WITH A KINASE
DOMAIN AND 4
CALMODULIN LIKE EF
HANDS

(Cryptosporidium
parvum) 		PF00069
(Pkinase)
PF13499
(EF-hand_7) 		3 ASN A 381
ASP A 379
ASP A 431
 CA  A   1 (-3.0A)
CA  A   1 (-3.3A)
CA  A 518 (-3.2A)
 0.82A 4obwD-3lijA:
undetectable		 4obwD-3lijA:
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.
3lrk ALPHA-GALACTOSIDASE
1

(Saccharomyces
cerevisiae) 		PF16499
(Melibiase_2) 		3 ASN A  38
ASP A  35
ASP A 149
 GOL  A7002 (-4.0A)
GOL  A7002 (-3.5A)
GOL  A7001 (-4.1A)
 0.88A 4obwD-3lrkA:
undetectable		 4obwD-3lrkA:
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.
3m7a UNCHARACTERIZED
PROTEIN

(Novosphingobium
aromaticivorans) 		PF02643
(DUF192) 		3 ASN A 126
ASP A 110
ASP A  84
 None
None
EDO  A 204 ( 4.7A)
 0.81A 4obwD-3m7aA:
undetectable		 4obwD-3m7aA:
20.38
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.
3psh PROTEIN HI_1472

(Haemophilus
influenzae) 		PF01497
(Peripla_BP_2) 		3 ASN A  76
ASP A 263
ASP A 267
 None
 0.80A 4obwD-3pshA:
undetectable		 4obwD-3pshA:
22.94
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.
3q2v CADHERIN-1

(Mus musculus) 		PF00028
(Cadherin) 		3 ASN A 520
ASP A 464
ASP A 344
 None
CA  A 611 ( 3.5A)
None
 0.79A 4obwD-3q2vA:
undetectable		 4obwD-3q2vA:
18.98
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.
3rot ABC SUGAR
TRANSPORTER,
PERIPLASMIC SUGAR
BINDING PROTEIN

(Legionella
pneumophila) 		PF13407
(Peripla_BP_4) 		3 ASN A 131
ASP A 112
ASP A  34
 None
GOL  A 317 (-2.8A)
None
 0.83A 4obwD-3rotA:
3.4		 4obwD-3rotA:
22.81
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.
3sp1 CYSTEINYL-TRNA
SYNTHETASE

(Borreliella
burgdorferi) 		PF01406
(tRNA-synt_1e) 		3 ASN A  18
ASP A 234
ASP A 231
 None
 0.63A 4obwD-3sp1A:
3.3		 4obwD-3sp1A:
20.20
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.
3v7p AMIDOHYDROLASE
FAMILY PROTEIN

(Nitratiruptor
sp. SB155-2) 		PF01979
(Amidohydro_1) 		3 ASN A 262
ASP A 218
ASP A 240
 None
 0.85A 4obwD-3v7pA:
undetectable		 4obwD-3v7pA:
22.06
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.
3v8v RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE L

(Escherichia
coli) 		PF01170
(UPF0020)
PF02926
(THUMP)
PF10672
(Methyltrans_SAM) 		3 ASN A 690
ASP A 525
ASP A 519
 None
 0.88A 4obwD-3v8vA:
12.8		 4obwD-3v8vA:
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.
3vkg DYNEIN HEAVY CHAIN,
CYTOPLASMIC

(Dictyostelium
discoideum) 		PF03028
(Dynein_heavy)
PF07728
(AAA_5)
PF08393
(DHC_N2)
PF12774
(AAA_6)
PF12775
(AAA_7)
PF12777
(MT)
PF12780
(AAA_8)
PF12781
(AAA_9) 		3 ASN A2381
ASP A2329
ASP A2341
 None
 0.72A 4obwD-3vkgA:
undetectable		 4obwD-3vkgA:
6.12
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.
4a01 PROTON
PYROPHOSPHATASE

(Vigna radiata) 		PF03030
(H_PPase) 		3 ASN A 280
ASP A 507
ASP A 527
 MG  A1768 ( 4.9A)
MG  A1768 (-2.5A)
None
 0.84A 4obwD-4a01A:
undetectable		 4obwD-4a01A:
15.82
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.
4az7 BETA-N-ACETYLHEXOSAM
INIDASE

(Streptococcus
pneumoniae) 		PF00728
(Glyco_hydro_20) 		3 ASN A 364
ASP A 360
ASP A 193
 None
LOG  A1614 (-3.9A)
None
 0.66A 4obwD-4az7A:
undetectable		 4obwD-4az7A:
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.
4azc BETA-N-ACETYLHEXOSAM
INIDASE

(Streptococcus
pneumoniae) 		PF00728
(Glyco_hydro_20) 		3 ASN A 808
ASP A 804
ASP A 638
 None
NGW  A2042 (-3.6A)
None
 0.71A 4obwD-4azcA:
undetectable		 4obwD-4azcA:
23.41
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.
4bfr PHOSPHATIDYLINOSITOL
4,5-BISPHOSPHATE
3-KINASE CATALYTIC S
SUBUNIT BETA ISOFORM

(Mus musculus) 		PF00454
(PI3_PI4_kinase)
PF00613
(PI3Ka)
PF00792
(PI3K_C2)
PF00794
(PI3K_rbd) 		3 ASN A 577
ASP A 581
ASP A 550
 None
 0.76A 4obwD-4bfrA:
undetectable		 4obwD-4bfrA:
14.63
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.
4bhi GAMMA-BUTYROBETAINE
DIOXYGENASE

(Homo sapiens) 		PF02668
(TauD)
PF06155
(DUF971) 		3 ASN A 190
ASP A 261
ASP A 204
 None
RUJ  A 401 ( 4.7A)
ZN  A 402 (-2.6A)
 0.75A 4obwD-4bhiA:
undetectable		 4obwD-4bhiA:
20.86
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.
4c9v RNF43

(Xenopus
tropicalis) 		no annotation 3 ASN A 137
ASP A 134
ASP A 168
 None
 0.86A 4obwD-4c9vA:
undetectable		 4obwD-4c9vA:
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.
4cag POLYSACCHARIDE LYASE
FAMILY 11 PROTEIN

(Bacillus
licheniformis) 		PF01839
(FG-GAP) 		3 ASN A 270
ASP A 148
ASP A 371
 None
GOL  A 611 ( 4.7A)
CA  A 601 ( 2.2A)
 0.65A 4obwD-4cagA:
undetectable		 4obwD-4cagA:
18.43
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.
4cs5 PROLIFERATING CELL
NUCLEAR ANTIGEN

(Litopenaeus
vannamei) 		PF00705
(PCNA_N)
PF02747
(PCNA_C) 		3 ASN A 120
ASP A  97
ASP A  94
 None
 0.87A 4obwD-4cs5A:
undetectable		 4obwD-4cs5A:
20.85
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.
4csi CELLULASE

(Humicola grisea) 		PF00840
(Glyco_hydro_7) 		3 ASN A 136
ASP A 133
ASP A 282
 None
 0.83A 4obwD-4csiA:
undetectable		 4obwD-4csiA:
19.41
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.
4i4i 6-PHOSPHOFRUCTOKINAS
E

(Geobacillus
stearothermophilus) 		PF00365
(PFK) 		3 ASN A 288
ASP A 134
ASP A 307
 None
 0.82A 4obwD-4i4iA:
undetectable		 4obwD-4i4iA:
21.30
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.
4iss ALLOPHANATE
HYDROLASE

(Kluyveromyces
lactis) 		PF01425
(Amidase) 		3 ASN A 230
ASP A 437
ASP A 409
 None
 0.76A 4obwD-4issA:
undetectable		 4obwD-4issA:
19.17
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.
4kto ISOVALERYL-COA
DEHYDROGENASE

(Sinorhizobium
meliloti) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		3 ASN A 350
ASP A  37
ASP A 205
 None
 0.85A 4obwD-4ktoA:
undetectable		 4obwD-4ktoA:
22.57
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.
4lhe THERMOSTABLE
MONOACYLGLYCEROL
LIPASE

(Bacillus sp.
H-257) 		PF12146
(Hydrolase_4) 		3 ASN A 223
ASP A 231
ASP A 153
 None
 0.77A 4obwD-4lheA:
undetectable		 4obwD-4lheA:
22.41
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.
4m8n PLEXINC1
INTRACELLULAR REGION
RAS-RELATED PROTEIN
RAP-1B

(Danio rerio;
Homo sapiens) 		PF08337
(Plexin_cytopl)
PF00071
(Ras) 		3 ASN A1009
ASP A1024
ASP E  69
 None
 0.63A 4obwD-4m8nA:
undetectable		 4obwD-4m8nA:
16.58
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.
4nz0 GENOME POLYPROTEIN

(Cardiovirus A) 		PF00680
(RdRP_1) 		3 ASN A 363
ASP A 233
ASP A 333
 None
 0.76A 4obwD-4nz0A:
undetectable		 4obwD-4nz0A:
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.
4ofz TREHALOSE-PHOSPHATAS
E

(Brugia malayi) 		no annotation 3 ASN A 228
ASP A 132
ASP A 140
 None
 0.88A 4obwD-4ofzA:
undetectable		 4obwD-4ofzA:
21.28
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.
4r86 RND FAMILY
AMINOGLYCOSIDE/MULTI
DRUG EFFLUX PUMP

(Salmonella
enterica) 		PF00873
(ACR_tran) 		3 ASN A 201
ASP A 142
ASP A 100
 None
 0.68A 4obwD-4r86A:
undetectable		 4obwD-4r86A:
20.75
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.
4rsm PERIPLASMIC BINDING
PROTEIN/LACI
TRANSCRIPTIONAL
REGULATOR

(Mycolicibacterium
smegmatis) 		PF13407
(Peripla_BP_4) 		3 ASN A  72
ASP A  43
ASP A 200
 None
 0.83A 4obwD-4rsmA:
undetectable		 4obwD-4rsmA:
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.
4u7d ATP-DEPENDENT DNA
HELICASE Q1

(Homo sapiens) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF16124
(RecQ_Zn_bind) 		3 ASN A 363
ASP A 382
ASP A 379
 None
 0.87A 4obwD-4u7dA:
undetectable		 4obwD-4u7dA:
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.
4um8 INTEGRIN ALPHA-V
INTEGRIN BETA-6

(Homo sapiens;
Homo sapiens) 		PF01839
(FG-GAP)
PF08441
(Integrin_alpha2)
PF00362
(Integrin_beta)
PF17205
(PSI_integrin) 		3 ASN B 218
ASP B 220
ASP A 148
 None
 0.76A 4obwD-4um8B:
undetectable		 4obwD-4um8B:
15.20
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.
4v20 CELLOBIOHYDROLASE

(Aspergillus
fumigatus) 		PF00840
(Glyco_hydro_7) 		3 ASN A 135
ASP A 132
ASP A 281
 None
 0.84A 4obwD-4v20A:
undetectable		 4obwD-4v20A:
20.85
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.
4wmo XEEL PROTEIN

(Xenopus laevis) 		no annotation 3 ASN F 117
ASP F 162
ASP F 143
 None
CA  F 402 (-2.1A)
None
 0.79A 4obwD-4wmoF:
undetectable		 4obwD-4wmoF:
21.00
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.
4wmy INTELECTIN-1

(Homo sapiens) 		no annotation 3 ASN A  88
ASP A 133
ASP A 114
 None
CA  A 401 (-2.1A)
None
 0.78A 4obwD-4wmyA:
undetectable		 4obwD-4wmyA:
20.70
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.
4z0n PERIPLASMIC BINDING
PROTEIN/LACI
TRANSCRIPTIONAL
REGULATOR

(Streptobacillus
moniliformis) 		PF13407
(Peripla_BP_4) 		3 ASN A 116
ASP A  38
ASP A 237
 GAL  A 405 (-2.7A)
GAL  A 405 (-2.0A)
None
 0.74A 4obwD-4z0nA:
undetectable		 4obwD-4z0nA:
24.72
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.
4zgv FERREDOXIN RECEPTOR

(Pectobacterium
atrosepticum) 		PF07715
(Plug) 		3 ASN A 540
ASP A 533
ASP A 610
 None
 0.76A 4obwD-4zgvA:
undetectable		 4obwD-4zgvA:
15.14
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.
4zyj DNMZ

(Streptomyces
peucetius) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		3 ASN A 369
ASP A  48
ASP A 216
 None
 0.65A 4obwD-4zyjA:
undetectable		 4obwD-4zyjA:
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.
5a6b N-ACETYL-BETA-D-GLUC
OSAMINIDASE

(Streptococcus
pneumoniae) 		PF00728
(Glyco_hydro_20) 		3 ASN D 319
ASP D 307
ASP D 311
 None
 0.80A 4obwD-5a6bD:
undetectable		 4obwD-5a6bD:
17.96
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.
5bq3 RHAMNOSE ABC
TRANSPORTER,
RHAMNOSE-BINDING
PROTEIN

(Actinomyces
odontolyticus) 		PF13407
(Peripla_BP_4) 		3 ASN A 331
ASP A 139
ASP A 117
 None
 0.60A 4obwD-5bq3A:
undetectable		 4obwD-5bq3A:
22.41
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.
5csl ACETYL-COA
CARBOXYLASE

(Saccharomyces
cerevisiae) 		PF00289
(Biotin_carb_N)
PF00364
(Biotin_lipoyl)
PF01039
(Carboxyl_trans)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2)
PF08326
(ACC_central) 		3 ASN A 127
ASP A 102
ASP A 503
 None
 0.77A 4obwD-5cslA:
undetectable		 4obwD-5cslA:
7.60
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.
5dwa TYPE-2 RESTRICTION
ENZYME AGEI

(Thalassobius
gelatinovorus) 		no annotation 3 ASN A 241
ASP A  65
ASP A 208
 None
 0.86A 4obwD-5dwaA:
undetectable		 4obwD-5dwaA:
22.90
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.
5hd9 ENCAPSIDATION
PROTEIN

(Bacillus virus
phi29) 		PF05894
(Podovirus_Gp16) 		3 ASN A 158
ASP A 118
ASP A  68
 None
 0.80A 4obwD-5hd9A:
3.1		 4obwD-5hd9A:
20.70
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.
5hl3 LMO2470 PROTEIN

(Listeria
monocytogenes) 		PF00560
(LRR_1)
PF12354
(Internalin_N)
PF13855
(LRR_8) 		3 ASN A 227
ASP A 203
ASP A 132
 None
None
CA  A 401 (-3.0A)
 0.83A 4obwD-5hl3A:
undetectable		 4obwD-5hl3A:
22.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5i8i UREA AMIDOLYASE

(Kluyveromyces
lactis) 		PF00289
(Biotin_carb_N)
PF01425
(Amidase)
PF02626
(CT_A_B)
PF02682
(CT_C_D)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		3 ASN A 230
ASP A 437
ASP A 409
 None
 0.76A 4obwD-5i8iA:
undetectable		 4obwD-5i8iA:
9.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5inr DIPEPTIDASE

(Lactobacillus
farciminis) 		PF03577
(Peptidase_C69) 		3 ASN A 228
ASP A 268
ASP A 240
 None
 0.73A 4obwD-5inrA:
undetectable		 4obwD-5inrA:
19.70
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.
5jz7 BETA-NERVE GROWTH
FACTOR
MEDI578 SCFV, LIGHT
CHAIN

(Homo sapiens;
Homo sapiens) 		PF00243
(NGF)
PF07686
(V-set) 		3 ASN D  52
ASP A  60
ASP A  65
 None
 0.81A 4obwD-5jz7D:
undetectable		 4obwD-5jz7D:
17.53
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.
5kws GALACTOSE-BINDING
PROTEIN

(Yersinia pestis) 		PF13407
(Peripla_BP_4) 		3 ASN A  91
ASP A  14
ASP A 212
 BGC  A 401 (-3.0A)
BGC  A 401 (-2.9A)
None
 0.75A 4obwD-5kwsA:
undetectable		 4obwD-5kwsA:
23.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5lmx DNA-DIRECTED RNA
POLYMERASE I SUBUNIT
RPA34

(Saccharomyces
cerevisiae) 		PF08208
(RNA_polI_A34) 		3 ASN N 106
ASP N  94
ASP N 134
 ASN  N 106 ( 0.6A)
ASP  N  94 ( 0.5A)
ASP  N 134 ( 0.5A)
 0.84A 4obwD-5lmxN:
undetectable		 4obwD-5lmxN:
22.94
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.
5lmx DNA-DIRECTED RNA
POLYMERASES I AND
III SUBUNIT
RPAC1,DNA-DIRECTED
RNA POLYMERASES I
AND III SUBUNIT
RPAC1

(Saccharomyces
cerevisiae) 		PF01000
(RNA_pol_A_bac)
PF01193
(RNA_pol_L) 		3 ASN C  53
ASP C  55
ASP C 269
 ASN  C  53 ( 0.6A)
ASP  C  55 ( 0.5A)
ASP  C 269 ( 0.5A)
 0.88A 4obwD-5lmxC:
undetectable		 4obwD-5lmxC:
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.
5m6u PHOSPHATIDYLINOSITOL
4,5-BISPHOSPHATE
3-KINASE CATALYTIC
SUBUNIT DELTA
ISOFORM

(Homo sapiens) 		PF00454
(PI3_PI4_kinase)
PF00613
(PI3Ka)
PF00792
(PI3K_C2)
PF00794
(PI3K_rbd)
PF02192
(PI3K_p85B) 		3 ASN A 556
ASP A 560
ASP A 529
 None
 0.67A 4obwD-5m6uA:
undetectable		 4obwD-5m6uA:
13.69
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.
5mrj BETA-XYLANASE

(Acremonium
chrysogenum) 		no annotation 3 ASN A 119
ASP A 368
ASP A 380
 None
 0.83A 4obwD-5mrjA:
undetectable		 4obwD-5mrjA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5nmi CYTOCHROME B-C1
COMPLEX SUBUNIT 1,
MITOCHONDRIAL
CYTOCHROME B

(Bos taurus;
Bos taurus) 		PF00675
(Peptidase_M16)
PF05193
(Peptidase_M16_C)
PF00032
(Cytochrom_B_C)
PF00033
(Cytochrome_B) 		3 ASN C  16
ASP C  20
ASP A 333
 None
CDL  C 505 (-3.9A)
None
 0.56A 4obwD-5nmiC:
undetectable		 4obwD-5nmiC:
20.16
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.
5o51 RHO GUANYL
NUCLEOTIDE EXCHANGE
FACTOR (ROM2),
PUTATIVE

(Aspergillus
fumigatus) 		no annotation 3 ASN A1162
ASP A1184
ASP A 895
 None
 0.78A 4obwD-5o51A:
undetectable		 4obwD-5o51A:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ovo ADP-RIBOSYL-(DINITRO
GEN REDUCTASE)
HYDROLASE

(Azospirillum
brasilense) 		no annotation 3 ASN A 126
ASP A  61
ASP A  97
 ADP  A 301 (-4.5A)
MG  A 302 ( 4.1A)
None
 0.80A 4obwD-5ovoA:
undetectable		 4obwD-5ovoA:
21.02
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.
5tw9 IRON UPTAKE SYSTEM
COMPONENT EFEO

(Yersinia pestis) 		no annotation 3 ASN A 332
ASP A 373
ASP A 322
 None
 0.82A 4obwD-5tw9A:
undetectable		 4obwD-5tw9A:
16.59
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.
5v1w GLYCOSIDE HYDROLASE

(Bacillus
halodurans) 		PF03639
(Glyco_hydro_81) 		3 ASN A 116
ASP A 216
ASP A 197
 None
 0.74A 4obwD-5v1wA:
undetectable		 4obwD-5v1wA:
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.
5xoe ATP-DEPENDENT
6-PHOSPHOFRUCTOKINAS
E

(Staphylococcus
aureus) 		no annotation 3 ASN A 290
ASP A 136
ASP A 310
 None
 0.83A 4obwD-5xoeA:
undetectable		 4obwD-5xoeA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xog DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA

(Komagataella
phaffii) 		PF00562
(RNA_pol_Rpb2_6)
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 ASN B 212
ASP B 622
ASP B 400
 None
 0.81A 4obwD-5xogB:
undetectable		 4obwD-5xogB:
12.01
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.
5xog DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA

(Komagataella
phaffii) 		PF00562
(RNA_pol_Rpb2_6)
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 ASN B 408
ASP B 400
ASP B 622
 None
 0.72A 4obwD-5xogB:
undetectable		 4obwD-5xogB:
12.01
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.
5y4j XYLOSE ISOMERASE

(Streptomyces
rubiginosus) 		PF01261
(AP_endonuc_2) 		3 ASN A  92
ASP A  57
ASP A 287
 None
None
XYL  A 402 ( 2.9A)
 0.88A 4obwD-5y4jA:
undetectable		 4obwD-5y4jA:
20.51
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.
6btm ALTERNATIVE COMPLEX
III SUBUNIT C
ALTERNATIVE COMPLEX
III SUBUNIT D

(Flavobacterium
johnsoniae;
Flavobacterium
johnsoniae) 		no annotation
no annotation 		3 ASN D  11
ASP D 141
ASP C  22
 None
 0.85A 4obwD-6btmD:
undetectable		 4obwD-6btmD:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6exv DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB2

(Sus scrofa) 		no annotation 3 ASN B 203
ASP B 617
ASP B 394
 None
 0.81A 4obwD-6exvB:
undetectable		 4obwD-6exvB:
undetectable