SIMILAR PATTERNS OF AMINO ACIDS FOR 5KF8_A_GCSA404

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.
1a0c XYLOSE ISOMERASE

(Thermoanaerobacterium
thermosulfurigenes) 		PF01261
(AP_endonuc_2) 		4 TRP A 187
GLU A 231
ASP A 308
TRP A  48
 None
CO  A 491 ( 2.4A)
CO  A 492 ( 2.4A)
None
 0.83A 5kf8A-1a0cA:
0.8		 5kf8A-1a0cA:
21.04
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.
1a0d XYLOSE ISOMERASE

(Geobacillus
stearothermophilus) 		PF01261
(AP_endonuc_2) 		4 TRP A 185
GLU A 229
ASP A 306
TRP A  47
 None
MN  A 491 ( 2.4A)
MN  A 492 ( 2.8A)
None
 1.00A 5kf8A-1a0dA:
0.1		 5kf8A-1a0dA:
20.40
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.
1a0e XYLOSE ISOMERASE

(Thermotoga
neapolitana) 		PF01261
(AP_endonuc_2) 		4 TRP A 187
GLU A 231
ASP A 308
TRP A  48
 None
CO  A 491 ( 2.4A)
CO  A 492 (-3.3A)
None
 1.01A 5kf8A-1a0eA:
0.0		 5kf8A-1a0eA:
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.
1cc1 HYDROGENASE (LARGE
SUBUNIT)

(Desulfomicrobium
baculatum) 		PF00374
(NiFeSe_Hases) 		4 ARG L 377
GLU L 331
GLY L 462
PRO L 463
 None
 1.15A 5kf8A-1cc1L:
0.0		 5kf8A-1cc1L:
19.57
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.
1d6h CHALCONE SYNTHASE

(Medicago sativa) 		PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C) 		4 GLU A 238
PRO A 228
GLY A  15
PRO A  16
 None
 1.00A 5kf8A-1d6hA:
0.0		 5kf8A-1d6hA:
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.
1de6 L-RHAMNOSE ISOMERASE

(Escherichia
coli) 		PF06134
(RhaA) 		4 TRP A 193
GLU A 234
ASP A 304
TRP A  48
 RNS  A1462 (-3.2A)
ZN  A 450 ( 2.4A)
MN  A 451 (-2.8A)
RNS  A1462 ( 4.1A)
 0.85A 5kf8A-1de6A:
0.0		 5kf8A-1de6A:
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.
1gcp VAV PROTO-ONCOGENE

(Mus musculus) 		PF00018
(SH3_1) 		4 TRP A 636
GLY A 611
PRO A 610
TRP A 649
 None
 1.01A 5kf8A-1gcpA:
undetectable		 5kf8A-1gcpA:
11.36
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.
1gff BACTERIOPHAGE G4
CAPSID PROTEINS GPF,
GPG, GPJ

(Escherichia
virus G4) 		PF02305
(Phage_F) 		4 ARG 1  26
TRP 1 158
GLU 1 154
ASP 1 391
 None
 1.02A 5kf8A-1gff1:
0.0		 5kf8A-1gff1:
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.
1k0g P-AMINOBENZOATE
SYNTHASE COMPONENT I

(Escherichia
coli) 		PF00425
(Chorismate_bind)
PF04715
(Anth_synt_I_N) 		4 GLU A 119
GLY A 364
PRO A 363
ASP A 313
 None
 1.11A 5kf8A-1k0gA:
0.0		 5kf8A-1k0gA:
19.66
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.
1mhs PLASMA MEMBRANE
ATPASE

(Neurospora
crassa) 		PF00122
(E1-E2_ATPase)
PF00690
(Cation_ATPase_N)
PF00702
(Hydrolase) 		4 ARG A  97
GLY A 199
PRO A 198
ASP A 200
 None
 1.15A 5kf8A-1mhsA:
undetectable		 5kf8A-1mhsA:
15.78
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.
1mqq ALPHA-D-GLUCURONIDAS
E

(Geobacillus
stearothermophilus) 		PF03648
(Glyco_hydro_67N)
PF07477
(Glyco_hydro_67C)
PF07488
(Glyco_hydro_67M) 		4 GLU A 299
PRO A 252
GLY A 294
ASP A 251
 None
 1.14A 5kf8A-1mqqA:
undetectable		 5kf8A-1mqqA:
18.66
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.
1n5x XANTHINE
DEHYDROGENASE

(Bos taurus) 		PF00111
(Fer2)
PF00941
(FAD_binding_5)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2)
PF03450
(CO_deh_flav_C) 		4 ARG A 233
GLU A 232
GLY A 630
PRO A 629
 None
 0.97A 5kf8A-1n5xA:
undetectable		 5kf8A-1n5xA:
12.87
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.
1n5x XANTHINE
DEHYDROGENASE

(Bos taurus) 		PF00111
(Fer2)
PF00941
(FAD_binding_5)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2)
PF03450
(CO_deh_flav_C) 		4 GLU A 232
GLY A 630
PRO A 629
ASP A 673
 None
 1.15A 5kf8A-1n5xA:
undetectable		 5kf8A-1n5xA:
12.87
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.
1pvj PYROGENIC EXOTOXIN B

(Streptococcus
pyogenes) 		PF01640
(Peptidase_C10)
PF13734
(Inhibitor_I69) 		4 GLU A 180
PRO A 223
GLY A 277
PRO A 278
 None
 0.98A 5kf8A-1pvjA:
undetectable		 5kf8A-1pvjA:
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.
1xbt THYMIDINE KINASE,
CYTOSOLIC

(Homo sapiens) 		PF00265
(TK) 		4 ARG A 130
GLY A  26
PRO A  27
ASP A 125
 None
 1.07A 5kf8A-1xbtA:
undetectable		 5kf8A-1xbtA:
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.
1z1e STILBENE SYNTHASE

(Arachis
hypogaea) 		PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C) 		4 ARG A 385
GLU A 238
GLY A  15
PRO A  16
 None
 1.16A 5kf8A-1z1eA:
undetectable		 5kf8A-1z1eA:
21.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1z1e STILBENE SYNTHASE

(Arachis
hypogaea) 		PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C) 		4 GLU A 238
PRO A 228
GLY A  15
PRO A  16
 None
 1.12A 5kf8A-1z1eA:
undetectable		 5kf8A-1z1eA:
21.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hg4 6-DEOXYERYTHRONOLIDE
B SYNTHASE

(Saccharopolyspora
erythraea) 		PF00109
(ketoacyl-synt)
PF00698
(Acyl_transf_1)
PF02801
(Ketoacyl-synt_C)
PF08990
(Docking)
PF16197
(KAsynt_C_assoc) 		4 TRP A  80
GLY A 233
PRO A 232
ASP A 153
 None
 1.07A 5kf8A-2hg4A:
undetectable		 5kf8A-2hg4A:
14.81
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.
2j87 THYMIDINE KINASE

(Vaccinia virus) 		PF00265
(TK) 		4 ARG A 115
GLY A  11
PRO A  12
ASP A 110
 None
 1.05A 5kf8A-2j87A:
undetectable		 5kf8A-2j87A:
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.
2lak AHSA1-LIKE PROTEIN
RHE_CH02687

(Rhizobium etli) 		PF08327
(AHSA1) 		4 PRO A 147
GLY A 144
PRO A 143
ASP A 146
 None
 1.14A 5kf8A-2lakA:
undetectable		 5kf8A-2lakA:
21.04
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.
2na1 POLYCOMB COMPLEX
PROTEIN BMI-1,
POLYHOMEOTIC-LIKE 2

(Homo sapiens;
Mus musculus) 		PF16207
(RAWUL) 		4 ARG A 165
GLU A  48
GLY A 219
PRO A 220
 None
 0.99A 5kf8A-2na1A:
undetectable		 5kf8A-2na1A:
17.92
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.
2o5r GLUTAMYL-TRNA
SYNTHETASE 1

(Thermotoga
maritima) 		PF00749
(tRNA-synt_1c) 		4 GLU A  84
PRO A  71
GLY A  78
PRO A  79
 None
 1.09A 5kf8A-2o5rA:
undetectable		 5kf8A-2o5rA:
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.
2orv THYMIDINE KINASE

(Homo sapiens) 		PF00265
(TK) 		4 ARG A 130
GLY A  26
PRO A  27
ASP A 125
 None
 1.07A 5kf8A-2orvA:
undetectable		 5kf8A-2orvA:
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.
2p0u STILBENECARBOXYLATE
SYNTHASE 2

(Marchantia
polymorpha) 		PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C) 		4 ARG A 403
GLU A 256
GLY A  33
PRO A  34
 None
 0.94A 5kf8A-2p0uA:
undetectable		 5kf8A-2p0uA:
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.
2vl7 XPD

(Sulfurisphaera
tokodaii) 		PF06733
(DEAD_2)
PF13307
(Helicase_C_2) 		4 TRP A  11
GLU A 345
PRO A 509
GLY A  36
 None
None
None
PO4  A1541 (-4.0A)
 1.13A 5kf8A-2vl7A:
undetectable		 5kf8A-2vl7A:
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.
2vqr PUTATIVE SULFATASE

(Rhizobium
leguminosarum) 		PF00884
(Sulfatase)
PF16347
(DUF4976) 		4 ARG A  39
GLU A  43
GLY A 355
ASP A 315
 None
 1.15A 5kf8A-2vqrA:
undetectable		 5kf8A-2vqrA:
20.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xdq LIGHT-INDEPENDENT
PROTOCHLOROPHYLLIDE
REDUCTASE SUBUNIT N

(Thermosynechococcus
elongatus) 		PF00148
(Oxidored_nitro) 		4 TRP A 305
GLU A 301
GLY A 275
PRO A 276
 None
 1.07A 5kf8A-2xdqA:
2.0		 5kf8A-2xdqA:
23.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xla SLL1785 PROTEIN

(Synechocystis
sp. PCC 6803) 		no annotation 4 PRO A 189
GLY A 131
PRO A 166
TRP A 127
 None
 1.15A 5kf8A-2xlaA:
undetectable		 5kf8A-2xlaA:
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.
2yk0 ERYTHROCYTE MEMBRANE
PROTEIN 1

(Plasmodium
falciparum) 		PF03011
(PFEMP)
PF05424
(Duffy_binding)
PF15447
(NTS) 		4 GLU A 322
PRO A 177
GLY A 187
ASP A 178
 None
 1.10A 5kf8A-2yk0A:
undetectable		 5kf8A-2yk0A:
18.55
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.
2zzw ABC TRANSPORTER,
SOLUTE-BINDING
PROTEIN

(Thermus
thermophilus) 		PF03480
(DctP) 		4 TRP A 295
GLY A 219
PRO A 220
ASP A 156
 None
 0.79A 5kf8A-2zzwA:
undetectable		 5kf8A-2zzwA:
20.05
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.
3al0 GLUTAMYL-TRNA(GLN)
AMIDOTRANSFERASE
SUBUNIT
C,LINKER,GLUTAMATE--
TRNA LIGASE 2

(Thermotoga
maritima;
synthetic
construct) 		PF00749
(tRNA-synt_1c)
PF02686
(Glu-tRNAGln) 		4 ARG C 208
GLU C 211
GLY C 205
PRO C 206
 None
 1.09A 5kf8A-3al0C:
undetectable		 5kf8A-3al0C:
19.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ask E3 UBIQUITIN-PROTEIN
LIGASE UHRF1

(Homo sapiens) 		PF00628
(PHD)
PF12148
(TTD) 		4 GLU A 234
GLY A 299
PRO A 300
ASP A 307
 None
 1.14A 5kf8A-3askA:
undetectable		 5kf8A-3askA:
19.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dgz THIOREDOXIN
REDUCTASE 2

(Mus musculus) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		4 ARG A 158
GLY A  13
ASP A  36
TRP A  47
 None
FAD  A 500 (-3.1A)
FAD  A 500 (-2.8A)
None
 1.12A 5kf8A-3dgzA:
undetectable		 5kf8A-3dgzA:
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.
3dzz PUTATIVE PYRIDOXAL
5'-PHOSPHATE-DEPENDE
NT C-S LYASE

(Lactobacillus
delbrueckii) 		PF00155
(Aminotran_1_2) 		4 TRP A  73
GLU A  74
PRO A 213
GLY A 202
 None
 1.06A 5kf8A-3dzzA:
undetectable		 5kf8A-3dzzA:
21.34
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.
3eoo METHYLISOCITRATE
LYASE

(Burkholderia
pseudomallei) 		PF13714
(PEP_mutase) 		4 ARG A 160
GLU A 117
GLY A  63
ASP A  61
 None
 1.03A 5kf8A-3eooA:
undetectable		 5kf8A-3eooA:
21.53
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.
3ff0 PHENAZINE
BIOSYNTHESIS PROTEIN
PHZB 2

(Pseudomonas
aeruginosa) 		PF03284
(PHZA_PHZB) 		4 GLU A 114
PRO A  79
GLY A 105
ASP A  80
 None
 0.91A 5kf8A-3ff0A:
undetectable		 5kf8A-3ff0A:
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.
3gde DNA LIGASE

(Archaeoglobus
fulgidus) 		PF01068
(DNA_ligase_A_M)
PF04675
(DNA_ligase_A_N)
PF04679
(DNA_ligase_A_C) 		4 ARG A 526
PRO A 309
GLY A 252
ASP A 251
 PO4  A 559 (-3.7A)
None
None
None
 1.16A 5kf8A-3gdeA:
undetectable		 5kf8A-3gdeA:
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.
3h0g DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB2

(Schizosaccharomyces
pombe) 		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) 		4 ARG B1113
GLU B 897
PRO B 929
GLY B 877
 None
 1.11A 5kf8A-3h0gB:
undetectable		 5kf8A-3h0gB:
14.46
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.
3jup PHENAZINE
BIOSYNTHESIS PROTEIN
A/B

(Burkholderia
lata) 		PF03284
(PHZA_PHZB) 		4 ARG A 117
PRO A  82
GLY A 108
ASP A  83
 None
 0.72A 5kf8A-3jupA:
undetectable		 5kf8A-3jupA:
17.18
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.
3ktc XYLOSE ISOMERASE

(Pectobacterium
atrosepticum) 		PF01261
(AP_endonuc_2) 		4 TRP A 126
GLU A 166
ASP A 240
TRP A  14
 UNL  A 337 ( 3.7A)
FE  A 334 (-2.6A)
FE  A 333 (-2.5A)
UNL  A 337 ( 3.9A)
 1.00A 5kf8A-3ktcA:
1.0		 5kf8A-3ktcA:
19.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3moi PROBABLE
DEHYDROGENASE

(Bordetella
bronchiseptica) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		4 ARG A 295
PRO A 128
GLY A 335
ASP A 343
 None
 0.95A 5kf8A-3moiA:
undetectable		 5kf8A-3moiA:
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.
3ngx BIFUNCTIONAL PROTEIN
FOLD

(Thermoplasma
acidophilum) 		PF00763
(THF_DHG_CYH)
PF02882
(THF_DHG_CYH_C) 		4 GLU A   7
PRO A 248
GLY A 254
PRO A 255
 None
 0.98A 5kf8A-3ngxA:
undetectable		 5kf8A-3ngxA:
20.94
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.
3ov3 CURCUMIN SYNTHASE

(Curcuma longa) 		PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C) 		4 ARG A 385
GLU A 238
GLY A  15
PRO A  16
 None
 0.93A 5kf8A-3ov3A:
undetectable		 5kf8A-3ov3A:
22.43
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.
3ov3 CURCUMIN SYNTHASE

(Curcuma longa) 		PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C) 		4 GLU A 238
PRO A 228
GLY A  15
PRO A  16
 None
 1.03A 5kf8A-3ov3A:
undetectable		 5kf8A-3ov3A:
22.43
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.
3s4d LACTOSE
PHOSPHORYLASE

(Cellulomonas
uda) 		PF06165
(Glyco_transf_36)
PF17167
(Glyco_hydro_36) 		4 ARG A 188
GLU A 174
ASP A 280
TRP A 278
 None
 0.87A 5kf8A-3s4dA:
undetectable		 5kf8A-3s4dA:
15.71
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.
3sf6 GLUTARYL-COA
DEHYDROGENASE

(Mycolicibacterium
smegmatis) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		4 ARG A  38
GLU A  96
GLY A 100
ASP A 271
 EDO  A 413 ( 4.9A)
EDO  A 413 (-4.7A)
None
None
 1.16A 5kf8A-3sf6A:
undetectable		 5kf8A-3sf6A:
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.
3tgw V-TYPE ATP SYNTHASE
BETA CHAIN

(Methanosarcina
mazei) 		PF00006
(ATP-synt_ab)
PF02874
(ATP-synt_ab_N) 		4 ARG A 257
GLU A 254
GLY A 307
PRO A 306
 None
 1.08A 5kf8A-3tgwA:
undetectable		 5kf8A-3tgwA:
20.49
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.
3thu MANDELATE RACEMASE /
MUCONATE LACTONIZING
ENZYME FAMILY
PROTEIN

(Sphingomonas
sp. SKA58) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 PRO A 105
GLY A 366
PRO A 365
ASP A 367
 None
 1.10A 5kf8A-3thuA:
undetectable		 5kf8A-3thuA:
20.76
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.
3ut2 CATALASE-PEROXIDASE
2

(Magnaporthe
oryzae) 		PF00141
(peroxidase) 		4 GLU A 362
PRO A 409
GLY A 353
ASP A 127
 None
 1.05A 5kf8A-3ut2A:
undetectable		 5kf8A-3ut2A:
16.21
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.
3vcn MANNONATE
DEHYDRATASE

(Caulobacter
vibrioides) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 PRO A 105
GLY A 366
PRO A 365
ASP A 367
 None
 1.12A 5kf8A-3vcnA:
undetectable		 5kf8A-3vcnA:
22.32
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.
3vsc PROTEIN CYSO

(Aeropyrum
pernix) 		PF00291
(PALP) 		4 PRO A 368
GLY A 339
PRO A 340
ASP A 369
 PLP  A 401 (-4.1A)
None
None
PLP  A 401 (-3.5A)
 1.05A 5kf8A-3vscA:
undetectable		 5kf8A-3vscA:
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.
3zeu PROBABLE TRNA
THREONYLCARBAMOYLADE
NOSINE BIOSYNTHESIS
PROTEIN GCP

(Salmonella
enterica) 		PF00814
(Peptidase_M22) 		4 PRO B 178
GLY B 180
PRO B 181
ASP B 167
 None
AGS  B1342 (-3.4A)
AGS  B1342 (-3.8A)
ADP  B1343 (-2.9A)
 0.92A 5kf8A-3zeuB:
undetectable		 5kf8A-3zeuB:
23.24
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.
3zo9 TREHALOSE
SYNTHASE/AMYLASE
TRES

(Mycolicibacterium
smegmatis) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		4 ARG A 164
GLU A 239
PRO A 166
TRP A 180
 None
 1.14A 5kf8A-3zo9A:
0.9		 5kf8A-3zo9A:
19.26
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.
3zz1 BETA-D-GLUCOSIDE
GLUCOHYDROLASE

(Trichoderma
reesei) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		4 ARG A 169
GLU A 166
GLY A 115
PRO A 116
 None
 1.14A 5kf8A-3zz1A:
undetectable		 5kf8A-3zz1A:
16.04
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.
4c51 CATALASE-PEROXIDASE

(Mycobacterium
tuberculosis) 		PF00141
(peroxidase) 		4 GLU A 318
PRO A 367
GLY A 309
ASP A  94
 None
None
None
HEM  A1741 ( 4.9A)
 0.95A 5kf8A-4c51A:
undetectable		 5kf8A-4c51A:
18.06
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.
4cxf RNA POLYMERASE SIGMA
FACTOR CNRH

(Cupriavidus
metallidurans) 		PF04542
(Sigma70_r2)
PF08281
(Sigma70_r4_2) 		4 ARG A  72
GLU A 158
PRO A  70
ASP A   5
 None
 1.14A 5kf8A-4cxfA:
undetectable		 5kf8A-4cxfA:
19.73
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.
4gn8 REGUCALCIN

(Mus musculus) 		PF08450
(SGL) 		4 ARG A 264
PRO A  35
GLY A  17
ASP A  33
 None
 1.14A 5kf8A-4gn8A:
undetectable		 5kf8A-4gn8A:
21.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4iig BETA-GLUCOSIDASE 1

(Aspergillus
aculeatus) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		4 ARG A 200
GLU A 197
GLY A 146
PRO A 147
 BGC  A 942 (-3.8A)
None
None
None
 1.16A 5kf8A-4iigA:
undetectable		 5kf8A-4iigA:
16.86
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.
4ir8 SEDOHEPTULOSE-1,7
BISPHOSPHATASE,
PUTATIVE

(Toxoplasma
gondii) 		PF00316
(FBPase) 		4 TRP A 119
PRO A 244
GLY A 240
ASP A 245
 None
 1.16A 5kf8A-4ir8A:
undetectable		 5kf8A-4ir8A:
21.61
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.
4isb LONG CHAIN FATTY
ACID COA LIGASE
FADD10

(Mycobacterium
tuberculosis) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		4 PRO A 121
GLY A  76
PRO A  77
ASP A  74
 None
 1.15A 5kf8A-4isbA:
undetectable		 5kf8A-4isbA:
18.83
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.
4jed GLUTATHIONE
S-TRANSFERASE

(Methylobacterium
radiotolerans) 		PF13410
(GST_C_2)
PF13417
(GST_N_3) 		4 ARG A 156
PRO A  87
GLY A  91
ASP A  88
 None
 1.13A 5kf8A-4jedA:
undetectable		 5kf8A-4jedA:
22.49
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.
4jnd CA(2+)/CALMODULIN-DE
PENDENT PROTEIN
KINASE PHOSPHATASE

(Caenorhabditis
elegans) 		PF00481
(PP2C) 		4 ARG A 248
GLY A  63
PRO A  64
ASP A  71
 None
 1.16A 5kf8A-4jndA:
undetectable		 5kf8A-4jndA:
21.44
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.
4kg7 PEPTIDASE S8 AND
S53, SUBTILISIN,
KEXIN, SEDOLISIN

(Mycolicibacterium
smegmatis) 		PF00082
(Peptidase_S8) 		4 TRP A 265
PRO A 255
GLY A 300
PRO A 301
 None
 1.11A 5kf8A-4kg7A:
undetectable		 5kf8A-4kg7A:
22.98
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.
4kxb GLUTAMYL
AMINOPEPTIDASE

(Homo sapiens) 		PF01433
(Peptidase_M1)
PF11838
(ERAP1_C) 		4 ARG A 137
GLU A 167
PRO A 467
ASP A 468
 None
 1.11A 5kf8A-4kxbA:
undetectable		 5kf8A-4kxbA:
16.54
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.
4lla LEUKOCYTE
IMMUNOGLOBULIN-LIKE
RECEPTOR SUBFAMILY B
MEMBER 2

(Homo sapiens) 		PF13895
(Ig_2) 		4 ARG A  77
GLU A  41
GLY A  74
ASP A  96
 None
 1.08A 5kf8A-4llaA:
undetectable		 5kf8A-4llaA:
18.52
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.
4mah AA11 LYTIC
POLYSACCHARIDE
MONOOXYGENASE

(Aspergillus
oryzae) 		no annotation 4 ARG A 191
GLU A  88
GLY A 196
PRO A 195
 None
 1.11A 5kf8A-4mahA:
undetectable		 5kf8A-4mahA:
19.60
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.
4mfi SN-GLYCEROL-3-PHOSPH
ATE ABC TRANSPORTER
SUBSTRATE-BINDING
PROTEIN USPB

(Mycobacterium
tuberculosis) 		PF13416
(SBP_bac_8) 		4 GLU A 179
PRO A 170
GLY A 173
PRO A 174
 None
 1.11A 5kf8A-4mfiA:
undetectable		 5kf8A-4mfiA:
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.
4oo3 HYPOTHETICAL PROTEIN

(Parabacteroides
merdae) 		PF01408
(GFO_IDH_MocA)
PF16490
(Oxidoreduct_C) 		4 ARG A 226
GLY A 237
ASP A 242
TRP A 329
 None
 0.85A 5kf8A-4oo3A:
undetectable		 5kf8A-4oo3A:
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.
4ow8 SERINE/THREONINE-PRO
TEIN KINASE PKNA

(Mycobacterium
tuberculosis) 		PF00069
(Pkinase) 		4 ARG A 215
GLU A 209
GLY A 145
PRO A 144
 None
 1.03A 5kf8A-4ow8A:
undetectable		 5kf8A-4ow8A:
20.63
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.
4x3f SERINE/THREONINE-PRO
TEIN KINASE PKNA

(Mycobacterium
tuberculosis) 		PF00069
(Pkinase) 		4 ARG A 215
GLU A 209
GLY A 145
PRO A 144
 None
 1.16A 5kf8A-4x3fA:
undetectable		 5kf8A-4x3fA:
20.88
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.
4xkm XYLOSE ISOMERASE

(Bacteroides
thetaiotaomicron) 		no annotation 4 TRP A 190
GLU A 234
ASP A 311
TRP A  51
 None
MN  A 501 (-2.5A)
MN  A 502 (-2.9A)
None
 1.01A 5kf8A-4xkmA:
0.9		 5kf8A-4xkmA:
20.81
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.
4y7l TYPE VI SECRETION
PROTEIN ICMF

(Escherichia
coli) 		PF06744
(IcmF_C) 		4 TRP A1045
PRO A1022
GLY A1046
ASP A 997
 None
 1.13A 5kf8A-4y7lA:
undetectable		 5kf8A-4y7lA:
22.02
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.
4y7m TYPE VI SECRETION
PROTEIN ICMF

(Escherichia
coli) 		PF06744
(IcmF_C) 		4 TRP C1045
PRO C1022
GLY C1046
ASP C 997
 None
 1.15A 5kf8A-4y7mC:
undetectable		 5kf8A-4y7mC:
21.10
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.
4ysw XANTHINE
DEHYDROGENASE/OXIDAS
E

(Rattus
norvegicus) 		PF00111
(Fer2)
PF00941
(FAD_binding_5)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2)
PF03450
(CO_deh_flav_C) 		4 GLU A 231
GLY A 630
PRO A 629
ASP A 673
 None
 1.03A 5kf8A-4yswA:
0.0		 5kf8A-4yswA:
14.25
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.
4zb6 PCURE2P4

(Phanerochaete
chrysosporium) 		PF00043
(GST_C)
PF02798
(GST_N) 		4 TRP A 176
PRO A  60
GLY A  16
PRO A  17
 GDS  A 300 (-4.0A)
GDS  A 300 (-4.5A)
GDS  A 300 (-3.7A)
NA  A 301 ( 4.6A)
 1.03A 5kf8A-4zb6A:
undetectable		 5kf8A-4zb6A:
21.19
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.
4zb8 PCURE2P6

(Phanerochaete
chrysosporium) 		PF00043
(GST_C)
PF02798
(GST_N) 		4 TRP A 175
PRO A  59
GLY A  15
PRO A  16
 GDS  A 300 (-4.0A)
GDS  A 300 (-4.4A)
GDS  A 300 (-3.6A)
GDS  A 300 (-4.2A)
 1.08A 5kf8A-4zb8A:
undetectable		 5kf8A-4zb8A:
19.34
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.
5fjj BETA-GLUCOSIDASE

(Aspergillus
oryzae) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		4 ARG A 201
GLU A 198
GLY A 147
PRO A 148
 None
 1.12A 5kf8A-5fjjA:
undetectable		 5kf8A-5fjjA:
16.22
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.
5g2x GROUP II
INTRON-ENCODED
PROTEIN LTRA

(Lactococcus
lactis) 		PF00078
(RVT_1)
PF01348
(Intron_maturas2) 		4 ARG C 115
GLU C 112
GLY C  53
ASP C  57
 None
 1.16A 5kf8A-5g2xC:
undetectable		 5kf8A-5g2xC:
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.
5hmq 4-HYDROXYPHENYLPYRUV
ATE DIOXYGENASE

(Pseudomonas
putida) 		PF00903
(Glyoxalase)
PF01261
(AP_endonuc_2)
PF14696
(Glyoxalase_5) 		4 ARG A 310
GLU A 593
GLY A 359
PRO A 360
 None
 1.06A 5kf8A-5hmqA:
1.3		 5kf8A-5hmqA:
18.73
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.
5iq0 ESTERASE

(uncultured
bacterium) 		PF07859
(Abhydrolase_3) 		4 PRO A  24
GLY A  11
PRO A  10
ASP A  23
 None
 1.14A 5kf8A-5iq0A:
undetectable		 5kf8A-5iq0A:
19.01
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5kf2 PREDICTED
ACETYLTRANSFERASE

(Clostridium
acetobutylicum) 		PF00583
(Acetyltransf_1) 		8 ARG A 192
TRP A 193
GLU A 196
PRO A 235
GLY A 251
PRO A 252
ASP A 287
TRP A 288
 None
PO4  A 405 (-3.7A)
None
None
None
None
None
None
 0.28A 5kf8A-5kf2A:
52.0		 5kf8A-5kf2A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5kf2 PREDICTED
ACETYLTRANSFERASE

(Clostridium
acetobutylicum) 		PF00583
(Acetyltransf_1) 		5 TRP A 193
PRO A 236
PRO A 252
ASP A 287
TRP A 288
 PO4  A 405 (-3.7A)
None
None
None
None
 1.45A 5kf8A-5kf2A:
52.0		 5kf8A-5kf2A:
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.
5l46 DIMETHYLGLYCINE
DEHYDROGENASE,
MITOCHONDRIAL

(Homo sapiens) 		PF01266
(DAO)
PF01571
(GCV_T)
PF08669
(GCV_T_C)
PF16350
(FAO_M) 		4 ARG A 344
GLU A 313
GLY A 310
PRO A 311
 None
 0.74A 5kf8A-5l46A:
undetectable		 5kf8A-5l46A:
17.54
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.
5mps PRE-MRNA-PROCESSING
FACTOR 17

(Saccharomyces
cerevisiae) 		PF00249
(Myb_DNA-binding) 		4 ARG o 200
PRO o 162
GLY o 182
ASP o 184
 None
 1.16A 5kf8A-5mpso:
undetectable		 5kf8A-5mpso:
21.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5n4l CERULOPLASMIN

(Rattus
norvegicus) 		no annotation 4 GLU A 465
GLY A 475
ASP A 474
TRP A 314
 None
 1.10A 5kf8A-5n4lA:
undetectable		 5kf8A-5n4lA:
15.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5nhb XYLOSE ISOMERASE

(Piromyces sp.
E2) 		no annotation 4 TRP A 189
GLU A 233
ASP A 310
TRP A  50
 None
FE2  A 501 (-2.2A)
FE2  A 502 ( 3.9A)
None
 1.00A 5kf8A-5nhbA:
undetectable		 5kf8A-5nhbA:
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.
5tgt GLUTAMATE--TRNA
LIGASE

(Pseudomonas
aeruginosa) 		PF00749
(tRNA-synt_1c) 		4 ARG A  83
GLU A  86
GLY A  80
PRO A  81
 None
 1.15A 5kf8A-5tgtA:
undetectable		 5kf8A-5tgtA:
21.46
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.
5tgt GLUTAMATE--TRNA
LIGASE

(Pseudomonas
aeruginosa) 		PF00749
(tRNA-synt_1c) 		4 GLU A  86
PRO A  73
GLY A  80
PRO A  81
 None
 1.09A 5kf8A-5tgtA:
undetectable		 5kf8A-5tgtA:
21.46
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.
5uc5 CHS2 CHALCONE
SYNTHASE

(Malus domestica) 		no annotation 4 GLU A 238
PRO A 228
GLY A  15
PRO A  16
 None
 1.06A 5kf8A-5uc5A:
undetectable		 5kf8A-5uc5A:
15.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ui2 ORANGE
CAROTENOID-BINDING
PROTEIN

(Arthrospira
maxima) 		PF02136
(NTF2)
PF09150
(Carot_N) 		4 ARG A 115
GLU A 112
GLY A  57
PRO A  56
 None
None
SUC  A 401 (-4.2A)
SUC  A 401 (-3.8A)
 0.88A 5kf8A-5ui2A:
undetectable		 5kf8A-5ui2A:
21.20
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.
5w1j THIOREDOXIN
GLUTATHIONE
REDUCTASE

(Echinococcus
granulosus) 		no annotation 4 ARG A 260
GLY A 116
ASP A 139
TRP A 150
 None
FAD  A 601 (-3.1A)
FAD  A 601 (-3.0A)
None
 1.16A 5kf8A-5w1jA:
undetectable		 5kf8A-5w1jA:
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.
5x4r S PROTEIN

(Middle East
respiratory
syndrome-related
coronavirus) 		no annotation 4 ARG A 141
GLU A 249
GLY A 121
TRP A 310
 None
 0.80A 5kf8A-5x4rA:
undetectable		 5kf8A-5x4rA:
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.
5x59 S PROTEIN

(Middle East
respiratory
syndrome-related
coronavirus) 		PF01601
(Corona_S2)
PF09408
(Spike_rec_bind) 		4 ARG A 141
GLU A 249
GLY A 121
TRP A 310
 None
 0.78A 5kf8A-5x59A:
undetectable		 5kf8A-5x59A:
13.82
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.
5y6q ALDEHYDE OXIDASE
LARGE SUBUNIT

(Methylobacillus
sp. KY4400) 		no annotation 4 GLU C 614
PRO C 607
PRO C 611
ASP C 609
 None
 1.14A 5kf8A-5y6qC:
undetectable		 5kf8A-5y6qC:
14.98
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.
5ypt STILBENECARBOXYLATE
SYNTHASE 1

(Marchantia
polymorpha) 		no annotation 4 ARG A 387
GLU A 240
GLY A  17
PRO A  18
 None
 1.05A 5kf8A-5yptA:
undetectable		 5kf8A-5yptA:
13.33
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.
5ypt STILBENECARBOXYLATE
SYNTHASE 1

(Marchantia
polymorpha) 		no annotation 4 GLU A 240
PRO A 230
GLY A  17
PRO A  18
 None
 1.04A 5kf8A-5yptA:
undetectable		 5kf8A-5yptA:
13.33
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.
5yq0 COFJ

(Escherichia
coli) 		no annotation 4 TRP A 121
PRO A  93
GLY A 151
PRO A 150
 None
 1.16A 5kf8A-5yq0A:
undetectable		 5kf8A-5yq0A:
13.33
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.
6auj THYMIDYLATE SYNTHASE

(Elizabethkingia
anophelis) 		PF00303
(Thymidylat_synt) 		4 ARG A 110
GLU A 145
GLY A  99
PRO A 100
 None
 1.07A 5kf8A-6aujA:
undetectable		 5kf8A-6aujA:
19.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6b2q SERINE/THREONINE-PRO
TEIN KINASE PKNA

(Mycobacterium
tuberculosis) 		no annotation 4 ARG A 215
GLU A 209
GLY A 145
PRO A 144
 None
 1.00A 5kf8A-6b2qA:
undetectable		 5kf8A-6b2qA:
12.90
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.
6btm ALTERNATIVE COMPLEX
III SUBUNIT B
ALTERNATIVE COMPLEX
III SUBUNIT E

(Flavobacterium
johnsoniae) 		no annotation 4 GLU E  36
PRO E  32
GLY B  72
PRO B  73
 None
None
E87  B1103 (-4.0A)
None
 1.07A 5kf8A-6btmE:
undetectable		 5kf8A-6btmE:
12.19