SIMILAR PATTERNS OF AMINO ACIDS FOR 6BKL_C_EU7C101_0

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.
1b4e PROTEIN
(5-AMINOLEVULINIC
ACID DEHYDRATASE)

(Escherichia
coli) 		PF00490
(ALAD) 		5 SER A 117
VAL A 153
ALA A 156
VAL A  99
GLY A 158
 None
GOL  A 410 ( 4.5A)
GOL  A 410 (-3.5A)
None
None
 1.22A 6bklA-1b4eA:
undetectable
6bklB-1b4eA:
undetectable
6bklC-1b4eA:
undetectable
6bklD-1b4eA:
undetectable		 6bklA-1b4eA:
6.19
6bklB-1b4eA:
6.19
6bklC-1b4eA:
6.19
6bklD-1b4eA:
6.19
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.
1d4e FLAVOCYTOCHROME C
FUMARATE REDUCTASE

(Shewanella
oneidensis) 		PF00890
(FAD_binding_2)
PF14537
(Cytochrom_c3_2) 		5 ALA A 167
VAL A 256
ALA A 257
VAL A 554
GLY A 134
 FAD  A 600 (-3.7A)
None
None
None
FAD  A 600 (-3.1A)
 1.24A 6bklA-1d4eA:
undetectable
6bklB-1d4eA:
undetectable
6bklC-1d4eA:
undetectable
6bklD-1d4eA:
undetectable		 6bklA-1d4eA:
3.84
6bklB-1d4eA:
3.84
6bklC-1d4eA:
3.84
6bklD-1d4eA:
3.84
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.
1dbn PROTEIN
(LEUKOAGGLUTININ)

(Maackia
amurensis) 		PF00139
(Lectin_legB) 		5 VAL A  47
ALA A 217
SER A 216
VAL A 105
GLY A  88
 None
 1.25A 6bklA-1dbnA:
undetectable
6bklB-1dbnA:
undetectable
6bklC-1dbnA:
undetectable
6bklD-1dbnA:
undetectable		 6bklA-1dbnA:
6.28
6bklB-1dbnA:
6.28
6bklC-1dbnA:
6.28
6bklD-1dbnA:
6.28
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.
1dm3 BIOSYNTHETIC
THIOLASE ACETYLATED
AT CYS89

(Zoogloea
ramigera) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		5 ALA A   8
VAL A  38
ALA A  10
SER A   9
VAL A 112
 None
 1.24A 6bklA-1dm3A:
undetectable
6bklB-1dm3A:
undetectable
6bklC-1dm3A:
undetectable
6bklD-1dm3A:
undetectable		 6bklA-1dm3A:
5.29
6bklB-1dm3A:
5.29
6bklC-1dm3A:
5.29
6bklD-1dm3A:
5.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ijt FIBROBLAST GROWTH
FACTOR 4

(Homo sapiens) 		PF00167
(FGF) 		5 SER A 194
ALA A 168
VAL A 199
ALA A 180
GLY A 190
 None
 1.15A 6bklA-1ijtA:
undetectable
6bklB-1ijtA:
undetectable
6bklC-1ijtA:
undetectable
6bklD-1ijtA:
undetectable		 6bklA-1ijtA:
10.94
6bklB-1ijtA:
10.94
6bklC-1ijtA:
10.94
6bklD-1ijtA:
10.94
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.
1m64 FLAVOCYTOCHROME C3

(Shewanella
frigidimarina) 		PF00890
(FAD_binding_2)
PF14537
(Cytochrom_c3_2) 		5 ALA A 137
SER A 140
ALA A 165
VAL A 257
GLY A 162
 FAD  A3000 (-3.5A)
None
FAD  A3000 (-3.3A)
None
None
 1.08A 6bklA-1m64A:
undetectable
6bklB-1m64A:
undetectable
6bklC-1m64A:
undetectable
6bklD-1m64A:
undetectable		 6bklA-1m64A:
3.93
6bklB-1m64A:
3.93
6bklC-1m64A:
3.93
6bklD-1m64A:
3.93
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.
1omo ALANINE
DEHYDROGENASE

(Archaeoglobus
fulgidus) 		PF02423
(OCD_Mu_crystall) 		5 ALA A  97
VAL A 304
ALA A 308
VAL A  11
GLY A 314
 ALA  A  97 ( 0.0A)
VAL  A 304 ( 0.6A)
ALA  A 308 ( 0.0A)
VAL  A  11 ( 0.6A)
GLY  A 314 ( 0.0A)
 1.20A 6bklA-1omoA:
undetectable
6bklB-1omoA:
undetectable
6bklC-1omoA:
undetectable
6bklD-1omoA:
undetectable		 6bklA-1omoA:
5.81
6bklB-1omoA:
5.81
6bklC-1omoA:
5.81
6bklD-1omoA:
5.81
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.
1t06 HYPOTHETICAL PROTEIN

(Bacillus cereus) 		PF08713
(DNA_alkylation) 		5 ALA A 170
SER A 169
ALA A 127
SER A 130
SER A  95
 None
 1.28A 6bklA-1t06A:
undetectable
6bklB-1t06A:
undetectable
6bklC-1t06A:
undetectable
6bklD-1t06A:
undetectable		 6bklA-1t06A:
8.81
6bklB-1t06A:
8.81
6bklC-1t06A:
8.81
6bklD-1t06A:
8.81
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.
1v6m GALACTOSE-BINDING
LECTIN

(Arachis
hypogaea) 		PF00139
(Lectin_legB) 		5 VAL A  43
ALA A 208
SER A 207
SER A 209
GLY A  84
 None
 1.14A 6bklA-1v6mA:
undetectable
6bklB-1v6mA:
undetectable
6bklC-1v6mA:
undetectable
6bklD-1v6mA:
undetectable		 6bklA-1v6mA:
6.96
6bklB-1v6mA:
6.96
6bklC-1v6mA:
6.96
6bklD-1v6mA:
6.96
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.
1wst MULTIPLE SUBSTRATE
AMINOTRANSFERASE

(Thermococcus
profundus) 		PF00155
(Aminotran_1_2) 		5 ALA A  47
VAL A  43
SER A  45
VAL A 363
GLY A 400
 None
 1.26A 6bklA-1wstA:
undetectable
6bklB-1wstA:
undetectable
6bklC-1wstA:
undetectable
6bklD-1wstA:
undetectable		 6bklA-1wstA:
6.19
6bklB-1wstA:
6.19
6bklC-1wstA:
6.19
6bklD-1wstA:
6.19
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.
1wxj TRYPTOPHAN SYNTHASE
ALPHA CHAIN

(Thermus
thermophilus) 		PF00290
(Trp_syntA) 		5 ALA A  16
VAL A 205
ALA A 206
VAL A 194
GLY A 208
 None
None
None
None
IPL  A1001 (-3.8A)
 1.25A 6bklA-1wxjA:
undetectable
6bklB-1wxjA:
undetectable
6bklC-1wxjA:
undetectable
6bklD-1wxjA:
undetectable		 6bklA-1wxjA:
5.90
6bklB-1wxjA:
5.90
6bklC-1wxjA:
5.90
6bklD-1wxjA:
5.90
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.
1wy0 GERANYLGERANYL
PYROPHOSPHATE
SYNTHETASE

(Pyrococcus
horikoshii) 		PF00348
(polyprenyl_synt) 		5 ALA A 184
VAL A  53
SER A 185
SER A  57
GLY A 190
 None
 1.13A 6bklA-1wy0A:
undetectable
6bklB-1wy0A:
undetectable
6bklC-1wy0A:
undetectable
6bklD-1wy0A:
undetectable		 6bklA-1wy0A:
6.14
6bklB-1wy0A:
6.14
6bklC-1wy0A:
6.14
6bklD-1wy0A:
6.14
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.
1xzo HYPOTHETICAL PROTEIN
YPMQ

(Bacillus
subtilis) 		PF02630
(SCO1-SenC) 		5 VAL A 167
ALA A 170
SER A 171
VAL A  70
GLY A 143
 None
 1.26A 6bklA-1xzoA:
undetectable
6bklB-1xzoA:
undetectable
6bklC-1xzoA:
undetectable
6bklD-1xzoA:
undetectable		 6bklA-1xzoA:
9.20
6bklB-1xzoA:
9.20
6bklC-1xzoA:
9.20
6bklD-1xzoA:
9.20
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.
2a8i THREONINE ASPARTASE
1

(Homo sapiens) 		PF01112
(Asparaginase_2) 		5 ALA A 101
ALA A 266
SER A 251
VAL A 130
GLY A 264
 None
 1.15A 6bklA-2a8iA:
undetectable
6bklB-2a8iA:
undetectable
6bklC-2a8iA:
undetectable
6bklD-2a8iA:
undetectable		 6bklA-2a8iA:
4.81
6bklB-2a8iA:
4.81
6bklC-2a8iA:
4.81
6bklD-2a8iA:
4.81
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.
2bra NEDD9 INTERACTING
PROTEIN WITH
CALPONIN HOMOLOGY
AND LIM DOMAINS

(Mus musculus) 		PF01494
(FAD_binding_3) 		5 ALA A  71
VAL A 101
ALA A 104
VAL A 167
GLY A  44
 None
 0.98A 6bklA-2braA:
undetectable
6bklB-2braA:
undetectable
6bklC-2braA:
undetectable
6bklD-2braA:
undetectable		 6bklA-2braA:
4.13
6bklB-2braA:
4.13
6bklC-2braA:
4.13
6bklD-2braA:
4.13
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.
2d0d 2-HYDROXY-6-OXO-7-ME
THYLOCTA-2,4-DIENOAT
E HYDROLASE

(Pseudomonas
fluorescens) 		PF00561
(Abhydrolase_1) 		5 SER A  80
VAL A  15
ALA A  13
VAL A  63
GLY A  87
 None
 1.23A 6bklA-2d0dA:
undetectable
6bklB-2d0dA:
undetectable
6bklC-2d0dA:
undetectable
6bklD-2d0dA:
undetectable		 6bklA-2d0dA:
8.47
6bklB-2d0dA:
8.47
6bklC-2d0dA:
8.47
6bklD-2d0dA:
8.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2dzn PROBABLE 26S
PROTEASOME
REGULATORY SUBUNIT
P28

(Saccharomyces
cerevisiae) 		PF12796
(Ank_2) 		5 ALA A 211
VAL A 194
ALA A 190
VAL A 228
GLY A 187
 None
 1.13A 6bklA-2dznA:
undetectable
6bklB-2dznA:
undetectable
6bklC-2dznA:
undetectable
6bklD-2dznA:
undetectable		 6bklA-2dznA:
7.34
6bklB-2dznA:
7.34
6bklC-2dznA:
7.34
6bklD-2dznA:
7.34
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.
2f9q CYTOCHROME P450 2D6

(Homo sapiens) 		PF00067
(p450) 		5 ALA A 127
SER A 289
VAL A 119
ALA A 122
VAL A 298
 None
None
HEM  A 600 (-4.6A)
None
None
 0.98A 6bklA-2f9qA:
undetectable
6bklB-2f9qA:
undetectable
6bklC-2f9qA:
undetectable
6bklD-2f9qA:
undetectable		 6bklA-2f9qA:
4.46
6bklB-2f9qA:
4.46
6bklC-2f9qA:
4.46
6bklD-2f9qA:
4.46
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.
2fqx MEMBRANE LIPOPROTEIN
TMPC

(Treponema
pallidum) 		PF02608
(Bmp) 		5 SER A  96
ALA A  91
VAL A 106
ALA A  83
VAL A 117
 None
 1.26A 6bklA-2fqxA:
undetectable
6bklB-2fqxA:
undetectable
6bklC-2fqxA:
undetectable
6bklD-2fqxA:
undetectable		 6bklA-2fqxA:
7.51
6bklB-2fqxA:
7.51
6bklC-2fqxA:
7.51
6bklD-2fqxA:
7.51
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.
2ibu ACETYL-COA
ACETYLTRANSFERASE

(Homo sapiens) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		5 ALA A 333
ALA A 410
SER A 411
VAL A 374
GLY A 408
 None
 1.17A 6bklA-2ibuA:
undetectable
6bklB-2ibuA:
undetectable
6bklC-2ibuA:
undetectable
6bklD-2ibuA:
undetectable		 6bklA-2ibuA:
3.80
6bklB-2ibuA:
3.80
6bklC-2ibuA:
3.80
6bklD-2ibuA:
3.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2k3n TUSP1

(Nephila
antipodiana) 		PF12042
(RP1-2) 		5 SER A  51
ALA A  46
SER A  45
SER A  47
GLY A  81
 None
 1.19A 6bklA-2k3nA:
undetectable
6bklB-2k3nA:
undetectable
6bklC-2k3nA:
undetectable
6bklD-2k3nA:
undetectable		 6bklA-2k3nA:
12.80
6bklB-2k3nA:
12.80
6bklC-2k3nA:
12.80
6bklD-2k3nA:
12.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2nvv ACETYL-COA
HYDROLASE/TRANSFERAS
E FAMILY PROTEIN

(Porphyromonas
gingivalis) 		PF02550
(AcetylCoA_hydro)
PF13336
(AcetylCoA_hyd_C) 		5 ALA A  61
SER A  62
VAL A 285
VAL A 259
GLY A 378
 ALA  A  61 ( 0.0A)
SER  A  62 ( 0.0A)
VAL  A 285 ( 0.6A)
VAL  A 259 ( 0.6A)
GLY  A 378 ( 0.0A)
 1.02A 6bklA-2nvvA:
undetectable
6bklB-2nvvA:
undetectable
6bklC-2nvvA:
undetectable
6bklD-2nvvA:
undetectable		 6bklA-2nvvA:
11.88
6bklB-2nvvA:
11.88
6bklC-2nvvA:
11.88
6bklD-2nvvA:
11.88
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.
2nvv ACETYL-COA
HYDROLASE/TRANSFERAS
E FAMILY PROTEIN

(Porphyromonas
gingivalis) 		PF02550
(AcetylCoA_hydro)
PF13336
(AcetylCoA_hyd_C) 		5 SER A  62
ALA A  29
VAL A 285
SER A 306
GLY A 141
 SER  A  62 ( 0.0A)
ALA  A  29 ( 0.0A)
VAL  A 285 ( 0.6A)
SER  A 306 ( 0.0A)
GLY  A 141 ( 0.0A)
 1.24A 6bklA-2nvvA:
undetectable
6bklB-2nvvA:
undetectable
6bklC-2nvvA:
undetectable
6bklD-2nvvA:
undetectable		 6bklA-2nvvA:
11.88
6bklB-2nvvA:
11.88
6bklC-2nvvA:
11.88
6bklD-2nvvA:
11.88
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.
2nvv ACETYL-COA
HYDROLASE/TRANSFERAS
E FAMILY PROTEIN

(Porphyromonas
gingivalis) 		PF02550
(AcetylCoA_hydro)
PF13336
(AcetylCoA_hyd_C) 		5 SER A  62
ALA A  29
VAL A 285
SER A 306
GLY A 143
 SER  A  62 ( 0.0A)
ALA  A  29 ( 0.0A)
VAL  A 285 ( 0.6A)
SER  A 306 ( 0.0A)
GLY  A 143 ( 0.0A)
 1.22A 6bklA-2nvvA:
undetectable
6bklB-2nvvA:
undetectable
6bklC-2nvvA:
undetectable
6bklD-2nvvA:
undetectable		 6bklA-2nvvA:
11.88
6bklB-2nvvA:
11.88
6bklC-2nvvA:
11.88
6bklD-2nvvA:
11.88
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.
2qcv PUTATIVE
5-DEHYDRO-2-DEOXYGLU
CONOKINASE

(Bacillus
halodurans) 		PF00294
(PfkB) 		5 ALA A 277
SER A 276
VAL A 302
ALA A 299
SER A 298
 None
None
None
PGE  A 332 (-3.6A)
None
 0.94A 6bklA-2qcvA:
undetectable
6bklB-2qcvA:
undetectable
6bklC-2qcvA:
undetectable
6bklD-2qcvA:
undetectable		 6bklA-2qcvA:
5.17
6bklB-2qcvA:
5.17
6bklC-2qcvA:
5.17
6bklD-2qcvA:
5.17
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.
2qo3 ERYAII ERYTHROMYCIN
POLYKETIDE SYNTHASE
MODULES 3 AND 4

(Saccharopolyspora
erythraea) 		PF00109
(ketoacyl-synt)
PF00698
(Acyl_transf_1)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		5 ALA A 813
VAL A 838
ALA A 841
VAL A 834
GLY A 717
 None
 1.12A 6bklA-2qo3A:
undetectable
6bklB-2qo3A:
undetectable
6bklC-2qo3A:
undetectable
6bklD-2qo3A:
undetectable		 6bklA-2qo3A:
3.82
6bklB-2qo3A:
3.82
6bklC-2qo3A:
3.82
6bklD-2qo3A:
3.82
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.
2qtp UNCHARACTERIZED
PROTEIN

(Ruegeria
pomeroyi) 		PF06684
(AA_synth) 		5 ALA A  83
SER A  82
VAL A  32
VAL A  30
GLY A  58
 None
 1.04A 6bklA-2qtpA:
undetectable
6bklB-2qtpA:
undetectable
6bklC-2qtpA:
undetectable
6bklD-2qtpA:
undetectable		 6bklA-2qtpA:
8.25
6bklB-2qtpA:
8.25
6bklC-2qtpA:
8.25
6bklD-2qtpA:
8.25
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.
2r1f PREDICTED
AMINODEOXYCHORISMATE
LYASE

(Escherichia
coli) 		PF02618
(YceG) 		5 ALA A 285
VAL A 209
ALA A 212
SER A 213
GLY A 288
 None
None
None
None
CD  A   1 ( 4.5A)
 1.26A 6bklA-2r1fA:
undetectable
6bklB-2r1fA:
undetectable
6bklC-2r1fA:
undetectable
6bklD-2r1fA:
undetectable		 6bklA-2r1fA:
6.49
6bklB-2r1fA:
6.49
6bklC-2r1fA:
6.49
6bklD-2r1fA:
6.49
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.
2r79 PERIPLASMIC BINDING
PROTEIN

(Pseudomonas
aeruginosa) 		PF01497
(Peripla_BP_2) 		5 ALA A 202
VAL A 172
ALA A 183
VAL A 223
GLY A 189
 None
 1.23A 6bklA-2r79A:
undetectable
6bklB-2r79A:
undetectable
6bklC-2r79A:
undetectable
6bklD-2r79A:
undetectable		 6bklA-2r79A:
7.30
6bklB-2r79A:
7.30
6bklC-2r79A:
7.30
6bklD-2r79A:
7.30
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.
2uw1 PLASTID DELTA4
MULTIFUNCTIONAL
ACYL-ACYL CARRIER
PROTEIN DESATURASE

(Hedera helix) 		PF03405
(FA_desaturase_2) 		5 ALA B 249
VAL B 322
ALA B 318
VAL B 305
GLY B 315
 None
 1.23A 6bklA-2uw1B:
undetectable
6bklB-2uw1B:
undetectable
6bklC-2uw1B:
undetectable
6bklD-2uw1B:
undetectable		 6bklA-2uw1B:
6.25
6bklB-2uw1B:
6.25
6bklC-2uw1B:
6.25
6bklD-2uw1B:
6.25
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.
2was 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE

(Saccharomyces
cerevisiae) 		PF01648
(ACPS) 		5 ALA B1855
VAL B1819
VAL B1867
SER B1822
GLY B1824
 None
 1.16A 6bklA-2wasB:
undetectable
6bklB-2wasB:
undetectable
6bklC-2wasB:
undetectable
6bklD-2wasB:
undetectable		 6bklA-2wasB:
11.61
6bklB-2wasB:
11.61
6bklC-2wasB:
11.61
6bklD-2wasB:
11.61
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.
2zbw THIOREDOXIN
REDUCTASE

(Thermus
thermophilus) 		PF07992
(Pyr_redox_2) 		5 ALA A 308
VAL A  24
ALA A  20
VAL A   8
GLY A  17
 None
 1.28A 6bklA-2zbwA:
undetectable
6bklB-2zbwA:
undetectable
6bklC-2zbwA:
undetectable
6bklD-2zbwA:
undetectable		 6bklA-2zbwA:
8.70
6bklB-2zbwA:
8.70
6bklC-2zbwA:
8.70
6bklD-2zbwA:
8.70
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.
2zsg AMINOPEPTIDASE P,
PUTATIVE

(Thermotoga
maritima) 		PF00557
(Peptidase_M24)
PF01321
(Creatinase_N) 		5 ALA A 198
VAL A 216
ALA A 192
SER A 197
GLY A 202
 None
 1.14A 6bklA-2zsgA:
undetectable
6bklB-2zsgA:
undetectable
6bklC-2zsgA:
undetectable
6bklD-2zsgA:
undetectable		 6bklA-2zsgA:
6.85
6bklB-2zsgA:
6.85
6bklC-2zsgA:
6.85
6bklD-2zsgA:
6.85
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.
3a1i AMIDASE

(Rhodococcus sp.
N-771) 		PF01425
(Amidase) 		5 ALA A 187
ALA A 139
SER A 175
VAL A  99
GLY A 137
 None
 1.15A 6bklA-3a1iA:
undetectable
6bklB-3a1iA:
undetectable
6bklC-3a1iA:
undetectable
6bklD-3a1iA:
undetectable		 6bklA-3a1iA:
4.46
6bklB-3a1iA:
4.46
6bklC-3a1iA:
4.46
6bklD-3a1iA:
4.46
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.
3a1i AMIDASE

(Rhodococcus sp.
N-771) 		PF01425
(Amidase) 		5 ALA A 429
SER A 430
ALA A 168
SER A 150
GLY A 170
 None
 1.22A 6bklA-3a1iA:
undetectable
6bklB-3a1iA:
undetectable
6bklC-3a1iA:
undetectable
6bklD-3a1iA:
undetectable		 6bklA-3a1iA:
4.46
6bklB-3a1iA:
4.46
6bklC-3a1iA:
4.46
6bklD-3a1iA:
4.46
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.
3a28 L-2.3-BUTANEDIOL
DEHYDROGENASE

(Corynebacterium
glutamicum) 		no annotation 5 ALA C 183
SER C 141
VAL C 229
VAL C 187
GLY C 253
 None
BME  C4462 ( 3.3A)
None
NAD  C4300 (-3.7A)
None
 1.27A 6bklA-3a28C:
undetectable
6bklB-3a28C:
undetectable
6bklC-3a28C:
undetectable
6bklD-3a28C:
undetectable		 6bklA-3a28C:
7.57
6bklB-3a28C:
7.57
6bklC-3a28C:
7.57
6bklD-3a28C:
7.57
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.
3ai2 NADPH-SORBOSE
REDUCTASE

(Gluconobacter
frateurii) 		PF13561
(adh_short_C2) 		5 ALA A  10
ALA A  24
VAL A  37
SER A  15
GLY A  20
 None
 1.20A 6bklA-3ai2A:
undetectable
6bklB-3ai2A:
undetectable
6bklC-3ai2A:
undetectable
6bklD-3ai2A:
undetectable		 6bklA-3ai2A:
6.84
6bklB-3ai2A:
6.84
6bklC-3ai2A:
6.84
6bklD-3ai2A:
6.84
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.
3cqo FBP32

(Morone
saxatilis) 		PF00754
(F5_F8_type_C) 		5 ALA A  28
VAL A 143
ALA A   7
VAL A 125
GLY A  10
 None
 1.28A 6bklA-3cqoA:
undetectable
6bklB-3cqoA:
undetectable
6bklC-3cqoA:
undetectable
6bklD-3cqoA:
undetectable		 6bklA-3cqoA:
6.14
6bklB-3cqoA:
6.14
6bklC-3cqoA:
6.14
6bklD-3cqoA:
6.14
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.
3fxg RHAMNONATE
DEHYDRATASE

(Fusarium
graminearum) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 ALA A 130
VAL A  92
ALA A  88
VAL A  68
GLY A  85
 None
 1.09A 6bklA-3fxgA:
undetectable
6bklB-3fxgA:
undetectable
6bklC-3fxgA:
undetectable
6bklD-3fxgA:
undetectable		 6bklA-3fxgA:
4.13
6bklB-3fxgA:
4.13
6bklC-3fxgA:
4.13
6bklD-3fxgA:
4.13
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.
3if9 GLYCINE OXIDASE

(Bacillus
subtilis) 		PF01266
(DAO) 		5 VAL A 200
ALA A 201
SER A 202
VAL A 198
GLY A  16
 None
None
FAD  A 371 (-3.5A)
None
None
 1.20A 6bklA-3if9A:
undetectable
6bklB-3if9A:
undetectable
6bklC-3if9A:
undetectable
6bklD-3if9A:
undetectable		 6bklA-3if9A:
4.86
6bklB-3if9A:
4.86
6bklC-3if9A:
4.86
6bklD-3if9A:
4.86
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.
3lft UNCHARACTERIZED
PROTEIN

(Streptococcus
pneumoniae) 		PF04392
(ABC_sub_bind) 		5 ALA A 128
SER A 127
VAL A  99
SER A 103
GLY A 116
 None
 1.04A 6bklA-3lftA:
undetectable
6bklB-3lftA:
undetectable
6bklC-3lftA:
undetectable
6bklD-3lftA:
undetectable		 6bklA-3lftA:
7.54
6bklB-3lftA:
7.54
6bklC-3lftA:
7.54
6bklD-3lftA:
7.54
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.
3moi PROBABLE
DEHYDROGENASE

(Bordetella
bronchiseptica) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		5 VAL A 111
ALA A 114
VAL A  81
SER A  85
GLY A  88
 None
 1.28A 6bklA-3moiA:
undetectable
6bklB-3moiA:
undetectable
6bklC-3moiA:
undetectable
6bklD-3moiA:
undetectable		 6bklA-3moiA:
6.56
6bklB-3moiA:
6.56
6bklC-3moiA:
6.56
6bklD-3moiA:
6.56
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.
3mtj HOMOSERINE
DEHYDROGENASE

(Thiobacillus
denitrificans) 		PF00742
(Homoserine_dh)
PF01842
(ACT)
PF03447
(NAD_binding_3) 		5 ALA A 130
VAL A 309
ALA A 308
VAL A  14
GLY A 134
 None
 1.22A 6bklA-3mtjA:
undetectable
6bklB-3mtjA:
undetectable
6bklC-3mtjA:
undetectable
6bklD-3mtjA:
undetectable		 6bklA-3mtjA:
4.78
6bklB-3mtjA:
4.78
6bklC-3mtjA:
4.78
6bklD-3mtjA:
4.78
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.
3noj 4-CARBOXY-4-HYDROXY-
2-OXOADIPATE
ALDOLASE/OXALOACETAT
E DECARBOXYLASE

(Pseudomonas
putida) 		PF03737
(RraA-like) 		5 ALA A 115
VAL A 170
ALA A  58
VAL A 177
GLY A  27
 None
 1.22A 6bklA-3nojA:
undetectable
6bklB-3nojA:
undetectable
6bklC-3nojA:
undetectable
6bklD-3nojA:
undetectable		 6bklA-3nojA:
8.07
6bklB-3nojA:
8.07
6bklC-3nojA:
8.07
6bklD-3nojA:
8.07
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.
3okf 3-DEHYDROQUINATE
SYNTHASE

(Vibrio cholerae) 		PF01761
(DHQ_synthase) 		5 ALA A 304
ALA A 187
VAL A 308
SER A 273
GLY A 269
 None
 1.15A 6bklA-3okfA:
undetectable
6bklB-3okfA:
undetectable
6bklC-3okfA:
undetectable
6bklD-3okfA:
undetectable		 6bklA-3okfA:
6.65
6bklB-3okfA:
6.65
6bklC-3okfA:
6.65
6bklD-3okfA:
6.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3p42 PREDICTED PROTEIN

(Escherichia
coli) 		PF06251
(Caps_synth_GfcC) 		5 SER A 223
ALA A 155
VAL A  96
ALA A 181
VAL A 226
 None
 1.16A 6bklA-3p42A:
undetectable
6bklB-3p42A:
undetectable
6bklC-3p42A:
undetectable
6bklD-3p42A:
undetectable		 6bklA-3p42A:
9.32
6bklB-3p42A:
9.32
6bklC-3p42A:
9.32
6bklD-3p42A:
9.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pgx CARVEOL
DEHYDROGENASE

(Mycobacterium
avium) 		PF13561
(adh_short_C2) 		5 ALA A 163
ALA A 176
SER A 175
VAL A 128
GLY A 180
 None
 1.27A 6bklA-3pgxA:
undetectable
6bklB-3pgxA:
undetectable
6bklC-3pgxA:
undetectable
6bklD-3pgxA:
undetectable		 6bklA-3pgxA:
13.08
6bklB-3pgxA:
13.08
6bklC-3pgxA:
13.08
6bklD-3pgxA:
13.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qlj SHORT CHAIN
DEHYDROGENASE

(Mycobacterium
avium) 		PF00106
(adh_short) 		5 ALA A 160
ALA A 173
SER A 172
VAL A 120
GLY A 177
 None
 1.28A 6bklA-3qljA:
undetectable
6bklB-3qljA:
undetectable
6bklC-3qljA:
undetectable
6bklD-3qljA:
undetectable		 6bklA-3qljA:
6.43
6bklB-3qljA:
6.43
6bklC-3qljA:
6.43
6bklD-3qljA:
6.43
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.
3sc4 SHORT CHAIN
DEHYDROGENASE
(A0QTM2 HOMOLOG)

(Mycolicibacterium
thermoresistibile) 		PF00106
(adh_short) 		5 ALA A  33
VAL A  80
ALA A  79
VAL A 127
GLY A  68
 None
 1.13A 6bklA-3sc4A:
undetectable
6bklB-3sc4A:
undetectable
6bklC-3sc4A:
undetectable
6bklD-3sc4A:
undetectable		 6bklA-3sc4A:
8.40
6bklB-3sc4A:
8.40
6bklC-3sc4A:
8.40
6bklD-3sc4A:
8.40
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.
3wgk CELL DIVISION
PROTEIN FTSZ

(Staphylococcus
aureus) 		PF00091
(Tubulin)
PF12327
(FtsZ_C) 		5 SER A 103
VAL A 117
ALA A 118
VAL A  19
GLY A 130
 None
 1.17A 6bklA-3wgkA:
undetectable
6bklB-3wgkA:
undetectable
6bklC-3wgkA:
undetectable
6bklD-3wgkA:
undetectable		 6bklA-3wgkA:
8.14
6bklB-3wgkA:
8.14
6bklC-3wgkA:
8.14
6bklD-3wgkA:
8.14
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.
3zzu ELONGATION FACTOR G

(Staphylococcus
aureus) 		PF00009
(GTP_EFTU)
PF00679
(EFG_C)
PF03144
(GTP_EFTU_D2)
PF03764
(EFG_IV)
PF14492
(EFG_II) 		5 SER A  95
ALA A 102
VAL A 119
ALA A 123
VAL A  92
 None
 1.04A 6bklA-3zzuA:
undetectable
6bklB-3zzuA:
undetectable
6bklC-3zzuA:
undetectable
6bklD-3zzuA:
undetectable		 6bklA-3zzuA:
3.39
6bklB-3zzuA:
3.39
6bklC-3zzuA:
3.39
6bklD-3zzuA:
3.39
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.
4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E

(Streptomyces
cinnabarigriseus) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 ALA A 260
VAL A 252
ALA A 229
SER A 230
VAL A 269
 None
NAP  A1447 (-3.8A)
None
NAP  A1447 (-3.6A)
None
 1.26A 6bklA-4a0sA:
undetectable
6bklB-4a0sA:
undetectable
6bklC-4a0sA:
undetectable
6bklD-4a0sA:
undetectable		 6bklA-4a0sA:
4.81
6bklB-4a0sA:
4.81
6bklC-4a0sA:
4.81
6bklD-4a0sA:
4.81
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.
4am3 POLYRIBONUCLEOTIDE
NUCLEOTIDYLTRANSFERA
SE

(Caulobacter
vibrioides) 		PF00013
(KH_1)
PF01138
(RNase_PH)
PF03725
(RNase_PH_C)
PF03726
(PNPase) 		5 ALA A 134
SER A 135
ALA A  44
SER A 141
GLY A  29
 None
 1.19A 6bklA-4am3A:
undetectable
6bklB-4am3A:
undetectable
6bklC-4am3A:
undetectable
6bklD-4am3A:
undetectable		 6bklA-4am3A:
3.25
6bklB-4am3A:
3.25
6bklC-4am3A:
3.25
6bklD-4am3A:
3.25
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.
4as5 INOSITOL
MONOPHOSPHATASE 1

(Mus musculus) 		PF00459
(Inositol_P) 		5 VAL A 198
ALA A 106
SER A 124
VAL A 193
GLY A  94
 None
None
None
None
PO4  A 401 (-3.4A)
 1.27A 6bklA-4as5A:
undetectable
6bklB-4as5A:
undetectable
6bklC-4as5A:
undetectable
6bklD-4as5A:
undetectable		 6bklA-4as5A:
6.55
6bklB-4as5A:
6.55
6bklC-4as5A:
6.55
6bklD-4as5A:
6.55
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.
4bed HEMOCYANIN KLH1

(Megathura
crenulata) 		PF00264
(Tyrosinase)
PF14830
(Haemocyan_bet_s) 		5 ALA B2281
SER B2274
VAL B2467
SER B2396
GLY B2421
 None
 1.17A 6bklA-4bedB:
undetectable
6bklB-4bedB:
undetectable
6bklC-4bedB:
undetectable
6bklD-4bedB:
undetectable		 6bklA-4bedB:
2.12
6bklB-4bedB:
2.12
6bklC-4bedB:
2.12
6bklD-4bedB:
2.12
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.
4c2f CARBOXY-TERMINAL
PROCESSING PROTEASE
CTPB

(Bacillus
subtilis) 		PF01471
(PG_binding_1)
PF03572
(Peptidase_S41)
PF13180
(PDZ_2) 		5 SER A 106
VAL A 164
ALA A 168
VAL A 118
GLY A 113
 None
 1.28A 6bklA-4c2fA:
undetectable
6bklB-4c2fA:
undetectable
6bklC-4c2fA:
undetectable
6bklD-4c2fA:
undetectable		 6bklA-4c2fA:
5.41
6bklB-4c2fA:
5.41
6bklC-4c2fA:
5.41
6bklD-4c2fA:
5.41
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.
4dd5 ACETYL-COA
ACETYLTRANSFERASE

(Clostridioides
difficile) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		5 VAL A  32
ALA A  31
SER A  30
VAL A  36
GLY A 257
 None
 1.06A 6bklA-4dd5A:
undetectable
6bklB-4dd5A:
undetectable
6bklC-4dd5A:
undetectable
6bklD-4dd5A:
undetectable		 6bklA-4dd5A:
4.55
6bklB-4dd5A:
4.55
6bklC-4dd5A:
4.55
6bklD-4dd5A:
4.55
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.
4fn5 ELONGATION FACTOR G
1

(Pseudomonas
aeruginosa) 		PF00009
(GTP_EFTU)
PF00679
(EFG_C)
PF03144
(GTP_EFTU_D2)
PF03764
(EFG_IV)
PF14492
(EFG_II) 		5 SER A 102
ALA A 109
VAL A 126
ALA A 130
VAL A  99
 None
 0.98A 6bklA-4fn5A:
undetectable
6bklB-4fn5A:
undetectable
6bklC-4fn5A:
undetectable
6bklD-4fn5A:
undetectable		 6bklA-4fn5A:
3.55
6bklB-4fn5A:
3.55
6bklC-4fn5A:
3.55
6bklD-4fn5A:
3.55
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.
4h7o SERINE
ACETYLTRANSFERASE

(Vibrio cholerae) 		PF00132
(Hexapep)
PF06426
(SATase_N) 		5 ALA A 206
VAL A 236
ALA A 241
SER A 224
VAL A 230
 None
 1.18A 6bklA-4h7oA:
undetectable
6bklB-4h7oA:
undetectable
6bklC-4h7oA:
undetectable
6bklD-4h7oA:
undetectable		 6bklA-4h7oA:
7.64
6bklB-4h7oA:
7.64
6bklC-4h7oA:
7.64
6bklD-4h7oA:
7.64
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.
4h7u PYRANOSE
DEHYDROGENASE

(Leucoagaricus
meleagris) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		5 ALA A 546
SER A 547
ALA A  26
VAL A 280
GLY A  24
 FED  A 801 (-3.3A)
None
FED  A 801 (-3.5A)
None
FED  A 801 (-3.3A)
 1.28A 6bklA-4h7uA:
undetectable
6bklB-4h7uA:
undetectable
6bklC-4h7uA:
undetectable
6bklD-4h7uA:
undetectable		 6bklA-4h7uA:
4.42
6bklB-4h7uA:
4.42
6bklC-4h7uA:
4.42
6bklD-4h7uA:
4.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hpz DTALE2

(Xanthomonas) 		PF03377
(TAL_effector) 		5 SER A 469
ALA A 502
SER A 503
ALA A 476
GLY A 472
 None
 1.22A 6bklA-4hpzA:
undetectable
6bklB-4hpzA:
undetectable
6bklC-4hpzA:
undetectable
6bklD-4hpzA:
undetectable		 6bklA-4hpzA:
5.12
6bklB-4hpzA:
5.12
6bklC-4hpzA:
5.12
6bklD-4hpzA:
5.12
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.
4jel CMP/HYDROXYMETHYL
CMP HYDROLASE

(Streptomyces
rimofaciens) 		PF05014
(Nuc_deoxyrib_tr) 		5 ALA A  12
VAL A 156
ALA A 157
VAL A  87
GLY A 161
 None
 1.13A 6bklA-4jelA:
undetectable
6bklB-4jelA:
undetectable
6bklC-4jelA:
undetectable
6bklD-4jelA:
undetectable		 6bklA-4jelA:
10.23
6bklB-4jelA:
10.23
6bklC-4jelA:
10.23
6bklD-4jelA:
10.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jem CMP/HYDROXYMETHYL
CMP HYDROLASE

(Streptomyces
rimofaciens) 		PF05014
(Nuc_deoxyrib_tr) 		5 ALA A  12
VAL A 156
ALA A 157
VAL A  87
GLY A 161
 None
 1.19A 6bklA-4jemA:
undetectable
6bklB-4jemA:
undetectable
6bklC-4jemA:
undetectable
6bklD-4jemA:
undetectable		 6bklA-4jemA:
10.97
6bklB-4jemA:
10.97
6bklC-4jemA:
10.97
6bklD-4jemA:
10.97
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.
4kxb GLUTAMYL
AMINOPEPTIDASE

(Homo sapiens) 		PF01433
(Peptidase_M1)
PF11838
(ERAP1_C) 		5 ALA A 419
SER A 420
VAL A 390
ALA A 392
GLY A 426
 ZN  A1001 ( 4.2A)
None
BES  A1017 ( 3.7A)
None
None
 1.10A 6bklA-4kxbA:
undetectable
6bklB-4kxbA:
undetectable
6bklC-4kxbA:
undetectable
6bklD-4kxbA:
undetectable		 6bklA-4kxbA:
3.10
6bklB-4kxbA:
3.10
6bklC-4kxbA:
3.10
6bklD-4kxbA:
3.10
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.
4mae METHANOL
DEHYDROGENASE

(Methylacidiphilum
fumariolicum) 		PF13360
(PQQ_2) 		5 ALA A 564
VAL A 529
VAL A 567
SER A 505
GLY A 504
 None
 1.18A 6bklA-4maeA:
undetectable
6bklB-4maeA:
undetectable
6bklC-4maeA:
undetectable
6bklD-4maeA:
undetectable		 6bklA-4maeA:
3.64
6bklB-4maeA:
3.64
6bklC-4maeA:
3.64
6bklD-4maeA:
3.64
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.
4mt1 DRUG EFFLUX PROTEIN

(Neisseria
gonorrhoeae) 		PF00873
(ACR_tran) 		5 ALA A 480
VAL A 403
VAL A 369
SER A 373
GLY A 376
 None
 1.15A 6bklA-4mt1A:
undetectable
6bklB-4mt1A:
undetectable
6bklC-4mt1A:
undetectable
6bklD-4mt1A:
undetectable		 6bklA-4mt1A:
2.56
6bklB-4mt1A:
2.56
6bklC-4mt1A:
2.56
6bklD-4mt1A:
2.56
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.
4pk1 CHIMERA PROTEIN OF
OUTER MEMBRANE
PROTEIN ASSEMBLY
FACTORS BAMA AND
BAMB

(Escherichia
coli) 		PF07244
(POTRA)
PF13360
(PQQ_2) 		5 SER A1285
VAL A1247
SER A1245
VAL A1286
GLY A1265
 None
 1.22A 6bklA-4pk1A:
undetectable
6bklB-4pk1A:
undetectable
6bklC-4pk1A:
undetectable
6bklD-4pk1A:
undetectable		 6bklA-4pk1A:
3.45
6bklB-4pk1A:
3.45
6bklC-4pk1A:
3.45
6bklD-4pk1A:
3.45
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.
4pve POLLEN ALLERGEN PHL
P 4.0202

(Phleum pratense) 		PF01565
(FAD_binding_4)
PF08031
(BBE) 		5 ALA A 175
VAL A 204
ALA A 160
VAL A 181
GLY A 156
 None
None
FAD  A 601 ( 4.5A)
None
FAD  A 601 ( 3.6A)
 1.07A 6bklA-4pveA:
undetectable
6bklB-4pveA:
undetectable
6bklC-4pveA:
undetectable
6bklD-4pveA:
undetectable		 6bklA-4pveA:
5.05
6bklB-4pveA:
5.05
6bklC-4pveA:
5.05
6bklD-4pveA:
5.05
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.
4rcn LONG-CHAIN ACYL-COA
CARBOXYLASE

(Mycobacterium
avium) 		PF00289
(Biotin_carb_N)
PF01039
(Carboxyl_trans)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		5 ALA A 125
VAL A 261
ALA A 265
VAL A 337
SER A 332
 None
 1.24A 6bklA-4rcnA:
undetectable
6bklB-4rcnA:
undetectable
6bklC-4rcnA:
undetectable
6bklD-4rcnA:
undetectable		 6bklA-4rcnA:
3.98
6bklB-4rcnA:
3.98
6bklC-4rcnA:
3.98
6bklD-4rcnA:
3.98
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.
4rgz XAA-PRO
AMINOPEPTIDASE

(Thermococcus
sibiricus) 		no annotation 5 SER A 197
ALA A 193
VAL A 159
ALA A 155
SER A 239
 None
 1.12A 6bklA-4rgzA:
undetectable
6bklB-4rgzA:
undetectable
6bklC-4rgzA:
undetectable
6bklD-4rgzA:
undetectable		 6bklA-4rgzA:
5.59
6bklB-4rgzA:
5.59
6bklC-4rgzA:
5.59
6bklD-4rgzA:
5.59
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.
4uj6 SURFACE LAYER
PROTEIN

(Geobacillus
stearothermophilus) 		PF13205
(Big_5) 		5 ALA A 288
VAL A 277
ALA A 318
VAL A 264
GLY A 315
 None
 1.26A 6bklA-4uj6A:
undetectable
6bklB-4uj6A:
undetectable
6bklC-4uj6A:
undetectable
6bklD-4uj6A:
undetectable		 6bklA-4uj6A:
2.52
6bklB-4uj6A:
2.52
6bklC-4uj6A:
2.52
6bklD-4uj6A:
2.52
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.
4v0j ACYL-[ACYL-CARRIER-P
ROTEIN] DESATURASE,
CHLOROPLASTIC

(Ricinus
communis) 		PF03405
(FA_desaturase_2) 		5 ALA A 254
VAL A 327
ALA A 323
VAL A 310
GLY A 320
 None
 1.20A 6bklA-4v0jA:
undetectable
6bklB-4v0jA:
undetectable
6bklC-4v0jA:
undetectable
6bklD-4v0jA:
undetectable		 6bklA-4v0jA:
6.69
6bklB-4v0jA:
6.69
6bklC-4v0jA:
6.69
6bklD-4v0jA:
6.69
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.
4x3m RNA 2'-O RIBOSE
METHYLTRANSFERASE

(Thermus
thermophilus) 		PF00588
(SpoU_methylase) 		5 ALA A 130
VAL A 159
ALA A 158
VAL A 151
SER A 155
 None
 1.12A 6bklA-4x3mA:
undetectable
6bklB-4x3mA:
undetectable
6bklC-4x3mA:
undetectable
6bklD-4x3mA:
undetectable		 6bklA-4x3mA:
7.73
6bklB-4x3mA:
7.73
6bklC-4x3mA:
7.73
6bklD-4x3mA:
7.73
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.
4xib E3 UBIQUITIN-PROTEIN
LIGASE MIB1

(Homo sapiens) 		PF00569
(ZZ)
PF06701
(MIB_HERC2) 		5 SER A 213
VAL A  49
SER A  41
VAL A  51
GLY A  15
 None
 1.23A 6bklA-4xibA:
undetectable
6bklB-4xibA:
undetectable
6bklC-4xibA:
undetectable
6bklD-4xibA:
undetectable		 6bklA-4xibA:
7.19
6bklB-4xibA:
7.19
6bklC-4xibA:
7.19
6bklD-4xibA:
7.19
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.
4xr9 CALS8

(Micromonospora
echinospora) 		PF00984
(UDPG_MGDP_dh)
PF03720
(UDPG_MGDP_dh_C)
PF03721
(UDPG_MGDP_dh_N) 		5 ALA A  78
VAL A  67
ALA A  71
VAL A  29
GLY A  74
 None
 1.27A 6bklA-4xr9A:
undetectable
6bklB-4xr9A:
undetectable
6bklC-4xr9A:
undetectable
6bklD-4xr9A:
undetectable		 6bklA-4xr9A:
6.17
6bklB-4xr9A:
6.17
6bklC-4xr9A:
6.17
6bklD-4xr9A:
6.17
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.
4xzk PUTATIVE
NAD(+)--ARGININE
ADP-RIBOSYLTRANSFERA
SE VIS

(Vibrio
splendidus) 		PF03496
(ADPrib_exo_Tox) 		5 SER A 142
ALA A 115
VAL A 149
ALA A 150
GLY A 118
 AG2  A 700 (-3.4A)
None
None
None
AG2  A 700 (-4.9A)
 1.27A 6bklA-4xzkA:
undetectable
6bklB-4xzkA:
undetectable
6bklC-4xzkA:
undetectable
6bklD-4xzkA:
undetectable		 6bklA-4xzkA:
9.76
6bklB-4xzkA:
9.76
6bklC-4xzkA:
9.76
6bklD-4xzkA:
9.76
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.
4ye5 PEPTIDOGLYCAN
SYNTHETASE
PENICILLIN-BINDING
PROTEIN 3

(Bifidobacterium
adolescentis) 		PF00905
(Transpeptidase)
PF03717
(PBP_dimer) 		5 SER A 268
ALA A 569
ALA A 279
VAL A 264
GLY A 277
 None
 1.28A 6bklA-4ye5A:
undetectable
6bklB-4ye5A:
undetectable
6bklC-4ye5A:
undetectable
6bklD-4ye5A:
undetectable		 6bklA-4ye5A:
4.25
6bklB-4ye5A:
4.25
6bklC-4ye5A:
4.25
6bklD-4ye5A:
4.25
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.
4yh7 RECEPTOR-TYPE
TYROSINE-PROTEIN
PHOSPHATASE DELTA

(Mus musculus) 		PF00041
(fn3)
PF07679
(I-set)
PF13927
(Ig_3) 		5 SER A 246
ALA A 320
VAL A 274
ALA A 311
VAL A 265
 None
 1.27A 6bklA-4yh7A:
undetectable
6bklB-4yh7A:
undetectable
6bklC-4yh7A:
undetectable
6bklD-4yh7A:
undetectable		 6bklA-4yh7A:
2.84
6bklB-4yh7A:
2.84
6bklC-4yh7A:
2.84
6bklD-4yh7A:
2.84
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.
5aw4 NA, K-ATPASE ALPHA
SUBUNIT

(Squalus
acanthias) 		PF00122
(E1-E2_ATPase)
PF00689
(Cation_ATPase_C)
PF00690
(Cation_ATPase_N)
PF13246
(Cation_ATPase) 		5 ALA A 733
VAL A 741
ALA A 745
VAL A 719
SER A 722
 None
 1.28A 6bklA-5aw4A:
undetectable
6bklB-5aw4A:
undetectable
6bklC-5aw4A:
undetectable
6bklD-5aw4A:
undetectable		 6bklA-5aw4A:
4.17
6bklB-5aw4A:
4.17
6bklC-5aw4A:
4.17
6bklD-5aw4A:
4.17
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.
5bp1 MYCOCEROSIC ACID
SYNTHASE

(Mycolicibacterium
smegmatis) 		PF00109
(ketoacyl-synt)
PF00698
(Acyl_transf_1)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		5 SER A 352
VAL A 174
ALA A 184
SER A 183
GLY A 203
 None
 1.09A 6bklA-5bp1A:
undetectable
6bklB-5bp1A:
undetectable
6bklC-5bp1A:
undetectable
6bklD-5bp1A:
undetectable		 6bklA-5bp1A:
2.41
6bklB-5bp1A:
2.41
6bklC-5bp1A:
2.41
6bklD-5bp1A:
2.41
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.
5cqf L-LYSINE
6-MONOOXYGENASE

(Pseudomonas
syringae group
genomosp. 3) 		PF13434
(K_oxygenase) 		5 ALA A 416
ALA A  21
VAL A 162
SER A 164
GLY A 395
 None
 1.26A 6bklA-5cqfA:
undetectable
6bklB-5cqfA:
undetectable
6bklC-5cqfA:
undetectable
6bklD-5cqfA:
undetectable		 6bklA-5cqfA:
4.33
6bklB-5cqfA:
4.33
6bklC-5cqfA:
4.33
6bklD-5cqfA:
4.33
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.
5ewq AMIDASE

(Bacillus
anthracis) 		PF01425
(Amidase) 		5 ALA A 243
ALA A 189
SER A 231
VAL A 148
GLY A 187
 None
 1.25A 6bklA-5ewqA:
undetectable
6bklB-5ewqA:
undetectable
6bklC-5ewqA:
undetectable
6bklD-5ewqA:
undetectable		 6bklA-5ewqA:
4.90
6bklB-5ewqA:
4.90
6bklC-5ewqA:
4.90
6bklD-5ewqA:
4.90
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.
5hy4 RING-OPENING
AMIDOHYDROLASE

(Frankia sp.
Eul1b) 		PF09663
(Amido_AtzD_TrzD) 		5 ALA A 246
VAL A 220
ALA A 221
SER A 245
GLY A 225
 None
 1.26A 6bklA-5hy4A:
undetectable
6bklB-5hy4A:
undetectable
6bklC-5hy4A:
undetectable
6bklD-5hy4A:
undetectable		 6bklA-5hy4A:
5.13
6bklB-5hy4A:
5.13
6bklC-5hy4A:
5.13
6bklD-5hy4A:
5.13
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.
5jij ALPHA,ALPHA-TREHALOS
E-PHOSPHATE SYNTHASE

(Mycolicibacterium
thermoresistibile) 		PF00982
(Glyco_transf_20) 		5 ALA A 391
VAL A 406
ALA A 420
VAL A 423
GLY A 418
 None
 1.26A 6bklA-5jijA:
undetectable
6bklB-5jijA:
undetectable
6bklC-5jijA:
undetectable
6bklD-5jijA:
undetectable		 6bklA-5jijA:
4.42
6bklB-5jijA:
4.42
6bklC-5jijA:
4.42
6bklD-5jijA:
4.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jzx UDP-N-ACETYLENOLPYRU
VOYLGLUCOSAMINE
REDUCTASE

(Mycobacterium
tuberculosis) 		PF01565
(FAD_binding_4)
PF02873
(MurB_C) 		5 ALA A 144
ALA A 206
VAL A 230
SER A 205
GLY A 119
 None
 1.20A 6bklA-5jzxA:
undetectable
6bklB-5jzxA:
undetectable
6bklC-5jzxA:
undetectable
6bklD-5jzxA:
undetectable		 6bklA-5jzxA:
6.80
6bklB-5jzxA:
6.80
6bklC-5jzxA:
6.80
6bklD-5jzxA:
6.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5lf9 NUCLEOSIDE
DIPHOSPHATE-LINKED
MOIETY X MOTIF 22

(Homo sapiens) 		no annotation 5 SER A 275
VAL A 123
ALA A 222
SER A 221
GLY A 209
 None
 1.24A 6bklA-5lf9A:
undetectable
6bklB-5lf9A:
undetectable
6bklC-5lf9A:
undetectable
6bklD-5lf9A:
undetectable		 6bklA-5lf9A:
6.82
6bklB-5lf9A:
6.82
6bklC-5lf9A:
6.82
6bklD-5lf9A:
6.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mn5 CELL DIVISION
PROTEIN FTSZ

(Staphylococcus
aureus) 		PF00091
(Tubulin)
PF12327
(FtsZ_C) 		5 SER A 103
VAL A 117
ALA A 118
VAL A  19
GLY A 130
 None
 1.16A 6bklA-5mn5A:
undetectable
6bklB-5mn5A:
undetectable
6bklC-5mn5A:
undetectable
6bklD-5mn5A:
undetectable		 6bklA-5mn5A:
8.81
6bklB-5mn5A:
8.81
6bklC-5mn5A:
8.81
6bklD-5mn5A:
8.81
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.
5t12 PHOSPHOENOLPYRUVATE-
-PROTEIN
PHOSPHOTRANSFERASE

(Escherichia
coli) 		PF00391
(PEP-utilizers)
PF05524
(PEP-utilisers_N) 		5 ALA A 353
VAL A 361
ALA A 177
VAL A 346
GLY A 388
 None
 1.01A 6bklA-5t12A:
undetectable
6bklB-5t12A:
undetectable
6bklC-5t12A:
undetectable
6bklD-5t12A:
undetectable		 6bklA-5t12A:
8.80
6bklB-5t12A:
8.80
6bklC-5t12A:
8.80
6bklD-5t12A:
8.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ty0 ELONGATION FACTOR G

(Legionella
pneumophila) 		PF00009
(GTP_EFTU)
PF03144
(GTP_EFTU_D2) 		5 SER A 100
ALA A 107
VAL A 124
ALA A 128
VAL A  97
 None
 1.06A 6bklA-5ty0A:
undetectable
6bklB-5ty0A:
undetectable
6bklC-5ty0A:
undetectable
6bklD-5ty0A:
undetectable		 6bklA-5ty0A:
5.23
6bklB-5ty0A:
5.23
6bklC-5ty0A:
5.23
6bklD-5ty0A:
5.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5uag DNA-DIRECTED RNA
POLYMERASE SUBUNIT
ALPHA

(Escherichia
coli) 		PF01000
(RNA_pol_A_bac)
PF01193
(RNA_pol_L) 		5 ALA A 112
VAL A  90
ALA A  89
VAL A 146
GLY A  87
 None
 1.25A 6bklA-5uagA:
undetectable
6bklB-5uagA:
undetectable
6bklC-5uagA:
undetectable
6bklD-5uagA:
undetectable		 6bklA-5uagA:
6.27
6bklB-5uagA:
6.27
6bklC-5uagA:
6.27
6bklD-5uagA:
6.27
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.
5ulm MITOGEN-ACTIVATED
PROTEIN KINASE
KINASE KINASE 5

(Homo sapiens) 		PF13281
(DUF4071) 		5 VAL A 494
ALA A 497
SER A 498
VAL A 486
GLY A 479
 None
 1.03A 6bklA-5ulmA:
undetectable
6bklB-5ulmA:
undetectable
6bklC-5ulmA:
undetectable
6bklD-5ulmA:
undetectable		 6bklA-5ulmA:
5.51
6bklB-5ulmA:
5.51
6bklC-5ulmA:
5.51
6bklD-5ulmA:
5.51
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.
5zya SPLICING FACTOR 3B
SUBUNIT 1

(Homo sapiens) 		no annotation 5 ALA C 601
VAL C 634
ALA C 636
SER C 637
GLY C 640
 None
 1.16A 6bklA-5zyaC:
undetectable
6bklB-5zyaC:
undetectable
6bklC-5zyaC:
undetectable
6bklD-5zyaC:
undetectable		 6bklA-5zyaC:
undetectable
6bklB-5zyaC:
undetectable
6bklC-5zyaC:
undetectable
6bklD-5zyaC:
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.
6avy ACYL-PROTEIN
THIOESTERASE 2

(Zea mays) 		no annotation 5 ALA A 104
ALA A 132
SER A 135
VAL A  36
GLY A 128
 None
 1.07A 6bklA-6avyA:
undetectable
6bklB-6avyA:
undetectable
6bklC-6avyA:
undetectable
6bklD-6avyA:
undetectable		 6bklA-6avyA:
undetectable
6bklB-6avyA:
undetectable
6bklC-6avyA:
undetectable
6bklD-6avyA:
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.
6b8d ELONGATION FACTOR G

(Haemophilus
influenzae) 		no annotation 5 SER A 102
ALA A 109
VAL A 126
ALA A 130
VAL A  99
 None
 1.18A 6bklA-6b8dA:
undetectable
6bklB-6b8dA:
undetectable
6bklC-6b8dA:
undetectable
6bklD-6b8dA:
undetectable		 6bklA-6b8dA:
5.15
6bklB-6b8dA:
5.15
6bklC-6b8dA:
5.15
6bklD-6b8dA:
5.15
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.
6c6l V-TYPE PROTON ATPASE
SUBUNIT C''
V-TYPE PROTON ATPASE
SUBUNIT C'

(Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae) 		no annotation
no annotation 		5 SER D  41
ALA C 162
ALA D  34
VAL D  63
SER D  66
 None
 1.24A 6bklA-6c6lD:
undetectable
6bklB-6c6lD:
undetectable
6bklC-6c6lD:
undetectable
6bklD-6c6lD:
undetectable		 6bklA-6c6lD:
undetectable
6bklB-6c6lD:
undetectable
6bklC-6c6lD:
undetectable
6bklD-6c6lD:
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.
6c6l V-TYPE PROTON ATPASE
SUBUNIT C''
V-TYPE PROTON ATPASE
SUBUNIT C'

(Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae) 		no annotation
no annotation 		5 SER D  41
ALA C 162
VAL D  63
SER D  66
GLY D 113
 None
 1.19A 6bklA-6c6lD:
undetectable
6bklB-6c6lD:
undetectable
6bklC-6c6lD:
undetectable
6bklD-6c6lD:
undetectable		 6bklA-6c6lD:
undetectable
6bklB-6c6lD:
undetectable
6bklC-6c6lD:
undetectable
6bklD-6c6lD:
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.
6d9y SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE SDR

(Paraburkholderia
phymatum) 		no annotation 5 ALA A 146
ALA A 159
SER A 158
VAL A 112
GLY A 163
 None
 1.23A 6bklA-6d9yA:
undetectable
6bklB-6d9yA:
undetectable
6bklC-6d9yA:
undetectable
6bklD-6d9yA:
undetectable		 6bklA-6d9yA:
undetectable
6bklB-6d9yA:
undetectable
6bklC-6d9yA:
undetectable
6bklD-6d9yA:
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.
6de8 BIFUNCTIONAL PROTEIN
FOLD

(Campylobacter
jejuni) 		no annotation 5 ALA A 201
VAL A 225
VAL A 247
SER A 251
GLY A 222
 None
 1.03A 6bklA-6de8A:
undetectable
6bklB-6de8A:
undetectable
6bklC-6de8A:
undetectable
6bklD-6de8A:
undetectable		 6bklA-6de8A:
undetectable
6bklB-6de8A:
undetectable
6bklC-6de8A:
undetectable
6bklD-6de8A:
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.
6ei3 PROTON-DEPENDENT
OLIGOPEPTIDE
TRANSPORTER FAMILY
PROTEIN

(Xanthomonas
campestris) 		no annotation 5 SER A 438
VAL A 307
ALA A 303
VAL A 448
GLY A 300
 None
 1.21A 6bklA-6ei3A:
undetectable
6bklB-6ei3A:
undetectable
6bklC-6ei3A:
undetectable
6bklD-6ei3A:
undetectable		 6bklA-6ei3A:
5.03
6bklB-6ei3A:
5.03
6bklC-6ei3A:
5.03
6bklD-6ei3A:
5.03
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.
6eti ATP-BINDING CASSETTE
SUB-FAMILY G MEMBER
2

(Homo sapiens) 		no annotation 5 SER A 440
ALA A 444
SER A 443
ALA A 520
SER A 521
 None
 0.89A 6bklA-6etiA:
undetectable
6bklB-6etiA:
undetectable
6bklC-6etiA:
undetectable
6bklD-6etiA:
undetectable		 6bklA-6etiA:
undetectable
6bklB-6etiA:
undetectable
6bklC-6etiA:
undetectable
6bklD-6etiA:
undetectable