SIMILAR PATTERNS OF AMINO ACIDS FOR 5DZK_P_BEZP801_1

List of similar pattern of amino acids derived from ASSAM search

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1bh6 SUBTILISIN DY

(Bacillus
licheniformis) 		PF00082
(Peptidase_S8) 		4 SER A 221
ALA A 152
HIS A  64
LEU A 126
 1BH  A 300 ( 1.7A)
1BH  A 300 ( 3.7A)
1BH  A 300 ( 3.0A)
1BH  A 300 (-4.0A)
 1.28A 5dzkB-1bh6A:
2.7
5dzkP-1bh6A:
undetectable		 5dzkB-1bh6A:
22.54
5dzkP-1bh6A:
1.03
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.
1e43 ALPHA-AMYLASE

(Bacillus
amyloliquefaciens) 		PF00128
(Alpha-amylase)
PF09154
(DUF1939) 		4 PHE A 290
SER A 296
ALA A 294
LEU A 292
 None
 1.28A 5dzkB-1e43A:
2.6
5dzkP-1e43A:
undetectable		 5dzkB-1e43A:
19.33
5dzkP-1e43A:
0.65
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.
1eco ERYTHROCRUORIN
(CARBONMONOXY)

(Chironomus
thummi) 		PF00042
(Globin) 		4 SER A  86
ALA A  85
HIS A  87
MET A 136
 HEM  A 137 ( 3.7A)
None
HEM  A 137 (-3.3A)
None
 0.94A 5dzkB-1ecoA:
undetectable
5dzkP-1ecoA:
undetectable		 5dzkB-1ecoA:
22.12
5dzkP-1ecoA:
4.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1g71 DNA PRIMASE

(Pyrococcus
furiosus) 		PF01896
(DNA_primase_S) 		4 PHE A 173
SER A 177
ALA A 176
LEU A 171
 None
 0.93A 5dzkB-1g71A:
undetectable
5dzkP-1g71A:
undetectable		 5dzkB-1g71A:
19.54
5dzkP-1g71A:
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.
1gc7 RADIXIN

(Mus musculus) 		PF00373
(FERM_M)
PF09379
(FERM_N)
PF09380
(FERM_C) 		4 SER A 127
ALA A 126
HIS A 179
LEU A 124
 SER  A 127 ( 0.0A)
ALA  A 126 ( 0.0A)
HIS  A 179 ( 1.0A)
LEU  A 124 ( 0.6A)
 1.23A 5dzkB-1gc7A:
0.0
5dzkP-1gc7A:
undetectable		 5dzkB-1gc7A:
19.68
5dzkP-1gc7A:
1.60
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.
1gk2 HISTIDINE
AMMONIA-LYASE

(Pseudomonas
putida) 		PF00221
(Lyase_aromatic) 		4 PHE A  59
SER A  64
ALA A  63
LEU A  61
 None
 1.24A 5dzkB-1gk2A:
0.5
5dzkP-1gk2A:
undetectable		 5dzkB-1gk2A:
19.22
5dzkP-1gk2A:
0.39
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.
1j6y PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE

(Arabidopsis
thaliana) 		PF00639
(Rotamase) 		4 SER A  72
ALA A  73
HIS A  12
LEU A  14
 None
 1.03A 5dzkB-1j6yA:
undetectable
5dzkP-1j6yA:
undetectable		 5dzkB-1j6yA:
23.15
5dzkP-1j6yA:
6.06
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.
1jzn GALACTOSE-SPECIFIC
LECTIN

(Crotalus atrox) 		PF00059
(Lectin_C) 		4 SER A  42
ALA A  41
HIS A  44
LEU A  13
 NA  A1139 (-2.9A)
None
None
None
 1.25A 5dzkB-1jznA:
undetectable
5dzkP-1jznA:
undetectable		 5dzkB-1jznA:
18.02
5dzkP-1jznA:
15.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1muu GDP-MANNOSE
6-DEHYDROGENASE

(Pseudomonas
aeruginosa) 		PF00984
(UDPG_MGDP_dh)
PF03720
(UDPG_MGDP_dh_C)
PF03721
(UDPG_MGDP_dh_N) 		4 PHE A 305
SER A 310
HIS A 311
LEU A 307
 None
 0.90A 5dzkB-1muuA:
2.9
5dzkP-1muuA:
undetectable		 5dzkB-1muuA:
18.88
5dzkP-1muuA:
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.
1qgo ANAEROBIC COBALAMIN
BIOSYNTHETIC COBALT
CHELATASE

(Salmonella
enterica) 		PF06180
(CbiK) 		4 SER A  32
ALA A  31
HIS A 253
LEU A  29
 None
 1.27A 5dzkB-1qgoA:
0.0
5dzkP-1qgoA:
undetectable		 5dzkB-1qgoA:
21.11
5dzkP-1qgoA:
33.33
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.
1r76 PECTATE LYASE

(Niveispirillum
irakense) 		PF09492
(Pec_lyase) 		4 PHE A 379
ALA A 312
HIS A 296
LEU A 314
 None
 1.24A 5dzkB-1r76A:
undetectable
5dzkP-1r76A:
undetectable		 5dzkB-1r76A:
21.20
5dzkP-1r76A:
0.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1v33 DNA PRIMASE SMALL
SUBUNIT

(Pyrococcus
horikoshii) 		PF01896
(DNA_primase_S) 		4 PHE A 173
SER A 177
ALA A 176
LEU A 171
 None
 0.97A 5dzkB-1v33A:
undetectable
5dzkP-1v33A:
undetectable		 5dzkB-1v33A:
20.44
5dzkP-1v33A:
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.
1w25 STALKED-CELL
DIFFERENTIATION
CONTROLLING PROTEIN

(Caulobacter
vibrioides) 		PF00072
(Response_reg)
PF00990
(GGDEF) 		4 PHE A 350
SER A 356
ALA A 355
LEU A 352
 None
 1.02A 5dzkB-1w25A:
undetectable
5dzkP-1w25A:
undetectable		 5dzkB-1w25A:
18.14
5dzkP-1w25A:
11.76
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.
1we5 PUTATIVE FAMILY 31
GLUCOSIDASE YICI

(Escherichia
coli) 		PF01055
(Glyco_hydro_31)
PF13802
(Gal_mutarotas_2) 		4 SER A 268
ALA A 266
HIS A 536
MET A 570
 None
 1.05A 5dzkB-1we5A:
undetectable
5dzkP-1we5A:
undetectable		 5dzkB-1we5A:
13.64
5dzkP-1we5A:
0.26
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.
1xkq SHORT-CHAIN
REDUCTASE FAMILY
MEMBER (5D234)

(Caenorhabditis
elegans) 		PF13561
(adh_short_C2) 		4 PHE A 213
SER A 219
ALA A 218
HIS A 220
 None
 0.94A 5dzkB-1xkqA:
undetectable
5dzkP-1xkqA:
undetectable		 5dzkB-1xkqA:
22.41
5dzkP-1xkqA:
1.25
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.
2dgk GLUTAMATE
DECARBOXYLASE BETA

(Escherichia
coli) 		PF00282
(Pyridoxal_deC) 		4 PHE A  63
SER A 273
ALA A 245
HIS A 275
 PLP  A1500 ( 4.7A)
PLP  A1500 (-2.8A)
PLP  A1500 (-3.4A)
PLP  A1500 (-3.8A)
 1.20A 5dzkB-2dgkA:
undetectable
5dzkP-2dgkA:
undetectable		 5dzkB-2dgkA:
20.62
5dzkP-2dgkA:
0.47
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.
2gre DEBLOCKING
AMINOPEPTIDASE

(Bacillus cereus) 		PF05343
(Peptidase_M42) 		4 SER A 329
ALA A 332
HIS A 327
MET A   9
 None
 1.20A 5dzkB-2greA:
undetectable
5dzkP-2greA:
undetectable		 5dzkB-2greA:
20.80
5dzkP-2greA:
3.03
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.
2jzv FOLDASE PROTEIN PRSA

(Staphylococcus
aureus) 		PF00639
(Rotamase) 		4 SER A 197
ALA A 198
HIS A 146
LEU A 148
 None
 1.00A 5dzkB-2jzvA:
undetectable
5dzkP-2jzvA:
undetectable		 5dzkB-2jzvA:
18.81
5dzkP-2jzvA:
33.33
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.
2l8y PROTEIN RCSF

(Escherichia
coli) 		PF16358
(RcsF) 		4 SER A 127
ALA A 128
HIS A 107
MET A  92
 None
 1.26A 5dzkB-2l8yA:
undetectable
5dzkP-2l8yA:
undetectable		 5dzkB-2l8yA:
20.10
5dzkP-2l8yA:
2.60
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.
2q5e CARBOXY-TERMINAL
DOMAIN RNA
POLYMERASE II
POLYPEPTIDE A SMALL
PHOSPHATASE 2

(Homo sapiens) 		PF03031
(NIF) 		4 PHE A 162
SER A 165
ALA A 164
LEU A 108
 None
 1.11A 5dzkB-2q5eA:
undetectable
5dzkP-2q5eA:
undetectable		 5dzkB-2q5eA:
21.74
5dzkP-2q5eA:
3.03
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.
2wtz UDP-N-ACETYLMURAMOYL
-L-ALANYL-D-GLUTAMAT
E--2,6-DIAMINOPIMELA
TE LIGASE

(Mycobacterium
tuberculosis) 		PF01225
(Mur_ligase)
PF02875
(Mur_ligase_C)
PF08245
(Mur_ligase_M) 		4 PHE A 418
ALA A 420
HIS A 395
MET A 432
 None
 1.28A 5dzkB-2wtzA:
undetectable
5dzkP-2wtzA:
undetectable		 5dzkB-2wtzA:
17.49
5dzkP-2wtzA:
7.69
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.
2y1b PUTATIVE OUTER
MEMBRANE PROTEIN,
SIGNAL

(Escherichia
coli) 		PF16358
(RcsF) 		4 SER A 127
ALA A 128
HIS A 107
MET A  92
 None
None
I3C  A1133 (-3.6A)
None
 1.02A 5dzkB-2y1bA:
undetectable
5dzkP-2y1bA:
undetectable		 5dzkB-2y1bA:
20.72
5dzkP-2y1bA:
2.17
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.
2yre F-BOX ONLY PROTEIN
30

(Homo sapiens) 		PF15965
(zf-TRAF_2) 		4 PHE A  69
SER A  86
ALA A  85
LEU A  80
 None
None
ZN  A 701 ( 4.7A)
None
 1.21A 5dzkB-2yreA:
undetectable
5dzkP-2yreA:
undetectable		 5dzkB-2yreA:
17.06
5dzkP-2yreA:
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.
2zuk ALPHA-AMINO-EPSILON-
CAPROLACTAM RACEMASE

(Achromobacter
obae) 		PF00202
(Aminotran_3) 		4 SER A  95
ALA A  94
HIS A 251
LEU A  92
 None
 1.12A 5dzkB-2zukA:
undetectable
5dzkP-2zukA:
undetectable		 5dzkB-2zukA:
20.45
5dzkP-2zukA:
2.08
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.
3clw CONSERVED EXPORTED
PROTEIN

(Bacteroides
fragilis) 		PF14587
(Glyco_hydr_30_2) 		4 PHE A 148
SER A  46
MET A 145
LEU A 149
 None
 1.07A 5dzkB-3clwA:
1.9
5dzkP-3clwA:
undetectable		 5dzkB-3clwA:
18.55
5dzkP-3clwA:
4.08
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.
3gay FRUCTOSE-BISPHOSPHAT
E ALDOLASE

(Giardia
intestinalis) 		PF01116
(F_bP_aldolase) 		4 SER A 107
ALA A 106
MET A 103
LEU A 136
 None
 1.26A 5dzkB-3gayA:
undetectable
5dzkP-3gayA:
undetectable		 5dzkB-3gayA:
25.15
5dzkP-3gayA:
33.33
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.
3goa 3-KETOACYL-COA
THIOLASE

(Salmonella
enterica) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		4 PHE A 367
SER A 269
ALA A 295
LEU A 369
 None
 1.04A 5dzkB-3goaA:
undetectable
5dzkP-3goaA:
undetectable		 5dzkB-3goaA:
20.89
5dzkP-3goaA:
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.
3h7a SHORT CHAIN
DEHYDROGENASE

(Rhodopseudomonas
palustris) 		PF00106
(adh_short) 		4 PHE A 158
ALA A 162
HIS A 180
LEU A 160
 PHE  A 158 ( 1.3A)
ALA  A 162 ( 0.0A)
HIS  A 180 ( 1.0A)
LEU  A 160 ( 0.6A)
 1.25A 5dzkB-3h7aA:
3.1
5dzkP-3h7aA:
undetectable		 5dzkB-3h7aA:
23.99
5dzkP-3h7aA:
0.94
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.
3hbx GLUTAMATE
DECARBOXYLASE 1

(Arabidopsis
thaliana) 		PF00282
(Pyridoxal_deC) 		4 PHE A  63
SER A 274
ALA A 246
HIS A 276
 None
LLP  A 277 ( 2.8A)
LLP  A 277 ( 3.3A)
LLP  A 277 ( 3.8A)
 1.15A 5dzkB-3hbxA:
undetectable
5dzkP-3hbxA:
undetectable		 5dzkB-3hbxA:
16.44
5dzkP-3hbxA:
0.89
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.
3hf1 RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE
SUBUNIT M2 B

(Homo sapiens) 		PF00268
(Ribonuc_red_sm) 		4 SER A 201
ALA A 204
MET A 282
LEU A 270
 None
 1.10A 5dzkB-3hf1A:
undetectable
5dzkP-3hf1A:
undetectable		 5dzkB-3hf1A:
20.51
5dzkP-3hf1A:
5.71
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.
3i1i HOMOSERINE
O-ACETYLTRANSFERASE

(Bacillus
anthracis) 		PF00561
(Abhydrolase_1) 		4 PHE A  48
SER A 152
ALA A 153
HIS A 348
 None
 1.20A 5dzkB-3i1iA:
2.2
5dzkP-3i1iA:
undetectable		 5dzkB-3i1iA:
20.63
5dzkP-3i1iA:
0.69
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.
3i9u HEME OXYGENASE 1

(Rattus
norvegicus) 		PF01126
(Heme_oxygenase) 		4 PHE A  47
SER A  53
ALA A  52
LEU A  49
 None
 1.10A 5dzkB-3i9uA:
undetectable
5dzkP-3i9uA:
undetectable		 5dzkB-3i9uA:
26.20
5dzkP-3i9uA:
0.76
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.
3iv7 ALCOHOL
DEHYDROGENASE IV

(Corynebacterium
glutamicum) 		PF00465
(Fe-ADH) 		4 SER A 234
ALA A 235
HIS A   9
LEU A 193
 None
 1.17A 5dzkB-3iv7A:
undetectable
5dzkP-3iv7A:
undetectable		 5dzkB-3iv7A:
21.41
5dzkP-3iv7A:
2.17
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.
3iyl VP1

(Aquareovirus C) 		PF06016
(Reovirus_L2) 		4 PHE W 632
ALA W 636
HIS W 638
LEU W 634
 None
 1.11A 5dzkB-3iylW:
undetectable
5dzkP-3iylW:
undetectable		 5dzkB-3iylW:
10.38
5dzkP-3iylW:
6.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ju8 SUCCINYLGLUTAMIC
SEMIALDEHYDE
DEHYDROGENASE

(Pseudomonas
aeruginosa) 		PF00171
(Aldedh) 		4 SER A 456
ALA A 457
HIS A 156
LEU A 152
 None
None
None
SIN  A 504 (-4.8A)
 1.11A 5dzkB-3ju8A:
undetectable
5dzkP-3ju8A:
undetectable		 5dzkB-3ju8A:
17.72
5dzkP-3ju8A:
2.86
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.
3ngo CCR4-NOT
TRANSCRIPTION
COMPLEX SUBUNIT
6-LIKE

(Homo sapiens) 		PF03372
(Exo_endo_phos) 		4 PHE A 189
SER A 186
ALA A 187
HIS A 539
 None
 1.23A 5dzkB-3ngoA:
undetectable
5dzkP-3ngoA:
undetectable		 5dzkB-3ngoA:
19.36
5dzkP-3ngoA:
40.00
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.
3npe 9-CIS-EPOXYCAROTENOI
D DIOXYGENASE 1,
CHLOROPLASTIC

(Zea mays) 		PF03055
(RPE65) 		4 PHE A 102
SER A 222
ALA A 225
HIS A 221
 None
 1.17A 5dzkB-3npeA:
undetectable
5dzkP-3npeA:
undetectable		 5dzkB-3npeA:
17.39
5dzkP-3npeA:
1.08
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.
3ocr CLASS II
ALDOLASE/ADDUCIN
DOMAIN PROTEIN

(Pseudomonas
savastanoi) 		PF00596
(Aldolase_II) 		4 SER A  57
ALA A  58
HIS A 110
LEU A 124
 None
 1.20A 5dzkB-3ocrA:
undetectable
5dzkP-3ocrA:
undetectable		 5dzkB-3ocrA:
22.76
5dzkP-3ocrA:
1.04
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.
3ox4 ALCOHOL
DEHYDROGENASE 2

(Zymomonas
mobilis) 		PF00465
(Fe-ADH) 		4 PHE A 248
SER A 144
ALA A 143
HIS A 101
 None
NAD  A1385 ( 4.9A)
None
None
 1.19A 5dzkB-3ox4A:
undetectable
5dzkP-3ox4A:
undetectable		 5dzkB-3ox4A:
21.79
5dzkP-3ox4A:
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.
3pgl CARBOXY-TERMINAL
DOMAIN RNA
POLYMERASE II
POLYPEPTIDE A SMALL
PHOSPHATASE 1

(Homo sapiens) 		PF03031
(NIF) 		4 PHE A 151
SER A 154
ALA A 153
LEU A  97
 None
RZX  A 257 ( 3.8A)
RZX  A 257 ( 4.9A)
None
 1.19A 5dzkB-3pglA:
undetectable
5dzkP-3pglA:
undetectable		 5dzkB-3pglA:
21.93
5dzkP-3pglA:
2.22
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.
3r45 HISTONE H3-LIKE
CENTROMERIC PROTEIN
A
HOLLIDAY JUNCTION
RECOGNITION PROTEIN

(Homo sapiens;
Homo sapiens) 		PF00125
(Histone)
PF10384
(Scm3) 		4 SER C  25
ALA C  24
HIS A 104
LEU C  22
 None
 1.21A 5dzkB-3r45C:
undetectable
5dzkP-3r45C:
undetectable		 5dzkB-3r45C:
14.58
5dzkP-3r45C:
10.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tlm SARCOPLASMIC/ENDOPLA
SMIC RETICULUM
CALCIUM ATPASE 1

(Bos taurus) 		PF00122
(E1-E2_ATPase)
PF00689
(Cation_ATPase_C)
PF00690
(Cation_ATPase_N)
PF08282
(Hydrolase_3)
PF13246
(Cation_ATPase) 		4 PHE A  92
SER A  72
ALA A  69
LEU A 792
 None
 1.20A 5dzkB-3tlmA:
undetectable
5dzkP-3tlmA:
undetectable		 5dzkB-3tlmA:
12.23
5dzkP-3tlmA:
3.28
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.
3trc PHOSPHOENOLPYRUVATE-
PROTEIN
PHOSPHOTRANSFERASE

(Coxiella
burnetii) 		PF01590
(GAF) 		4 SER A 134
ALA A  90
HIS A 110
LEU A  94
 None
 1.27A 5dzkB-3trcA:
undetectable
5dzkP-3trcA:
undetectable		 5dzkB-3trcA:
23.89
5dzkP-3trcA:
1.17
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.
4bv6 APOPTOSIS-INDUCING
FACTOR 1,
MITOCHONDRIAL

(Homo sapiens) 		PF07992
(Pyr_redox_2)
PF14721
(AIF_C) 		4 PHE A 134
ALA A 147
MET A 469
LEU A 160
 None
 1.21A 5dzkB-4bv6A:
undetectable
5dzkP-4bv6A:
undetectable		 5dzkB-4bv6A:
18.74
5dzkP-4bv6A:
12.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4byf UNCONVENTIONAL
MYOSIN-IC

(Homo sapiens) 		PF00063
(Myosin_head)
PF00612
(IQ) 		4 PHE A 121
ALA A 123
MET A  66
LEU A 119
 None
 1.24A 5dzkB-4byfA:
undetectable
5dzkP-4byfA:
undetectable		 5dzkB-4byfA:
15.66
5dzkP-4byfA:
10.53
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.
4g56 MGC81050 PROTEIN

(Xenopus laevis) 		PF00400
(WD40) 		4 PHE B 281
SER B 263
ALA B 262
HIS B 244
 None
 1.03A 5dzkB-4g56B:
undetectable
5dzkP-4g56B:
undetectable		 5dzkB-4g56B:
21.88
5dzkP-4g56B:
3.51
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.
4g8k 2-5A-DEPENDENT
RIBONUCLEASE

(Homo sapiens) 		PF12796
(Ank_2)
PF13857
(Ank_5) 		4 PHE A  96
SER A 104
ALA A  99
LEU A 110
 None
 1.19A 5dzkB-4g8kA:
undetectable
5dzkP-4g8kA:
undetectable		 5dzkB-4g8kA:
22.82
5dzkP-4g8kA:
6.90
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.
4iyp IMMUNOGLOBULIN-BINDI
NG PROTEIN 1

(Homo sapiens) 		PF04177
(TAP42) 		4 PHE A  84
ALA A  87
HIS A 108
LEU A  46
 None
 1.25A 5dzkB-4iypA:
undetectable
5dzkP-4iypA:
undetectable		 5dzkB-4iypA:
22.76
5dzkP-4iypA:
8.00
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.
4j9u TRK SYSTEM POTASSIUM
UPTAKE PROTEIN TRKH

(Vibrio
parahaemolyticus) 		PF02386
(TrkH) 		4 PHE A 341
SER A 429
ALA A 432
LEU A 442
 None
 1.10A 5dzkB-4j9uA:
undetectable
5dzkP-4j9uA:
undetectable		 5dzkB-4j9uA:
16.63
5dzkP-4j9uA:
15.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jsb ENOYL-COA HYDRATASE

(Thermobifida
fusca) 		PF00378
(ECH_1) 		4 PHE A 138
SER A  71
ALA A 133
LEU A 140
 None
 1.26A 5dzkB-4jsbA:
11.5
5dzkP-4jsbA:
undetectable		 5dzkB-4jsbA:
23.18
5dzkP-4jsbA:
1.74
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.
4lz6 BH2163 PROTEIN

(Bacillus
halodurans) 		PF01554
(MatE) 		4 PHE A 187
SER A 199
ALA A 198
LEU A 196
 None
 0.98A 5dzkB-4lz6A:
undetectable
5dzkP-4lz6A:
undetectable		 5dzkB-4lz6A:
18.22
5dzkP-4lz6A:
11.76
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.
4mec HEME OXYGENASE 1

(Rattus
norvegicus) 		PF01126
(Heme_oxygenase) 		4 PHE A  47
SER A  53
ALA A  52
LEU A  49
 None
 1.19A 5dzkB-4mecA:
undetectable
5dzkP-4mecA:
undetectable		 5dzkB-4mecA:
25.29
5dzkP-4mecA:
1.55
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.
4nky STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE

(Homo sapiens) 		PF00067
(p450) 		4 PHE A 484
ALA A 367
HIS A 400
LEU A 361
 None
HEM  A 600 ( 3.1A)
None
HEM  A 600 ( 4.2A)
 1.21A 5dzkB-4nkyA:
undetectable
5dzkP-4nkyA:
undetectable		 5dzkB-4nkyA:
17.31
5dzkP-4nkyA:
14.29
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.
4qs9 HEXOKINASE-1

(Arabidopsis
thaliana) 		PF00349
(Hexokinase_1)
PF03727
(Hexokinase_2) 		4 SER A 488
ALA A 487
HIS A 489
LEU A 485
 None
 0.97A 5dzkB-4qs9A:
undetectable
5dzkP-4qs9A:
undetectable		 5dzkB-4qs9A:
17.92
5dzkP-4qs9A:
2.17
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4u0g ATP-DEPENDENT CLP
PROTEASE PROTEOLYTIC
SUBUNIT 2

(Mycobacterium
tuberculosis) 		PF00574
(CLP_protease) 		5 PHE A  83
SER A 110
ALA A 111
HIS A 135
MET A 164
 ZIL  A 301 (-4.5A)
ZIL  A 301 ( 4.0A)
ZIL  A 301 ( 4.0A)
ZIL  A 301 (-3.7A)
ZIL  A 301 ( 2.9A)
 0.49A 5dzkB-4u0gA:
27.7
5dzkP-4u0gA:
undetectable		 5dzkB-4u0gA:
100.00
5dzkP-4u0gA:
1.92
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.
4uvj COHESIN SUBUNIT SCC3

(Saccharomyces
cerevisiae) 		no annotation 4 SER A 692
ALA A 691
MET A 746
LEU A 688
 None
 0.99A 5dzkB-4uvjA:
undetectable
5dzkP-4uvjA:
undetectable		 5dzkB-4uvjA:
20.15
5dzkP-4uvjA:
12.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4w82 FATTY ACID SYNTHASE

(Homo sapiens) 		PF00107
(ADH_zinc_N) 		4 PHE A1573
ALA A1844
HIS A1848
LEU A1571
 None
 1.09A 5dzkB-4w82A:
undetectable
5dzkP-4w82A:
undetectable		 5dzkB-4w82A:
21.56
5dzkP-4w82A:
2.82
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.
4wy8 ESTERASE

(Rhizomucor
miehei) 		PF07859
(Abhydrolase_3) 		4 SER A 164
ALA A 165
HIS A 291
MET A 218
 None
 1.22A 5dzkB-4wy8A:
2.4
5dzkP-4wy8A:
undetectable		 5dzkB-4wy8A:
22.94
5dzkP-4wy8A:
4.44
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.
4y07 NEDD4-LIKE E3
UBIQUITIN-PROTEIN
LIGASE WWP2

(Homo sapiens) 		PF00632
(HECT) 		4 PHE A 611
ALA A 613
HIS A 618
LEU A 540
 None
 1.05A 5dzkB-4y07A:
undetectable
5dzkP-4y07A:
undetectable		 5dzkB-4y07A:
20.95
5dzkP-4y07A:
2.63
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.
4yh2 GLUTATHIONE S
TRANSFERASE E6

(Drosophila
melanogaster) 		PF13417
(GST_N_3)
PF14497
(GST_C_3) 		4 PHE A 162
SER A 166
ALA A  17
LEU A 164
 None
 1.20A 5dzkB-4yh2A:
undetectable
5dzkP-4yh2A:
undetectable		 5dzkB-4yh2A:
25.48
5dzkP-4yh2A:
2.00
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.
4ypv EST8

(Parvibaculum) 		PF07859
(Abhydrolase_3) 		4 SER A 159
ALA A 160
HIS A 283
MET A 213
 None
 1.25A 5dzkB-4ypvA:
2.6
5dzkP-4ypvA:
undetectable		 5dzkB-4ypvA:
22.35
5dzkP-4ypvA:
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.
4zgf UNCHARACTERIZED
PROTEIN

(Bacteroides
vulgatus) 		PF16139
(DUF4847) 		4 SER A  31
ALA A  30
HIS A 160
LEU A 145
 None
None
P6G  A 205 ( 3.9A)
None
 1.11A 5dzkB-4zgfA:
undetectable
5dzkP-4zgfA:
undetectable		 5dzkB-4zgfA:
21.89
5dzkP-4zgfA:
1.63
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.
4zxc HYDROQUINONE
DIOXYGENASE SMALL
SUBUNIT

(Pseudomonas sp.
WBC-3) 		no annotation 4 SER A 132
ALA A 133
MET A 115
LEU A 128
 None
 1.26A 5dzkB-4zxcA:
undetectable
5dzkP-4zxcA:
undetectable		 5dzkB-4zxcA:
19.64
5dzkP-4zxcA:
1.61
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.
5a40 PUTATIVE FLUORIDE
ION TRANSPORTER CRCB

(Bordetella
pertussis) 		PF02537
(CRCB) 		4 SER A  59
ALA A  58
HIS A  60
LEU A  56
 None
 1.14A 5dzkB-5a40A:
undetectable
5dzkP-5a40A:
undetectable		 5dzkB-5a40A:
19.82
5dzkP-5a40A:
28.57
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.
5bp7 SAM-DEPENDENT
METHYLTRANSFERASE

(Geobacter
sulfurreducens) 		PF13847
(Methyltransf_31) 		4 SER A  48
ALA A  76
HIS A  18
LEU A  71
 None
None
SAH  A 301 (-4.4A)
None
 1.11A 5dzkB-5bp7A:
undetectable
5dzkP-5bp7A:
undetectable		 5dzkB-5bp7A:
22.14
5dzkP-5bp7A:
1.34
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.
5c7m E3 UBIQUITIN-PROTEIN
LIGASE ITCHY HOMOLOG

(Homo sapiens) 		PF00632
(HECT) 		4 PHE A 644
ALA A 646
HIS A 651
LEU A 573
 None
 1.04A 5dzkB-5c7mA:
undetectable
5dzkP-5c7mA:
undetectable		 5dzkB-5c7mA:
20.49
5dzkP-5c7mA:
2.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5csl ACETYL-COA
CARBOXYLASE

(Saccharomyces
cerevisiae) 		PF00289
(Biotin_carb_N)
PF00364
(Biotin_lipoyl)
PF01039
(Carboxyl_trans)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2)
PF08326
(ACC_central) 		4 PHE A 510
SER A 519
ALA A 511
HIS A 453
 None
 1.28A 5dzkB-5cslA:
10.3
5dzkP-5cslA:
undetectable		 5dzkB-5cslA:
6.60
5dzkP-5cslA:
1.45
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.
5d8m METAGENOMIC CARBOXYL
ESTERASE MGS0156

(uncultured
organism) 		no annotation 4 SER A 232
ALA A 261
HIS A 231
LEU A 352
 None
 0.98A 5dzkB-5d8mA:
2.3
5dzkP-5d8mA:
undetectable		 5dzkB-5d8mA:
22.62
5dzkP-5d8mA:
2.08
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.
5dyr VIRULENCE-ASSOCIATED
PROTEIN D

(Xylella
fastidiosa) 		PF09827
(CRISPR_Cas2) 		4 PHE A  92
ALA A  90
HIS A  37
LEU A  84
 None
 1.20A 5dzkB-5dyrA:
2.4
5dzkP-5dyrA:
undetectable		 5dzkB-5dyrA:
22.88
5dzkP-5dyrA:
12.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5eeb ALDEHYDE
DEHYDROGENASE

(Pyrobaculum
ferrireducens) 		PF00171
(Aldedh) 		4 PHE A 277
SER A 289
ALA A 290
LEU A 280
 None
 1.28A 5dzkB-5eebA:
undetectable
5dzkP-5eebA:
undetectable		 5dzkB-5eebA:
18.33
5dzkP-5eebA:
0.56
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.
5epe SAM-DEPENDENT
METHYLTRANSFERASE

(Thiobacillus
denitrificans) 		PF13847
(Methyltransf_31) 		4 SER A  47
ALA A  75
HIS A  17
LEU A  70
 None
None
SAH  A 301 (-4.5A)
None
 1.09A 5dzkB-5epeA:
undetectable
5dzkP-5epeA:
undetectable		 5dzkB-5epeA:
23.13
5dzkP-5epeA:
1.59
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.
5epg ALDEHYDE OXIDASE

(Homo sapiens) 		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 SER A  57
ALA A  85
HIS A  68
LEU A 216
 None
 1.02A 5dzkB-5epgA:
2.0
5dzkP-5epgA:
undetectable		 5dzkB-5epgA:
10.35
5dzkP-5epgA:
25.00
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.
5f15 4-AMINO-4-DEOXY-L-AR
ABINOSE (L-ARA4N)
TRANSFERASE

(Cupriavidus
metallidurans) 		PF13231
(PMT_2) 		4 PHE A 171
SER A 122
ALA A 125
LEU A 169
 MPG  A 617 ( 4.5A)
None
None
5TR  A 681 ( 4.3A)
 1.19A 5dzkB-5f15A:
undetectable
5dzkP-5f15A:
undetectable		 5dzkB-5f15A:
16.67
5dzkP-5f15A:
1.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fya PATATIN-LIKE
PROTEIN, PLPD

(Pseudomonas
aeruginosa) 		PF01734
(Patatin) 		4 SER A  71
ALA A  70
HIS A 147
LEU A  68
 None
 1.26A 5dzkB-5fyaA:
undetectable
5dzkP-5fyaA:
undetectable		 5dzkB-5fyaA:
23.46
5dzkP-5fyaA:
1.59
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.
5gp4 GLUTAMATE
DECARBOXYLASE

(Lactobacillus
brevis) 		no annotation 4 PHE C  65
SER C 276
ALA C 248
HIS C 278
 None
PLP  C 501 (-2.7A)
PLP  C 501 (-3.1A)
PLP  C 501 (-3.8A)
 1.14A 5dzkB-5gp4C:
undetectable
5dzkP-5gp4C:
undetectable		 5dzkB-5gp4C:
17.12
5dzkP-5gp4C:
3.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hss LINALOOL
DEHYDRATASE/ISOMERAS
E

(Castellaniella
defragrans) 		no annotation 4 ALA A  71
HIS A 128
MET A  99
LEU A 131
 None
 1.23A 5dzkB-5hssA:
undetectable
5dzkP-5hssA:
undetectable		 5dzkB-5hssA:
19.89
5dzkP-5hssA:
0.66
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.
5k7v DESIGNED PROTEIN
HR00C3

(synthetic
construct) 		no annotation 4 SER A 183
ALA A 182
MET A 129
LEU A 180
 None
 1.04A 5dzkB-5k7vA:
undetectable
5dzkP-5k7vA:
undetectable		 5dzkB-5k7vA:
23.15
5dzkP-5k7vA:
1.17
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.
5m49 AMINOTRANSFERASE
CLASS-III

(Rhizobium
freirei) 		PF00202
(Aminotran_3) 		4 SER A  95
ALA A  94
HIS A 251
LEU A  92
 None
 1.12A 5dzkB-5m49A:
undetectable
5dzkP-5m49A:
undetectable		 5dzkB-5m49A:
20.95
5dzkP-5m49A:
1.21
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.
5msx PUTATIVE
ENDO-1,4-BETA-XYLANA
SE

(Bacteroides
thetaiotaomicron) 		PF00754
(F5_F8_type_C)
PF04616
(Glyco_hydro_43) 		4 PHE A 169
ALA A 176
MET A 236
LEU A 178
 None
 1.22A 5dzkB-5msxA:
undetectable
5dzkP-5msxA:
undetectable		 5dzkB-5msxA:
17.74
5dzkP-5msxA:
1.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5n4l CERULOPLASMIN

(Rattus
norvegicus) 		no annotation 4 PHE A 560
SER A 623
ALA A 624
HIS A 631
 None
 1.27A 5dzkB-5n4lA:
undetectable
5dzkP-5n4lA:
undetectable		 5dzkB-5n4lA:
undetectable
5dzkP-5n4lA:
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.
5nx2 GLUCAGON-LIKE
PEPTIDE 1 RECEPTOR

(Homo sapiens) 		PF00002
(7tm_2)
PF02793
(HRM) 		4 PHE A 187
SER A 193
ALA A 191
LEU A 189
 None
 1.17A 5dzkB-5nx2A:
undetectable
5dzkP-5nx2A:
undetectable		 5dzkB-5nx2A:
21.43
5dzkP-5nx2A:
1.63
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.
5o7j HISTIDINE KINASE

(Pseudomonas
aeruginosa) 		no annotation 4 PHE A  87
ALA A 139
HIS A 134
LEU A  88
 None
 1.28A 5dzkB-5o7jA:
undetectable
5dzkP-5o7jA:
undetectable		 5dzkB-5o7jA:
undetectable
5dzkP-5o7jA:
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.
5oy0 PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A2

(Synechocystis
sp. PCC 6803) 		no annotation 4 PHE b 141
SER b 147
ALA b 146
LEU b 143
 CLA  b1817 (-4.0A)
None
None
None
 1.13A 5dzkB-5oy0b:
undetectable
5dzkP-5oy0b:
undetectable		 5dzkB-5oy0b:
undetectable
5dzkP-5oy0b:
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.
5td3 CATECHOL
1,2-DIOXYGENASE

(Burkholderia
vietnamiensis) 		PF00775
(Dioxygenase_C)
PF04444
(Dioxygenase_N) 		4 PHE A 299
SER A 242
ALA A 162
HIS A 245
 None
 1.26A 5dzkB-5td3A:
undetectable
5dzkP-5td3A:
undetectable		 5dzkB-5td3A:
22.92
5dzkP-5td3A:
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.
5tj7 NEDD4-LIKE E3
UBIQUITIN-PROTEIN
LIGASE WWP2

(Homo sapiens) 		PF00397
(WW)
PF00632
(HECT) 		4 PHE A 611
ALA A 613
HIS A 618
LEU A 540
 None
 1.05A 5dzkB-5tj7A:
undetectable
5dzkP-5tj7A:
undetectable		 5dzkB-5tj7A:
19.46
5dzkP-5tj7A:
1.34
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.
5ud0 FRUCTOSE-BISPHOSPHAT
E ALDOLASE

(Helicobacter
pylori) 		no annotation 4 SER A 106
ALA A 105
MET A 102
LEU A 135
 None
None
NA  A 401 (-3.6A)
None
 1.25A 5dzkB-5ud0A:
undetectable
5dzkP-5ud0A:
undetectable		 5dzkB-5ud0A:
undetectable
5dzkP-5ud0A:
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.
5uj8 ORIGIN RECOGNITION
COMPLEX SUBUNIT 2

(Homo sapiens) 		PF04084
(ORC2) 		4 SER E 423
ALA E 422
HIS E 393
LEU E 391
 None
 1.18A 5dzkB-5uj8E:
undetectable
5dzkP-5uj8E:
undetectable		 5dzkB-5uj8E:
21.17
5dzkP-5uj8E:
4.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5um6 UBIQUITIN-ACTIVATING
ENZYME E1 1

(Schizosaccharomyces
pombe) 		PF00899
(ThiF)
PF09358
(E1_UFD)
PF10585
(UBA_e1_thiolCys)
PF16190
(E1_FCCH)
PF16191
(E1_4HB) 		4 PHE A 724
SER A 730
ALA A 729
HIS A 818
 None
 0.84A 5dzkB-5um6A:
undetectable
5dzkP-5um6A:
undetectable		 5dzkB-5um6A:
11.46
5dzkP-5um6A:
0.20
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.
5uyr BACTERIOPHYTOCHROME

(Xanthomonas
campestris) 		no annotation 4 PHE A 516
SER A 522
ALA A 521
LEU A 518
 None
 1.15A 5dzkB-5uyrA:
undetectable
5dzkP-5uyrA:
undetectable		 5dzkB-5uyrA:
undetectable
5dzkP-5uyrA:
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.
5v54 5-HYDROXYTRYPTAMINE
RECEPTOR 1B,OB-1
FUSED 5-HT1B
RECEPTOR,5-HYDROXYTR
YPTAMINE RECEPTOR 1B

(Spodoptera
frugiperda;
Homo sapiens) 		no annotation 4 SER A  90
ALA A  89
HIS A 139
LEU A  87
 None
 1.16A 5dzkB-5v54A:
undetectable
5dzkP-5v54A:
undetectable		 5dzkB-5v54A:
undetectable
5dzkP-5v54A:
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.
5vkq NO MECHANORECEPTOR
POTENTIAL C ISOFORM
L

(Drosophila
melanogaster) 		PF00023
(Ank)
PF00520
(Ion_trans)
PF12796
(Ank_2)
PF13637
(Ank_4) 		4 PHE A1116
SER A1105
ALA A1112
LEU A1081
 None
 1.00A 5dzkB-5vkqA:
undetectable
5dzkP-5vkqA:
undetectable		 5dzkB-5vkqA:
8.08
5dzkP-5vkqA:
1.12
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.
5xmc E3 UBIQUITIN-PROTEIN
LIGASE ITCHY

(Mus musculus) 		PF00397
(WW)
PF00632
(HECT) 		4 PHE A 605
ALA A 607
HIS A 612
LEU A 534
 None
 1.07A 5dzkB-5xmcA:
undetectable
5dzkP-5xmcA:
undetectable		 5dzkB-5xmcA:
15.23
5dzkP-5xmcA:
0.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6ckc METHYLOSOME PROTEIN
50

(Homo sapiens) 		no annotation 4 PHE B 291
SER B 273
ALA B 272
HIS B 254
 None
 1.15A 5dzkB-6ckcB:
undetectable
5dzkP-6ckcB:
undetectable		 5dzkB-6ckcB:
undetectable
5dzkP-6ckcB:
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.
6eic MYCOBACTERIUM
TUBERCULOSIS
MONOGLYCERIDE LIPASE

(Mycobacterium
tuberculosis) 		no annotation 4 SER C 110
ALA C 136
HIS C 109
LEU C 228
 MPD  C 302 (-3.3A)
SO4  C 301 ( 4.0A)
MPD  C 302 (-4.3A)
SO4  C 301 ( 4.4A)
 0.99A 5dzkB-6eicC:
3.1
5dzkP-6eicC:
undetectable		 5dzkB-6eicC:
undetectable
5dzkP-6eicC:
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.
6exs PEPTIDE ABC
TRANSPORTER PERMEASE

(Staphylococcus
hominis) 		no annotation 4 PHE A 190
ALA A 193
MET A  46
LEU A 191
 None
 1.06A 5dzkB-6exsA:
undetectable
5dzkP-6exsA:
undetectable		 5dzkB-6exsA:
undetectable
5dzkP-6exsA:
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.
6f1j -

(-) 		no annotation 4 PHE A 211
ALA A 175
HIS A 180
LEU A 210
 PEG  A 403 ( 4.7A)
None
ZN  A 406 (-3.3A)
None
 1.16A 5dzkB-6f1jA:
undetectable
5dzkP-6f1jA:
undetectable		 5dzkB-6f1jA:
undetectable
5dzkP-6f1jA:
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.
6f2d FLAGELLAR
BIOSYNTHETIC PROTEIN
FLIP
FLAGELLAR
BIOSYNTHETIC PROTEIN
FLIR

(Salmonella
enterica;
Salmonella
enterica) 		no annotation
no annotation 		4 SER F  34
HIS F 143
MET F 134
LEU A 179
 None
 1.16A 5dzkB-6f2dF:
undetectable
5dzkP-6f2dF:
undetectable		 5dzkB-6f2dF:
undetectable
5dzkP-6f2dF:
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.
6ffl MALTOSE/MALTODEXTRIN
TRANSPORT PERMEASE
HOMOLOGUE

(Bdellovibrio
bacteriovorus) 		no annotation 4 SER A 331
ALA A 332
HIS A 115
LEU A 310
 None
 1.20A 5dzkB-6fflA:
undetectable
5dzkP-6fflA:
undetectable		 5dzkB-6fflA:
undetectable
5dzkP-6fflA:
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.
6g79 5-HYDROXYTRYPTAMINE
RECEPTOR 1B

(Homo sapiens) 		no annotation 4 SER S  90
ALA S  89
HIS S 139
LEU S  87
 None
 1.13A 5dzkB-6g79S:
undetectable
5dzkP-6g79S:
undetectable		 5dzkB-6g79S:
undetectable
5dzkP-6g79S:
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.
6gng -

(-) 		no annotation 4 SER A  27
HIS A 171
MET A 138
LEU A 119
 None
QPS  A 601 (-4.2A)
None
None
 1.27A 5dzkB-6gngA:
3.2
5dzkP-6gngA:
undetectable		 5dzkB-6gngA:
undetectable
5dzkP-6gngA:
undetectable