SIMILAR PATTERNS OF AMINO ACIDS FOR 5UBB_A_SAMA301

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.
1a79 TRNA ENDONUCLEASE

(Methanocaldococcus
jannaschii) 		PF01974
(tRNA_int_endo)
PF02778
(tRNA_int_endo_N) 		5 GLY A  26
SER A  31
LEU A  30
VAL A  21
LEU A  45
 None
 1.09A 5ubbA-1a79A:
undetectable		 5ubbA-1a79A:
23.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1b0k PROTEIN (ACONITASE)

(Sus scrofa) 		PF00330
(Aconitase)
PF00694
(Aconitase_C) 		5 VAL A 202
LEU A  62
VAL A  43
HIS A  46
LEU A  47
 None
 1.30A 5ubbA-1b0kA:
undetectable		 5ubbA-1b0kA:
15.44
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.
1bb9 AMPHIPHYSIN 2

(Rattus
norvegicus) 		PF14604
(SH3_9) 		5 MET A  23
GLY A  66
LEU A  40
VAL A  48
LEU A  42
 None
 1.05A 5ubbA-1bb9A:
undetectable		 5ubbA-1bb9A:
20.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1bpl ALPHA-1,4-GLUCAN-4-G
LUCANOHYDROLASE

(Bacillus
licheniformis) 		PF00128
(Alpha-amylase) 		5 SER A  29
LEU A  32
GLN A   9
TRP A  41
VAL A  40
 None
 1.17A 5ubbA-1bplA:
undetectable		 5ubbA-1bplA:
19.49
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.
1fzy UBIQUITIN-CONJUGATIN
G ENZYME E2-24 KDA

(Saccharomyces
cerevisiae) 		PF00179
(UQ_con) 		5 GLY A  37
VAL A  27
LEU A 106
VAL A  54
LEU A 109
 None
 1.20A 5ubbA-1fzyA:
undetectable		 5ubbA-1fzyA:
20.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1g8p MAGNESIUM-CHELATASE
38 KDA SUBUNIT

(Rhodobacter
capsulatus) 		PF01078
(Mg_chelatase) 		5 SER A 297
LEU A 295
VAL A 310
HIS A 314
LEU A 315
 None
 1.25A 5ubbA-1g8pA:
undetectable		 5ubbA-1g8pA:
20.06
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.
1jke D-TYR-TRNATYR
DEACYLASE

(Escherichia
coli) 		PF02580
(Tyr_Deacylase) 		5 GLY A 123
SER A  12
LEU A  74
VAL A  76
LEU A  28
 None
 1.26A 5ubbA-1jkeA:
undetectable		 5ubbA-1jkeA:
19.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1kps RAN-GTPASE
ACTIVATING PROTEIN 1

(Mus musculus) 		PF07834
(RanGAP1_C) 		5 MET B 500
LEU B 582
GLN B 550
VAL B 548
LEU B 586
 None
 1.26A 5ubbA-1kpsB:
undetectable		 5ubbA-1kpsB:
23.77
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.
1mv0 MYC
BOX-DEPENDENT-INTERA
CTING PROTEIN 1

(Homo sapiens) 		PF14604
(SH3_9) 		5 MET B 411
GLY B 454
LEU B 428
VAL B 436
LEU B 430
 None
 1.27A 5ubbA-1mv0B:
undetectable		 5ubbA-1mv0B:
19.07
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.
1mv3 MYC BOX DEPENDENT
INTERACTING PROTEIN
1

(Homo sapiens) 		PF14604
(SH3_9) 		5 MET A 411
GLY A 454
LEU A 428
VAL A 436
LEU A 430
 None
 1.20A 5ubbA-1mv3A:
undetectable		 5ubbA-1mv3A:
23.32
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.
1p90 HYPOTHETICAL PROTEIN

(Azotobacter
vinelandii) 		PF02579
(Nitro_FeMo-Co) 		5 VAL A 101
LEU A 205
VAL A 168
HIS A 188
LEU A 190
 None
 1.21A 5ubbA-1p90A:
undetectable		 5ubbA-1p90A:
20.00
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.
1r5m SIR4-INTERACTING
PROTEIN SIF2

(Saccharomyces
cerevisiae) 		PF00400
(WD40)
PF12894
(ANAPC4_WD40) 		5 GLY A 176
LEU A 226
GLN A 222
VAL A 223
HIS A 208
 None
 1.27A 5ubbA-1r5mA:
undetectable		 5ubbA-1r5mA:
20.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1urj MAJOR DNA-BINDING
PROTEIN

(Human
alphaherpesvirus
1) 		PF00747
(Viral_DNA_bp) 		5 GLY A 448
LEU A 115
VAL A 511
HIS A 512
LEU A 501
 None
None
None
ZN  A2131 (-2.8A)
None
 1.24A 5ubbA-1urjA:
undetectable		 5ubbA-1urjA:
10.29
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.
1v6z HYPOTHETICAL PROTEIN
TTHA0657

(Thermus
thermophilus) 		PF04452
(Methyltrans_RNA) 		5 GLY A  96
VAL A 136
LEU A 219
VAL A  73
LEU A 178
 None
 1.16A 5ubbA-1v6zA:
undetectable		 5ubbA-1v6zA:
22.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1vjs ALPHA-AMYLASE

(Bacillus
licheniformis) 		PF00128
(Alpha-amylase)
PF09154
(DUF1939) 		5 SER A  29
LEU A  32
GLN A   9
TRP A  41
VAL A  40
 None
 1.13A 5ubbA-1vjsA:
undetectable		 5ubbA-1vjsA:
19.28
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.
1wgv KIAA1068 PROTEIN

(Homo sapiens) 		PF04969
(CS) 		5 SER A  53
LEU A  74
GLN A  26
TRP A 104
HIS A  76
 None
 1.20A 5ubbA-1wgvA:
undetectable		 5ubbA-1wgvA:
19.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1x0a MALATE/L-LACTATE
DEHYDROGENASE FAMILY
PROTEIN

(Thermus
thermophilus) 		PF02615
(Ldh_2) 		5 GLY A  83
VAL A 259
SER A  64
GLN A 257
VAL A  61
 None
 1.01A 5ubbA-1x0aA:
undetectable		 5ubbA-1x0aA:
22.86
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1xtp LMAJ004091AAA

(Leishmania
major) 		PF05891
(Methyltransf_PK) 		5 GLY A 101
SER A 148
GLN A 165
TRP A 166
LEU A 171
 SAI  A 401 (-3.4A)
SAI  A 401 (-4.0A)
SAI  A 401 (-4.6A)
None
None
 0.47A 5ubbA-1xtpA:
32.5		 5ubbA-1xtpA:
31.15
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.
2c4m GLYCOGEN
PHOSPHORYLASE

(Corynebacterium
callunae) 		PF00343
(Phosphorylase) 		5 VAL A 292
SER A 284
LEU A 283
HIS A 280
LEU A 277
 None
 1.21A 5ubbA-2c4mA:
undetectable		 5ubbA-2c4mA:
13.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2c6r DNA-BINDING STRESS
RESPONSE PROTEIN,
DPS FAMILY

(Deinococcus
radiodurans) 		PF00210
(Ferritin) 		5 VAL A 206
LEU A  81
GLN A 138
VAL A 136
LEU A  85
 None
 1.22A 5ubbA-2c6rA:
undetectable		 5ubbA-2c6rA:
20.43
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.
2f2a GLUTAMYL-TRNA(GLN)
AMIDOTRANSFERASE
SUBUNIT A

(Staphylococcus
aureus) 		PF01425
(Amidase) 		5 MET A 191
GLY A 457
VAL A 431
GLN A 454
LEU A 259
 None
 1.24A 5ubbA-2f2aA:
undetectable		 5ubbA-2f2aA:
18.96
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.
2in5 HYPOTHETICAL
LIPOPROTEIN YMCC

(Escherichia
coli) 		PF11102
(YjbF) 		5 MET A  37
GLY A  74
LEU A  97
GLN A 178
VAL A 176
 None
 1.01A 5ubbA-2in5A:
undetectable		 5ubbA-2in5A:
23.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jng CULLIN-7

(Homo sapiens) 		PF11515
(Cul7) 		5 TYR A  34
LEU A  73
GLN A  56
TRP A  67
HIS A  69
 None
 1.24A 5ubbA-2jngA:
undetectable		 5ubbA-2jngA:
20.27
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.
2pb0 ACETYLORNITHINE/SUCC
INYLDIAMINOPIMELATE
AMINOTRANSFERASE

(Salmonella
enterica) 		PF00202
(Aminotran_3) 		5 MET A 242
GLY A 233
LEU A 382
HIS A 312
LEU A 340
 None
 1.21A 5ubbA-2pb0A:
3.6		 5ubbA-2pb0A:
19.61
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.
2qjo BIFUNCTIONAL NMN
ADENYLYLTRANSFERASE/
NUDIX HYDROLASE

(Synechocystis
sp. PCC 6803) 		PF00293
(NUDIX)
PF01467
(CTP_transf_like) 		5 GLY A   8
VAL A  96
LEU A 109
VAL A 107
LEU A 129
 None
 1.26A 5ubbA-2qjoA:
3.1		 5ubbA-2qjoA:
21.51
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.
2qsf DNA REPAIR PROTEIN
RAD4

(Saccharomyces
cerevisiae) 		PF03835
(Rad4)
PF10403
(BHD_1)
PF10405
(BHD_3) 		5 GLY A 268
VAL A 333
SER A 168
VAL A 255
LEU A 252
 None
 1.27A 5ubbA-2qsfA:
undetectable		 5ubbA-2qsfA:
16.73
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.
2rsg COLLAGEN TYPE IV
ALPHA-3-BINDING
PROTEIN

(Homo sapiens) 		PF00169
(PH) 		5 SER A  53
LEU A  52
GLN A 107
HIS A 115
LEU A  71
 None
 0.92A 5ubbA-2rsgA:
undetectable		 5ubbA-2rsgA:
16.89
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.
2w3z PUTATIVE DEACETYLASE

(Streptococcus
mutans) 		PF01522
(Polysacc_deac_1) 		5 TYR A  86
LEU A 111
VAL A 134
HIS A 135
LEU A 129
 None
 1.23A 5ubbA-2w3zA:
undetectable		 5ubbA-2w3zA:
22.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wl1 PYRIN

(Homo sapiens) 		PF00622
(SPRY)
PF13765
(PRY) 		5 GLY A 668
VAL A 722
SER A 757
VAL A 690
LEU A 682
 None
None
EDO  A1780 ( 4.6A)
None
None
 1.15A 5ubbA-2wl1A:
undetectable		 5ubbA-2wl1A:
22.84
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.
2y5c ADRENODOXIN-LIKE
PROTEIN,
MITOCHONDRIAL

(Homo sapiens) 		PF00111
(Fer2) 		5 GLY A  88
LEU A  39
VAL A  54
HIS A  53
LEU A 104
 None
 1.00A 5ubbA-2y5cA:
undetectable		 5ubbA-2y5cA:
19.55
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.
2yg6 PUTRESCINE OXIDASE

(Rhodococcus
erythropolis) 		PF01593
(Amino_oxidase) 		5 SER A  70
LEU A  72
GLN A  59
TRP A  60
VAL A  61
 None
 1.29A 5ubbA-2yg6A:
undetectable		 5ubbA-2yg6A:
20.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zau SELENIDE, WATER
DIKINASE

(Aquifex
aeolicus) 		PF00586
(AIRS)
PF02769
(AIRS_C) 		5 GLY A 297
LEU A 168
VAL A 220
HIS A 228
LEU A 225
 None
 1.30A 5ubbA-2zauA:
undetectable		 5ubbA-2zauA:
20.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ze0 ALPHA-GLUCOSIDASE

(Geobacillus sp.
HTA-462) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		5 LEU A  40
GLN A  13
TRP A  49
VAL A  48
LEU A  93
 None
 1.24A 5ubbA-2ze0A:
undetectable		 5ubbA-2ze0A:
17.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bh0 DNAB-LIKE
REPLICATIVE HELICASE

(Bacillus phage
SPP1) 		PF03796
(DnaB_C) 		5 VAL A 198
SER A 290
LEU A 320
HIS A 229
LEU A 231
 None
 1.27A 5ubbA-3bh0A:
2.8		 5ubbA-3bh0A:
22.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bib T-CELL
IMMUNOGLOBULIN AND
MUCIN
DOMAIN-CONTAINING
PROTEIN 4

(Mus musculus) 		PF07686
(V-set) 		5 GLY X   8
LEU X 107
GLN X  12
VAL X  14
LEU X  16
 None
 1.10A 5ubbA-3bibX:
undetectable		 5ubbA-3bibX:
16.89
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.
3c4n UNCHARACTERIZED
PROTEIN DR_0571

(Deinococcus
radiodurans) 		PF01266
(DAO) 		5 GLY A 236
LEU A 372
GLN A 242
VAL A 240
LEU A 366
 None
 0.97A 5ubbA-3c4nA:
undetectable		 5ubbA-3c4nA:
20.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dcp HISTIDINOL-PHOSPHATA
SE

(Listeria
monocytogenes) 		PF02811
(PHP)
PF13263
(PHP_C) 		5 TYR A 237
VAL A 203
SER A 121
LEU A 122
GLN A 156
 None
None
FE  A 310 ( 4.1A)
None
None
 1.16A 5ubbA-3dcpA:
undetectable		 5ubbA-3dcpA:
22.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hkz DNA-DIRECTED RNA
POLYMERASE SUBUNIT B

(Sulfolobus
solfataricus) 		PF00562
(RNA_pol_Rpb2_6)
PF04560
(RNA_pol_Rpb2_7)
PF04561
(RNA_pol_Rpb2_2)
PF04563
(RNA_pol_Rpb2_1)
PF04565
(RNA_pol_Rpb2_3)
PF04566
(RNA_pol_Rpb2_4)
PF04567
(RNA_pol_Rpb2_5) 		5 GLY B 585
LEU B 633
VAL B 582
HIS B 639
LEU B 640
 None
 1.19A 5ubbA-3hkzB:
undetectable		 5ubbA-3hkzB:
11.52
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.
3i4y CATECHOL
1,2-DIOXYGENASE

(Rhodococcus
opacus) 		PF00775
(Dioxygenase_C)
PF04444
(Dioxygenase_N) 		5 TYR A 162
LEU A 153
GLN A 192
HIS A 222
LEU A 223
 35C  A   1 ( 4.2A)
None
None
FE  A 281 ( 3.3A)
None
 1.12A 5ubbA-3i4yA:
undetectable		 5ubbA-3i4yA:
20.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3im9 MALONYL COA-ACYL
CARRIER PROTEIN
TRANSACYLASE

(Staphylococcus
aureus) 		PF00698
(Acyl_transf_1) 		5 GLY A  91
VAL A 111
MET A  86
GLN A  63
HIS A  88
 None
None
None
None
SO4  A 901 (-3.6A)
 1.22A 5ubbA-3im9A:
undetectable		 5ubbA-3im9A:
23.38
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.
3iv3 TAGATOSE
1,6-DIPHOSPHATE
ALDOLASE 2

(Streptococcus
mutans) 		PF01791
(DeoC) 		5 GLY A 273
VAL A 203
LEU A 315
VAL A 274
LEU A 311
 None
None
None
None
EDO  A 338 ( 3.9A)
 1.29A 5ubbA-3iv3A:
undetectable		 5ubbA-3iv3A:
21.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jwj HEN1

(Trichormus
variabilis) 		PF08242
(Methyltransf_12) 		5 GLY A 288
LEU A 344
VAL A 362
HIS A 365
LEU A 366
 None
 0.72A 5ubbA-3jwjA:
14.9		 5ubbA-3jwjA:
21.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ndy ENDOGLUCANASE D

(Clostridium
cellulovorans) 		PF00150
(Cellulase) 		5 VAL A  13
MET A 197
SER A 225
GLN A  17
VAL A  19
 None
 1.17A 5ubbA-3ndyA:
undetectable		 5ubbA-3ndyA:
18.50
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.
3nmb PUTATIVE SUGAR
HYDROLASE

(Bacteroides
ovatus) 		PF06439
(DUF1080) 		5 GLY A  72
VAL A  81
SER A  51
LEU A  52
LEU A  54
 None
None
None
None
EDO  A   7 ( 4.7A)
 0.97A 5ubbA-3nmbA:
undetectable		 5ubbA-3nmbA:
20.21
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.
3nyq MALONYL-COA LIGASE

(Streptomyces
coelicolor) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		5 GLY A  62
VAL A  53
LEU A  34
VAL A  66
LEU A   8
 None
 1.18A 5ubbA-3nyqA:
2.8		 5ubbA-3nyqA:
18.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rjd HIGH AFFINITY
IMMUNOGLOBULIN GAMMA
FC RECEPTOR I

(Homo sapiens) 		PF00047
(ig)
PF13895
(Ig_2)
PF13927
(Ig_3) 		5 SER A 255
LEU A 278
GLN A 246
VAL A 208
LEU A 202
 None
 1.27A 5ubbA-3rjdA:
undetectable		 5ubbA-3rjdA:
20.66
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.
3swt TAURINE CATABOLISM
DIOXYGENASE, TAUD

(Mycobacterium
marinum) 		PF02668
(TauD) 		5 VAL A  44
SER A  22
LEU A  23
VAL A 245
LEU A  53
 None
 1.10A 5ubbA-3swtA:
undetectable		 5ubbA-3swtA:
21.38
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.
3uai H/ACA
RIBONUCLEOPROTEIN
COMPLEX SUBUNIT 4

(Saccharomyces
cerevisiae) 		PF01472
(PUA)
PF01509
(TruB_N)
PF08068
(DKCLD)
PF16198
(TruB_C_2) 		5 GLY A 184
LEU A 139
GLN A 214
VAL A 127
LEU A 203
 None
 1.25A 5ubbA-3uaiA:
undetectable		 5ubbA-3uaiA:
22.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3unv ADMH

(Pantoea
agglomerans) 		PF00221
(Lyase_aromatic) 		5 SER A 500
LEU A 499
GLN A 489
VAL A 491
LEU A 290
 None
 1.30A 5ubbA-3unvA:
undetectable		 5ubbA-3unvA:
18.28
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.
3zdu CYCLIN-DEPENDENT
KINASE-LIKE 3

(Homo sapiens) 		PF00069
(Pkinase) 		5 TYR A 200
GLY A 188
GLN A 268
VAL A 263
LEU A 259
 None
 1.30A 5ubbA-3zduA:
undetectable		 5ubbA-3zduA:
21.07
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.
4bg7 PUTATIVE
TRANSCRIPTIONAL
COACTIVATOR P15

(Escherichia
virus T5) 		PF02229
(PC4) 		5 GLY A  42
VAL A   5
SER A  17
LEU A  30
LEU A  20
 None
 1.21A 5ubbA-4bg7A:
undetectable		 5ubbA-4bg7A:
17.27
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.
4cg4 PYRIN

(Homo sapiens) 		PF00622
(SPRY)
PF13765
(PRY) 		5 GLY A 668
VAL A 722
SER A 757
VAL A 690
LEU A 682
 None
 1.17A 5ubbA-4cg4A:
undetectable		 5ubbA-4cg4A:
23.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4con ANAEROBIC
RIBONUCLEOSIDE-TRIPH
OSPHATE REDUCTASE

(Thermotoga
maritima) 		PF13597
(NRDD) 		5 TYR A 124
MET A 356
GLY A 439
VAL A 550
VAL A 497
 None
 1.14A 5ubbA-4conA:
undetectable		 5ubbA-4conA:
16.64
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.
4dag NEUTRALIZING
ANTIBODY DS7 HEAVY
CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		5 MET H 117
SER H 186
LEU H 187
VAL H 159
HIS H 209
 None
 1.01A 5ubbA-4dagH:
undetectable		 5ubbA-4dagH:
18.78
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.
4g6c BETA-HEXOSAMINIDASE
1

(Burkholderia
cenocepacia) 		PF00933
(Glyco_hydro_3) 		5 GLY A 107
SER A 155
LEU A 156
VAL A 106
LEU A  88
 None
 1.30A 5ubbA-4g6cA:
undetectable		 5ubbA-4g6cA:
22.89
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.
4gek TRNA
(CMO5U34)-METHYLTRAN
SFERASE

(Escherichia
coli) 		PF13649
(Methyltransf_25) 		5 VAL A 173
SER A 237
LEU A 228
VAL A 211
HIS A 214
 None
 0.98A 5ubbA-4gekA:
17.2		 5ubbA-4gekA:
20.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4glk ABIQ

(Lactococcus
lactis) 		PF13958
(ToxN_toxin) 		5 MET A  92
GLY A  36
VAL A  95
VAL A  35
LEU A 119
 None
None
None
None
GOL  A 202 (-4.6A)
 1.14A 5ubbA-4glkA:
undetectable		 5ubbA-4glkA:
21.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gnx PUTATIVE
UNCHARACTERIZED
PROTEIN

(Ustilago maydis) 		PF01336
(tRNA_anti-codon)
PF08646
(Rep_fac-A_C)
PF16900
(REPA_OB_2) 		5 MET C 401
VAL C 377
SER C 392
VAL C 317
LEU C 306
 None
 1.29A 5ubbA-4gnxC:
undetectable		 5ubbA-4gnxC:
19.14
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.
4iwn TRNA
(CMO5U34)-METHYLTRAN
SFERASE

(Escherichia
coli) 		PF13649
(Methyltransf_25) 		5 VAL A 173
SER A 237
LEU A 228
VAL A 211
HIS A 214
 None
 0.92A 5ubbA-4iwnA:
17.0		 5ubbA-4iwnA:
20.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ix1 HYPOTHETICAL PROTEIN

(Rhodococcus
opacus) 		no annotation 5 GLY A 153
VAL A 157
LEU A  94
VAL A 120
LEU A 117
 None
 0.97A 5ubbA-4ix1A:
undetectable		 5ubbA-4ix1A:
23.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4j3o OUTER MEMBRANE USHER
PROTEIN FIMD

(Escherichia
coli) 		PF00577
(Usher)
PF13953
(PapC_C)
PF13954
(PapC_N) 		5 GLY D 779
SER D 790
LEU D 789
VAL D 787
LEU D 753
 None
 1.24A 5ubbA-4j3oD:
undetectable		 5ubbA-4j3oD:
13.32
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.
4kro CETUXIMAB HEAVY
CHAIN

(Homo sapiens;
Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		5 GLY D  10
SER D  19
LEU D  18
VAL D  12
LEU D  85
 None
 1.22A 5ubbA-4kroD:
undetectable		 5ubbA-4kroD:
19.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ky9 BAND 3 ANION
TRANSPORT PROTEIN

(Homo sapiens) 		PF07565
(Band_3_cyto) 		5 GLY A 243
VAL A 113
LEU A 135
VAL A 267
LEU A 157
 None
 1.28A 5ubbA-4ky9A:
undetectable		 5ubbA-4ky9A:
20.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mch URIDINE
PHOSPHORYLASE

(Aliivibrio
fischeri) 		PF01048
(PNP_UDP_1) 		5 TYR A 119
GLY A 189
SER A 183
LEU A 185
VAL A  74
 None
 0.95A 5ubbA-4mchA:
undetectable		 5ubbA-4mchA:
23.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mtp RNA DEPENDENT RNA
POLYMERASE

(Japanese
encephalitis
virus) 		PF00972
(Flavi_NS5) 		5 GLY A 507
VAL A 672
SER A 501
HIS A 386
LEU A 387
 GLY  A 507 ( 0.0A)
VAL  A 672 ( 0.6A)
SER  A 501 ( 0.0A)
HIS  A 386 ( 1.0A)
LEU  A 387 ( 0.5A)
 1.04A 5ubbA-4mtpA:
undetectable		 5ubbA-4mtpA:
14.40
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.
4nhd 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3 PROTEIN 1

(Vibrio cholerae) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		5 GLY A 208
VAL A 214
SER A 152
HIS A 205
LEU A 204
 COA  A 401 (-3.3A)
None
None
None
None
 1.24A 5ubbA-4nhdA:
undetectable		 5ubbA-4nhdA:
25.08
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.
4oja SUPEROXIDE DISMUTASE
[CU-ZN]

(Hydra vulgaris) 		PF00080
(Sod_Cu) 		5 VAL A  29
LEU A  36
VAL A 118
HIS A 119
LEU A 143
 None
None
None
CU  A 201 (-3.2A)
None
 1.29A 5ubbA-4ojaA:
undetectable		 5ubbA-4ojaA:
18.70
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.
4ra0 TYROSINE-PROTEIN
KINASE RECEPTOR UFO

(Homo sapiens) 		PF13895
(Ig_2)
PF13927
(Ig_3) 		5 VAL C 216
SER C 152
LEU C 151
VAL C 187
HIS C 186
 None
 1.21A 5ubbA-4ra0C:
undetectable		 5ubbA-4ra0C:
22.17
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.
4rus FISH-EGG LECTIN

(Cyprinus carpio) 		PF06462
(Hyd_WA) 		5 GLY A 179
LEU A 186
VAL A 215
HIS A 214
LEU A 224
 None
 1.18A 5ubbA-4rusA:
undetectable		 5ubbA-4rusA:
21.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4wzz PUTATIVE SUGAR ABC
TRANSPORTER,
SUBSTRATE-BINDING
PROTEIN

(Lachnoclostridium
phytofermentans) 		PF13407
(Peripla_BP_4) 		5 GLY A 316
SER A 308
LEU A 309
VAL A 149
LEU A 136
 None
 1.27A 5ubbA-4wzzA:
undetectable		 5ubbA-4wzzA:
19.35
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.
4yd8 PROTEIN PTHB1

(Homo sapiens) 		PF14727
(PHTB1_N) 		5 GLY A  43
LEU A  49
GLN A  80
VAL A  78
LEU A  74
 None
 1.18A 5ubbA-4yd8A:
undetectable		 5ubbA-4yd8A:
22.25
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.
4zrq TRANSCOBALAMIN-2
CD320 ANTIGEN

(Homo sapiens;
Homo sapiens) 		PF01122
(Cobalamin_bind)
PF14478
(DUF4430)
PF00057
(Ldl_recept_a) 		5 TYR A 139
VAL A 110
LEU A 188
TRP C 150
VAL A 153
 None
 1.20A 5ubbA-4zrqA:
undetectable		 5ubbA-4zrqA:
19.22
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5e1b N-TERMINAL
XAA-PRO-LYS
N-METHYLTRANSFERASE
1

(Homo sapiens) 		PF05891
(Methyltransf_PK) 		8 MET A  30
GLY A  69
LEU A 119
GLN A 135
TRP A 136
VAL A 137
HIS A 140
LEU A 141
 SAH  A 301 (-4.1A)
SAH  A 301 (-3.9A)
SAH  A 301 (-3.9A)
SAH  A 301 (-4.6A)
None
SAH  A 301 ( 4.4A)
SAH  A 301 (-3.8A)
None
 0.33A 5ubbA-5e1bA:
36.2		 5ubbA-5e1bA:
47.50
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.
5e9u GLYCOSYLTRANSFERASE
GTF1

(Streptococcus
gordonii) 		PF00534
(Glycos_transf_1) 		5 TYR A 484
GLY A 428
LEU A 410
GLN A 430
LEU A 420
 None
 1.27A 5ubbA-5e9uA:
2.6		 5ubbA-5e9uA:
18.88
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.
5eor ANTI VACCINIA VIRUS
A27 ANTIBODY 8E3
HEAVY CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		5 GLY H  11
SER H  20
LEU H  19
VAL H  13
LEU H  86
 None
 1.28A 5ubbA-5eorH:
undetectable		 5ubbA-5eorH:
21.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5f89 CAP248-2B HEAVY
CHAIN

(Homo sapiens) 		no annotation 5 MET H 108
SER H 177
LEU H 178
VAL H 150
HIS H 200
 None
 1.27A 5ubbA-5f89H:
undetectable		 5ubbA-5f89H:
19.44
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.
5frd CARBOXYLESTERASE
(EST-2)

(Archaeoglobus
fulgidus) 		PF12697
(Abhydrolase_6) 		5 VAL A 251
SER A  75
LEU A  76
VAL A  85
LEU A  98
 None
 1.28A 5ubbA-5frdA:
undetectable		 5ubbA-5frdA:
23.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hdt SISTER CHROMATID
COHESION PROTEIN
PDS5 HOMOLOG B

(Homo sapiens) 		no annotation 5 MET A 495
VAL A 489
SER A 617
LEU A 621
HIS A 660
 None
 1.27A 5ubbA-5hdtA:
undetectable		 5ubbA-5hdtA:
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.
5it9 RIBOSOMAL PROTEIN
RACK1

(Kluyveromyces
lactis) 		PF01092
(Ribosomal_S6e) 		5 GLY g  37
SER g  61
LEU g  43
GLN g  70
VAL g  69
 None
 1.17A 5ubbA-5it9g:
undetectable		 5ubbA-5it9g:
21.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jm6 AMINOPEPTIDASE-LIKE
PROTEIN

(Chaetomium
thermophilum) 		PF02127
(Peptidase_M18) 		5 VAL A 333
SER A 432
LEU A 436
VAL A 477
LEU A 418
 None
 1.17A 5ubbA-5jm6A:
undetectable		 5ubbA-5jm6A:
17.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jry NAD-DEPENDENT
ALDEHYDE
DEHYDROGENASE

(Burkholderia
multivorans) 		PF00171
(Aldedh) 		5 LEU A 198
GLN A  66
VAL A  68
HIS A  71
LEU A 193
 None
 1.29A 5ubbA-5jryA:
3.4		 5ubbA-5jryA:
19.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jxd TUMOR NECROSIS
FACTOR ALPHA-INDUCED
PROTEIN 8

(Mus musculus) 		PF05527
(DUF758) 		5 VAL A  71
LEU A 185
VAL A  57
HIS A 181
LEU A 182
 None
 1.18A 5ubbA-5jxdA:
undetectable		 5ubbA-5jxdA:
25.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5kvp ZOOCIN A
ENDOPEPTIDASE

(Streptococcus
equi) 		PF01551
(Peptidase_M23) 		5 GLY A 108
VAL A 101
SER A  91
LEU A  90
VAL A  47
 None
 1.29A 5ubbA-5kvpA:
undetectable		 5ubbA-5kvpA:
20.43
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.
5l75 LIPOPOLYSACCHARIDE
ABC TRANSPORTER,
ATP-BINDING PROTEIN
LPTB
FIG000906: PREDICTED
PERMEASE

(Klebsiella
pneumoniae;
Klebsiella
pneumoniae) 		PF00005
(ABC_tran)
PF12399
(BCA_ABC_TP_C)
PF03739
(YjgP_YjgQ) 		5 VAL G  91
SER A 139
LEU A 138
VAL A 146
LEU A 130
 None
 1.17A 5ubbA-5l75G:
undetectable		 5ubbA-5l75G:
21.78
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.
5lj3 PRP46

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		5 MET J 301
VAL J 295
SER J 322
LEU J 316
VAL J 282
 None
 1.27A 5ubbA-5lj3J:
undetectable		 5ubbA-5lj3J:
20.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5m89 SPLICEOSOME WD40 SC

(Chaetomium
thermophilum) 		no annotation 6 TYR A 267
GLY A 258
LEU A 286
GLN A 277
VAL A 264
LEU A 295
 None
 1.33A 5ubbA-5m89A:
undetectable		 5ubbA-5m89A:
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.
5n6y NITROGENASE
VANADIUM-IRON
PROTEIN BETA CHAIN

(Azotobacter
vinelandii) 		no annotation 5 TYR E  38
MET E 216
GLY E 191
VAL E 188
VAL E 193
 None
 1.23A 5ubbA-5n6yE:
undetectable		 5ubbA-5n6yE:
20.08
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.
5opg ENVELOPE
GLYCOPROTEIN GN

(Hantaan
orthohantavirus) 		PF01567
(Hanta_G1) 		5 SER A 354
LEU A 311
GLN A  79
VAL A 337
LEU A 328
 None
 1.24A 5ubbA-5opgA:
undetectable		 5ubbA-5opgA:
22.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5oyn DEHYDRATASE,
ILVD/EDD FAMILY

(Caulobacter
vibrioides) 		no annotation 5 GLY A 485
SER A 505
LEU A 511
VAL A 449
LEU A 514
 None
 1.23A 5ubbA-5oynA:
undetectable		 5ubbA-5oynA:
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.
5th9 GS-5745 FAB HEAVY
CHAIN

(Oryctolagus
cuniculus) 		PF07654
(C1-set)
PF07686
(V-set) 		5 GLY H  10
SER H  19
LEU H  18
VAL H  12
LEU H  85
 None
 1.25A 5ubbA-5th9H:
undetectable		 5ubbA-5th9H:
22.27
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.
5tj2 SUGAR ABC
TRANSPORTER
SUBSTRATE-BINDING
PROTEIN,GASDERMIN-B
FUSION PROTEIN

(Escherichia
coli;
Homo sapiens) 		PF04598
(Gasdermin)
PF13416
(SBP_bac_8) 		5 SER A1397
LEU A1399
GLN A1344
VAL A1346
LEU A1355
 None
 1.28A 5ubbA-5tj2A:
undetectable		 5ubbA-5tj2A:
17.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5x41 COBALT TRANSPORT
PROTEIN CBIM

(Rhodobacter
capsulatus) 		no annotation 5 TYR M 127
GLY M  76
VAL M  84
VAL M  79
LEU M 204
 None
 1.07A 5ubbA-5x41M:
undetectable		 5ubbA-5x41M:
21.21
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.
6be3 FAB (F598) HEAVY
CHAIN

(Homo sapiens) 		no annotation 5 MET H 119
SER H 188
LEU H 189
VAL H 161
HIS H 211
 None
 1.27A 5ubbA-6be3H:
undetectable		 5ubbA-6be3H:
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.
6bhu MULTIDRUG
RESISTANCE-ASSOCIATE
D PROTEIN 1

(Bos taurus) 		no annotation 5 GLY A1508
VAL A1314
SER A1511
LEU A1513
VAL A1496
 None
 1.25A 5ubbA-6bhuA:
undetectable		 5ubbA-6bhuA:
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.
6blb HOLLIDAY JUNCTION
ATP-DEPENDENT DNA
HELICASE RUVB

(Pseudomonas
aeruginosa) 		no annotation 5 GLY A 160
VAL A 179
SER A  88
HIS A 117
LEU A 119
 None
 1.19A 5ubbA-6blbA:
undetectable		 5ubbA-6blbA:
20.11
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.
6d6u GAMMA-AMINOBUTYRIC
ACID RECEPTOR
SUBUNIT
BETA-2,GAMMA-AMINOBU
TYRIC ACID RECEPTOR
SUBUNIT BETA-2

(Homo sapiens) 		no annotation 6 SER A  73
LEU A  72
GLN A  65
VAL A 124
HIS A 119
LEU A 118
 None
None
None
None
NAG  A 404 (-3.9A)
None
 1.31A 5ubbA-6d6uA:
undetectable		 5ubbA-6d6uA:
21.23
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.
6dub -

(-) 		no annotation 12 TYR A  76
MET A  86
GLY A 124
VAL A 130
MET A 147
SER A 173
LEU A 174
GLN A 190
TRP A 191
VAL A 192
HIS A 195
LEU A 196
 SAH  A 301 (-3.7A)
SAH  A 301 (-3.9A)
SAH  A 301 (-3.9A)
None
SAH  A 301 (-3.5A)
UNX  A 311 (-4.0A)
SAH  A 301 (-4.0A)
SAH  A 301 (-4.2A)
GOL  A 303 ( 4.9A)
UNX  A 316 ( 4.3A)
SAH  A 301 (-3.9A)
None
 0.11A 5ubbA-6dubA:
38.7		 5ubbA-6dubA:
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.
6dub -

(-) 		no annotation 8 TYR A  76
MET A  86
GLY A 124
VAL A 130
MET A 148
GLN A 190
TRP A 191
HIS A 195
 SAH  A 301 (-3.7A)
SAH  A 301 (-3.9A)
SAH  A 301 (-3.9A)
None
SAH  A 301 (-4.4A)
SAH  A 301 (-4.2A)
GOL  A 303 ( 4.9A)
SAH  A 301 (-3.9A)
 1.13A 5ubbA-6dubA:
38.7		 5ubbA-6dubA:
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.
6et9 ACETYL-COA
ACETYLTRANSFERASE
THIOLASE

(Methanothermococcus
thermolithotrophicus) 		no annotation 5 GLY A 380
LEU A 257
VAL A 376
HIS A 284
LEU A 294
 None
 1.18A 5ubbA-6et9A:
undetectable		 5ubbA-6et9A:
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.
6fa5 PUTATIVE MRNA
SPLICING FACTOR

(Chaetomium
thermophilum) 		no annotation 5 VAL A 404
LEU A 675
GLN A 666
VAL A 664
LEU A 689
 None
 1.21A 5ubbA-6fa5A:
undetectable		 5ubbA-6fa5A:
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.
1ebv PROSTAGLANDIN H2
SYNTHASE

(Ovis aries) 		PF00008
(EGF)
PF03098
(An_peroxidase) 		4 GLY A 225
ARG A 376
ASP A 229
GLN A 330
 None
 1.36A 5ubbA-1ebvA:
undetectable		 5ubbA-1ebvA:
17.42
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.
1ebv PROSTAGLANDIN H2
SYNTHASE

(Ovis aries) 		PF00008
(EGF)
PF03098
(An_peroxidase) 		4 GLY A 227
ARG A 376
ASP A 229
GLN A 241
 None
 1.42A 5ubbA-1ebvA:
undetectable		 5ubbA-1ebvA:
17.42
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.
1ebv PROSTAGLANDIN H2
SYNTHASE

(Ovis aries) 		PF00008
(EGF)
PF03098
(An_peroxidase) 		4 GLY A 227
ARG A 376
ASP A 229
GLN A 330
 None
 1.39A 5ubbA-1ebvA:
undetectable		 5ubbA-1ebvA:
17.42
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.
1gxs P-(S)-HYDROXYMANDELO
NITRILE LYASE CHAIN
A
P-(S)-HYDROXYMANDELO
NITRILE LYASE CHAIN
B

(Sorghum
bicolor;
Sorghum bicolor) 		PF00450
(Peptidase_S10)
PF00450
(Peptidase_S10) 		4 GLY B 413
ARG B 420
ASP B 359
GLN A 245
 None
 1.49A 5ubbA-1gxsB:
undetectable		 5ubbA-1gxsB:
20.27
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.
1l5j ACONITATE HYDRATASE
2

(Escherichia
coli) 		PF00330
(Aconitase)
PF06434
(Aconitase_2_N)
PF11791
(Aconitase_B_N) 		4 GLY A 513
ARG A 344
MET A 420
GLN A 440
 None
 1.36A 5ubbA-1l5jA:
undetectable		 5ubbA-1l5jA:
14.35
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.
1o5w AMINE OXIDASE
[FLAVIN-CONTAINING]
A

(Rattus
norvegicus) 		PF01593
(Amino_oxidase) 		4 GLY A 203
ARG A 206
ASP A 132
MET A 131
 None
 1.29A 5ubbA-1o5wA:
undetectable		 5ubbA-1o5wA:
16.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ulv GLUCODEXTRANASE

(Arthrobacter
globiformis) 		PF00723
(Glyco_hydro_15)
PF09136
(Glucodextran_B)
PF09137
(Glucodextran_N)
PF09985
(Glucodextran_C) 		4 GLY A  65
ARG A 199
ASP A  64
GLN A  74
 None
 1.27A 5ubbA-1ulvA:
undetectable		 5ubbA-1ulvA:
12.25
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.
1xoc OLIGOPEPTIDE-BINDING
PROTEIN APPA

(Bacillus
subtilis) 		PF00496
(SBP_bac_5) 		4 GLY A 146
ARG A 463
ASP A 145
GLN A 435
 None
 1.50A 5ubbA-1xocA:
undetectable		 5ubbA-1xocA:
17.85
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.
2bma GLUTAMATE
DEHYDROGENASE
(NADP+)

(Plasmodium
falciparum) 		PF00208
(ELFV_dehydrog)
PF02812
(ELFV_dehydrog_N) 		4 GLY A 164
ARG A 205
ASP A 165
GLN A 323
 None
 1.36A 5ubbA-2bmaA:
undetectable		 5ubbA-2bmaA:
19.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fem CYTIDYLATE KINASE

(Escherichia
coli) 		PF02224
(Cytidylate_kin) 		4 GLY A  12
ARG A 154
ASP A  11
GLN A 117
 None
 1.45A 5ubbA-2femA:
undetectable		 5ubbA-2femA:
21.60
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.
2vea PHYTOCHROME-LIKE
PROTEIN CPH1

(Synechocystis
sp. PCC 6803) 		PF00360
(PHY)
PF01590
(GAF)
PF08446
(PAS_2) 		4 GLY A 184
ARG A 213
ASP A 185
GLN A 446
 None
 1.39A 5ubbA-2veaA:
undetectable		 5ubbA-2veaA:
18.08
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.
2vun ENAMIDASE

(Eubacterium
barkeri) 		PF01979
(Amidohydro_1) 		4 ARG A 290
ASP A  65
MET A  96
GLN A 191
 None
 1.44A 5ubbA-2vunA:
undetectable		 5ubbA-2vunA:
17.30
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.
2w9m POLYMERASE X

(Deinococcus
radiodurans) 		PF14520
(HHH_5)
PF14716
(HHH_8) 		4 GLY A 230
ARG A 125
ASP A 227
GLN A 219
 None
 1.42A 5ubbA-2w9mA:
undetectable		 5ubbA-2w9mA:
18.04
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.
2yr5 PRO-ENZYME OF
L-PHENYLALANINE
OXIDASE

(Pseudomonas sp.
P-501) 		no annotation 4 GLY A 658
ARG A 329
ASP A 652
GLN A 414
 None
None
FAD  A 801 (-3.3A)
FAD  A 801 ( 3.1A)
 1.43A 5ubbA-2yr5A:
undetectable		 5ubbA-2yr5A:
13.71
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.
3byv RHOPTRY KINASE

(Toxoplasma
gondii) 		PF14531
(Kinase-like) 		4 GLY A 448
ARG A 450
ASP A 447
GLN A 547
 None
 1.37A 5ubbA-3byvA:
undetectable		 5ubbA-3byvA:
20.73
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.
3c9r THIAMINE
MONOPHOSPHATE KINASE

(Aquifex
aeolicus) 		PF00586
(AIRS) 		4 GLY A 211
ARG A 161
ASP A 215
GLN A 221
 None
 1.03A 5ubbA-3c9rA:
undetectable		 5ubbA-3c9rA:
21.43
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.
3cf4 ACETYL-COA
DECARBOXYLASE/SYNTHA
SE ALPHA SUBUNIT

(Methanosarcina
barkeri) 		PF03063
(Prismane) 		4 GLY A 506
ARG A 503
MET A 511
GLN A 796
 None
None
None
ACY  A 824 ( 3.2A)
 1.42A 5ubbA-3cf4A:
1.6		 5ubbA-3cf4A:
13.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3d62 3C-LIKE PROTEINASE

(Severe acute
respiratory
syndrome-related
coronavirus) 		PF05409
(Peptidase_C30) 		4 GLY A 179
ARG A  40
ASP A 176
GLN A 107
 None
 1.27A 5ubbA-3d62A:
undetectable		 5ubbA-3d62A:
22.88
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.
3dni DEOXYRIBONUCLEASE I

(Bos taurus) 		PF03372
(Exo_endo_phos) 		4 GLY A 100
ARG A  73
ASP A  98
GLN A 156
 None
 1.41A 5ubbA-3dniA:
undetectable		 5ubbA-3dniA:
21.48
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.
3egw RESPIRATORY NITRATE
REDUCTASE 1 ALPHA
CHAIN
RESPIRATORY NITRATE
REDUCTASE 1 BETA
CHAIN

(Escherichia
coli;
Escherichia
coli) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF14710
(Nitr_red_alph_N)
PF13247
(Fer4_11)
PF14711
(Nitr_red_bet_C) 		4 GLY B 150
ARG A1153
ASP A1131
GLN A1242
 None
 1.20A 5ubbA-3egwB:
undetectable		 5ubbA-3egwB:
17.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3iuu PUTATIVE
METALLOPEPTIDASE

(Chelativorans
sp. BNC1) 		PF07171
(MlrC_C)
PF07364
(DUF1485) 		4 GLY A 117
ARG A 122
ASP A 114
GLN A 471
 None
 1.47A 5ubbA-3iuuA:
2.5		 5ubbA-3iuuA:
18.57
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.
3jyf 2',3'-CYCLIC
NUCLEOTIDE
2'-PHOSPHODIESTERASE
/3'-NUCLEOTIDASE
BIFUNCTIONAL
PERIPLASMIC PROTEIN

(Klebsiella
pneumoniae) 		PF00149
(Metallophos) 		4 GLY A 241
ASP A  16
MET A 275
GLN A  64
 None
MN  A 340 (-3.2A)
None
GOL  A 350 (-3.1A)
 1.26A 5ubbA-3jyfA:
undetectable		 5ubbA-3jyfA:
19.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3k70 EXODEOXYRIBONUCLEASE
V BETA CHAIN

(Escherichia
coli) 		PF00580
(UvrD-helicase)
PF12705
(PDDEXK_1)
PF13361
(UvrD_C) 		4 GLY B 510
ARG B 822
ASP B 513
GLN B 520
 None
 1.30A 5ubbA-3k70B:
3.7		 5ubbA-3k70B:
11.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ml0 PENICILLIN G
ACYLASE, ALPHA
SUBUNIT
PENICILLIN G
ACYLASE, BETA
SUBUNIT

(Alcaligenes
faecalis;
Alcaligenes
faecalis) 		PF01804
(Penicil_amidase)
PF01804
(Penicil_amidase) 		4 GLY A  50
ARG A  45
ASP A  68
GLN B 111
 None
 1.36A 5ubbA-3ml0A:
undetectable		 5ubbA-3ml0A:
23.14
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.
3om5 LEVANSUCRASE

(Bacillus
megaterium) 		PF02435
(Glyco_hydro_68) 		4 GLY A 294
ARG A 290
ASP A  49
GLN A  56
 None
 1.38A 5ubbA-3om5A:
undetectable		 5ubbA-3om5A:
20.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qxb PUTATIVE XYLOSE
ISOMERASE

(Rhodospirillum
rubrum) 		PF01261
(AP_endonuc_2) 		4 GLY A 196
ARG A 235
ASP A 194
GLN A  34
 None
None
FE  A 301 ( 3.2A)
None
 1.45A 5ubbA-3qxbA:
undetectable		 5ubbA-3qxbA:
21.41
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.
3u07 UNCHARACTERIZED
PROTEIN VPA0106

(Vibrio
parahaemolyticus) 		PF06742
(DUF1214)
PF06863
(DUF1254) 		4 GLY A 130
ARG A 127
MET A 103
GLN A 135
 None
 1.28A 5ubbA-3u07A:
undetectable		 5ubbA-3u07A:
21.63
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.
3vb9 UNCHARACTERIZED
PROTEIN VPA0735

(Vibrio
parahaemolyticus) 		PF06742
(DUF1214)
PF06863
(DUF1254) 		4 GLY A 351
ARG A 362
ASP A 145
MET A 134
 MG  A 501 ( 4.5A)
None
None
None
 1.25A 5ubbA-3vb9A:
undetectable		 5ubbA-3vb9A:
19.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zyx AMINE OXIDASE
[FLAVIN-CONTAINING]
B

(Homo sapiens) 		PF01593
(Amino_oxidase) 		4 GLY A 194
ARG A 197
ASP A 123
MET A 122
 None
 1.35A 5ubbA-3zyxA:
1.5		 5ubbA-3zyxA:
16.89
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.
4ddq DNA GYRASE SUBUNIT A

(Bacillus
subtilis) 		PF00521
(DNA_topoisoIV) 		4 GLY A  41
ASP A  40
MET A 160
GLN A 147
 None
 1.30A 5ubbA-4ddqA:
undetectable		 5ubbA-4ddqA:
19.81
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.
4du5 PFKB

(Polaromonas sp.
JS666) 		PF00294
(PfkB) 		4 GLY A  82
ARG A  80
ASP A  84
MET A  86
 None
 1.29A 5ubbA-4du5A:
4.0		 5ubbA-4du5A:
19.46
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.
4fwt ELONGATION FACTOR
TS, ELONGATION
FACTOR TU, LINKER, Q
BETA REPLICASE

(Escherichia
coli;
Escherichia
virus Qbeta) 		PF00009
(GTP_EFTU)
PF00889
(EF_TS)
PF03143
(GTP_EFTU_D3)
PF03144
(GTP_EFTU_D2)
PF03431
(RNA_replicase_B) 		4 GLY A 638
ASP A 639
MET A 636
GLN A 147
 None
 1.47A 5ubbA-4fwtA:
undetectable		 5ubbA-4fwtA:
11.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4it1 PUTATIVE GLUCARATE
DEHYDRATASE

(Pseudomonas
fluorescens) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 GLY A  23
ARG A 423
ASP A 406
GLN A 403
 None
 1.38A 5ubbA-4it1A:
undetectable		 5ubbA-4it1A:
19.86
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.
4k9s GDSL-LIKE
LIPASE/ACYLHYDROLASE
FAMILY PROTEIN

(Neisseria
meningitidis) 		PF00657
(Lipase_GDSL) 		4 GLY A  84
ASP A  85
MET A 117
GLN A  96
 None
 1.20A 5ubbA-4k9sA:
undetectable		 5ubbA-4k9sA:
20.77
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.
4laq SINGLE HEAVY CHAIN
VARIABLE FRAGMENT

(Mus musculus) 		PF07686
(V-set) 		4 GLY H  32
ARG H  71
ASP H  96
MET H 100
 None
 1.46A 5ubbA-4laqH:
undetectable		 5ubbA-4laqH:
19.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4m47 DNA POLYMERASE BETA

(Homo sapiens) 		PF10391
(DNA_pol_lambd_f)
PF14716
(HHH_8)
PF14791
(DNA_pol_B_thumb)
PF14792
(DNA_pol_B_palm) 		4 GLY A 179
ARG A 333
ASP A 192
MET A 191
 XG4  A 401 (-3.1A)
None
MG  A 402 (-2.4A)
None
 1.41A 5ubbA-4m47A:
undetectable		 5ubbA-4m47A:
21.52
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.
4ph9 PROSTAGLANDIN G/H
SYNTHASE 2

(Mus musculus) 		PF00008
(EGF)
PF03098
(An_peroxidase) 		4 GLY A 226
ARG A 377
ASP A 230
GLN A 331
 None
 1.35A 5ubbA-4ph9A:
undetectable		 5ubbA-4ph9A:
18.00
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.
4ph9 PROSTAGLANDIN G/H
SYNTHASE 2

(Mus musculus) 		PF00008
(EGF)
PF03098
(An_peroxidase) 		4 GLY A 228
ARG A 377
ASP A 230
GLN A 242
 EDO  A 616 ( 4.5A)
None
None
None
 1.43A 5ubbA-4ph9A:
undetectable		 5ubbA-4ph9A:
18.00
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.
4ph9 PROSTAGLANDIN G/H
SYNTHASE 2

(Mus musculus) 		PF00008
(EGF)
PF03098
(An_peroxidase) 		4 GLY A 228
ARG A 377
ASP A 230
GLN A 331
 EDO  A 616 ( 4.5A)
None
None
None
 1.36A 5ubbA-4ph9A:
undetectable		 5ubbA-4ph9A:
18.00
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.
4qnx TRNA
(MO5U34)-METHYLTRANS
FERASE

(Escherichia
coli) 		PF08003
(Methyltransf_9) 		4 GLY A 132
ARG A  90
ASP A 152
GLN A 183
 None
None
None
SO4  A 403 (-4.2A)
 1.47A 5ubbA-4qnxA:
14.3		 5ubbA-4qnxA:
20.19
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.
4ras OXIDOREDUCTASE,
NAD-BINDING/IRON-SUL
FUR CLUSTER-BINDING
PROTEIN

(Nitratireductor
pacificus) 		PF12838
(Fer4_7)
PF13486
(Dehalogenase) 		4 GLY A 475
ARG A 473
ASP A 476
GLN A 658
 B12  A 803 ( 4.3A)
None
B12  A 803 (-3.3A)
None
 1.11A 5ubbA-4rasA:
undetectable		 5ubbA-4rasA:
15.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rkc AROMATIC AMINO ACID
AMINOTRANSFERASE

(Psychrobacter
sp. B6) 		PF00155
(Aminotran_1_2) 		4 GLY A 218
ARG A 322
ASP A 224
MET A 221
 None
None
None
NO3  A 404 (-4.8A)
 0.89A 5ubbA-4rkcA:
4.3		 5ubbA-4rkcA:
19.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zxi TYROCIDINE
SYNTHETASE 3

(Acinetobacter
baumannii) 		PF00501
(AMP-binding)
PF00550
(PP-binding)
PF00668
(Condensation)
PF00975
(Thioesterase)
PF13193
(AMP-binding_C) 		4 ARG A 289
ASP A 149
MET A 148
GLN A 394
 None
 0.84A 5ubbA-4zxiA:
2.6		 5ubbA-4zxiA:
10.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5e1b N-TERMINAL
XAA-PRO-LYS
N-METHYLTRANSFERASE
1

(Homo sapiens) 		PF05891
(Methyltransf_PK) 		4 GLY A  71
ARG A  74
ASP A  91
GLN A 120
 SAH  A 301 (-3.1A)
SAH  A 301 (-3.9A)
SAH  A 301 (-2.7A)
SAH  A 301 (-3.4A)
 0.21A 5ubbA-5e1bA:
36.2		 5ubbA-5e1bA:
47.50
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.
5evj ARSENITE
METHYLTRANSFERASE

(Chlamydomonas
reinhardtii) 		PF13847
(Methyltransf_31) 		4 GLY A  93
ARG A  96
ASP A 115
MET A 116
 None
 1.45A 5ubbA-5evjA:
13.3		 5ubbA-5evjA:
21.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5i6c URIC ACID-XANTHINE
PERMEASE

(Aspergillus
nidulans) 		PF00860
(Xan_ur_permease) 		4 GLY A 238
ASP A 241
MET A 452
GLN A 112
 None
 1.27A 5ubbA-5i6cA:
undetectable		 5ubbA-5i6cA:
17.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ikr PROSTAGLANDIN G/H
SYNTHASE 2

(Homo sapiens) 		PF00008
(EGF)
PF03098
(An_peroxidase) 		4 GLY A 225
ARG A 376
ASP A 229
GLN A 330
 None
 1.42A 5ubbA-5ikrA:
undetectable		 5ubbA-5ikrA:
15.65
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.
5ikr PROSTAGLANDIN G/H
SYNTHASE 2

(Homo sapiens) 		PF00008
(EGF)
PF03098
(An_peroxidase) 		4 GLY A 227
ARG A 376
ASP A 229
GLN A 241
 None
 1.42A 5ubbA-5ikrA:
undetectable		 5ubbA-5ikrA:
15.65
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.
5ikr PROSTAGLANDIN G/H
SYNTHASE 2

(Homo sapiens) 		PF00008
(EGF)
PF03098
(An_peroxidase) 		4 GLY A 227
ARG A 376
ASP A 229
GLN A 330
 None
 1.43A 5ubbA-5ikrA:
undetectable		 5ubbA-5ikrA:
15.65
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.
5jay 8-AMINO-7-OXONONANOA
TE SYNTHASE

(Paraburkholderia
xenovorans) 		PF00155
(Aminotran_1_2) 		4 GLY A 186
ARG A 309
ASP A 185
MET A 184
 None
 1.42A 5ubbA-5jayA:
undetectable		 5ubbA-5jayA:
18.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5k1c UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE 12

(Homo sapiens) 		PF00443
(UCH) 		4 GLY A 178
ARG A 298
ASP A 198
GLN A 141
 None
 1.44A 5ubbA-5k1cA:
undetectable		 5ubbA-5k1cA:
19.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5kx6 GALACTOSIDE
2-ALPHA-L-FUCOSYLTRA
NSFERASE

(Arabidopsis
thaliana) 		PF03254
(XG_FTase) 		4 GLY A 284
ASP A 285
MET A 279
GLN A 254
 None
 1.33A 5ubbA-5kx6A:
undetectable		 5ubbA-5kx6A:
19.00
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.
5l7z MATERNAL PROTEIN
EXUPERANTIA

(Drosophila
melanogaster) 		no annotation 4 GLY A  44
ASP A  49
MET A  48
GLN A 314
 None
 1.40A 5ubbA-5l7zA:
undetectable		 5ubbA-5l7zA:
20.00
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.
5ld5 GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE

(Atopobium
vaginae) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		4 GLY A 257
ARG A 251
ASP A 335
GLN A  35
 None
 1.36A 5ubbA-5ld5A:
4.0		 5ubbA-5ld5A:
18.80
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.
5lpc VANADIUM-DEPENDENT
BROMOPEROXIDASE

(Acaryochloris
marina) 		no annotation 4 GLY A 517
ARG A 425
ASP A 598
GLN A 180
 None
 1.14A 5ubbA-5lpcA:
undetectable		 5ubbA-5lpcA:
15.93
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.
5mjv CAPSID SUBUNIT VP1
CAPSID SUBUNIT VP3

(Parechovirus A;
Parechovirus A) 		no annotation
no annotation 		4 GLY B 137
ARG B 200
ASP B 239
MET A  56
 None
 1.34A 5ubbA-5mjvB:
undetectable		 5ubbA-5mjvB:
21.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5u03 CTP SYNTHASE 1

(Homo sapiens) 		PF00117
(GATase)
PF06418
(CTP_synth_N) 		4 GLY A  64
ARG A 479
ASP A  63
GLN A 128
 None
 1.37A 5ubbA-5u03A:
undetectable		 5ubbA-5u03A:
17.11
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.
5ufs ANCESTRAL
GLUCOCORTICOID
RECEPTOR2

(unidentified) 		PF00104
(Hormone_recep) 		4 GLY A  16
ARG A  27
ASP A  95
GLN A  84
 None
 1.44A 5ubbA-5ufsA:
undetectable		 5ubbA-5ufsA:
23.28
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.
5vj4 UNCHARACTERIZED
PROTEIN

(Borrelia
turicatae) 		no annotation 4 GLY A 415
ARG A 419
ASP A 414
MET A 412
 SO4  A 505 (-4.0A)
SO4  A 502 (-3.2A)
None
SO4  A 505 ( 4.8A)
 1.40A 5ubbA-5vj4A:
undetectable		 5ubbA-5vj4A:
17.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5vnx 8-AMINO-7-OXONONANOA
TE SYNTHASE

(Burkholderia
multivorans) 		PF00155
(Aminotran_1_2) 		4 GLY A 186
ARG A 309
ASP A 185
MET A 184
 None
None
EDO  A 606 (-3.8A)
BEN  A 601 ( 4.5A)
 1.41A 5ubbA-5vnxA:
2.3		 5ubbA-5vnxA:
21.41
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.
5y3r X-RAY REPAIR
CROSS-COMPLEMENTING
PROTEIN 6
DNA-DEPENDENT
PROTEIN KINASE
CATALYTIC SUBUNIT

(Homo sapiens;
Homo sapiens) 		PF02735
(Ku)
PF03730
(Ku_C)
PF03731
(Ku_N)
PF00454
(PI3_PI4_kinase)
PF02259
(FAT)
PF02260
(FATC)
PF08163
(NUC194) 		4 GLY A 191
ARG A 218
ASP A 192
GLN C2353
 None
 1.50A 5ubbA-5y3rA:
undetectable		 5ubbA-5y3rA:
17.94
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.
6brd RIFAMPIN
MONOOXYGENASE

(Streptomyces
venezuelae) 		no annotation 4 GLY A 258
ARG A 256
ASP A 259
GLN A 340
 None
 1.32A 5ubbA-6brdA:
undetectable		 5ubbA-6brdA:
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.
6dub -

(-) 		no annotation 4 GLY A 126
ARG A 129
ASP A 146
MET A 147
 SAH  A 301 (-3.0A)
SAH  A 301 (-3.9A)
SAH  A 301 (-2.8A)
SAH  A 301 (-3.5A)
 0.95A 5ubbA-6dubA:
38.7		 5ubbA-6dubA:
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.
6dub -

(-) 		no annotation 5 GLY A 126
ARG A 129
ASP A 146
MET A 148
GLN A 175
 SAH  A 301 (-3.0A)
SAH  A 301 (-3.9A)
SAH  A 301 (-2.8A)
SAH  A 301 (-4.4A)
SAH  A 301 (-3.5A)
 0.14A 5ubbA-6dubA:
38.7		 5ubbA-6dubA:
undetectable