SIMILAR PATTERNS OF AMINO ACIDS FOR 3OU7_B_SAMB300

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.
1gyd ARABINAN
ENDO-1,5-ALPHA-L-ARA
BINOSIDASE A

(Cellvibrio
japonicus) 		PF04616
(Glyco_hydro_43) 		5 GLY B 239
GLY B 288
SER B 247
ALA B 236
HIS B 291
 None
 1.14A 3ou7B-1gydB:
undetectable		 3ou7B-1gydB:
23.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1htq GLUTAMINE SYNTHETASE

(Mycobacterium
tuberculosis) 		PF00120
(Gln-synt_C)
PF03951
(Gln-synt_N) 		5 TYR A 171
GLY A 170
GLY A 156
SER A 155
HIS A 175
 None
 1.16A 3ou7B-1htqA:
undetectable		 3ou7B-1htqA:
18.09
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.
1idu VANADIUM
CHLOROPEROXIDASE

(Curvularia
inaequalis) 		PF01569
(PAP2) 		5 LEU A 241
GLY A 409
GLY A 552
ALA A 341
HIS A 239
 None
 1.14A 3ou7B-1iduA:
undetectable		 3ou7B-1iduA:
18.18
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.
1itz TRANSKETOLASE

(Zea mays) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		5 ALA A 134
GLY A 132
GLY A 432
ALA A 176
HIS A 424
 None
 0.90A 3ou7B-1itzA:
undetectable		 3ou7B-1itzA:
15.21
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.
1kol FORMALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 TYR A 302
GLY A 300
GLY A  47
SER A  48
ALA A 192
 None
NAD  A1403 ( 3.7A)
NAD  A1403 (-3.1A)
NAD  A1403 (-2.7A)
NAD  A1403 ( 4.1A)
 1.11A 3ou7B-1kolA:
6.2		 3ou7B-1kolA:
19.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1puj CONSERVED
HYPOTHETICAL PROTEIN
YLQF

(Bacillus
subtilis) 		PF01926
(MMR_HSR1) 		5 LEU A 210
TYR A 256
ALA A 240
GLY A 242
LEU A 227
 None
 1.13A 3ou7B-1pujA:
undetectable		 3ou7B-1pujA:
22.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1rmg RHAMNOGALACTURONASE
A

(Aspergillus
aculeatus) 		PF00295
(Glyco_hydro_28) 		5 ALA A 148
GLY A 114
GLY A 170
LEU A 176
ALA A 127
 None
 1.04A 3ou7B-1rmgA:
undetectable		 3ou7B-1rmgA:
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.
1rp0 THIAZOLE
BIOSYNTHETIC ENZYME

(Arabidopsis
thaliana) 		PF01946
(Thi4) 		5 GLY A 240
GLY A  48
SER A  49
MET A 259
ALA A 195
 AHZ  A 600 (-3.5A)
AHZ  A 600 (-3.4A)
AHZ  A 600 (-3.5A)
AHZ  A 600 (-3.3A)
None
 1.08A 3ou7B-1rp0A:
2.6		 3ou7B-1rp0A:
23.23
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.
1sbp SULFATE-BINDING
PROTEIN

(Salmonella
enterica) 		PF13531
(SBP_bac_11) 		5 ALA A 173
GLY A 132
GLY A  44
SER A  45
ALA A 191
 SO4  A 311 (-3.4A)
SO4  A 311 (-3.1A)
SO4  A 311 (-3.5A)
SO4  A 311 (-4.4A)
None
 0.92A 3ou7B-1sbpA:
undetectable		 3ou7B-1sbpA:
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.
1sqj OLIGOXYLOGLUCAN
REDUCING-END-SPECIFI
C CELLOBIOHYDROLASE

(Geotrichum sp.
M128) 		PF15899
(BNR_6) 		5 ALA A 553
GLY A 603
GLY A 555
SER A 556
ALA A 645
 None
 0.94A 3ou7B-1sqjA:
undetectable		 3ou7B-1sqjA:
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.
1tqy ACTINORHODIN
POLYKETIDE PUTATIVE
BETA-KETOACYL
SYNTHASE 2

(Streptomyces
coelicolor) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 ALA B 232
GLY B 185
GLY B 336
SER B 335
ALA B  82
 None
 1.07A 3ou7B-1tqyB:
undetectable		 3ou7B-1tqyB:
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.
1w1k VANILLYL-ALCOHOL
OXIDASE

(Penicillium
simplicissimum) 		PF01565
(FAD_binding_4)
PF02913
(FAD-oxidase_C) 		5 ALA A 112
GLY A 109
SER A 106
LEU A 507
ALA A  71
 None
None
FAD  A1561 ( 4.5A)
None
None
 1.04A 3ou7B-1w1kA:
undetectable		 3ou7B-1w1kA:
18.48
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.
1xv2 HYPOTHETICAL
PROTEIN, SIMILAR TO
ALPHA-ACETOLACTATE
DECARBOXYLASE

(Staphylococcus
aureus) 		PF03306
(AAL_decarboxy) 		5 LEU A   5
ALA A  74
GLY A   9
ALA A  23
HIS A  31
 None
 1.00A 3ou7B-1xv2A:
undetectable		 3ou7B-1xv2A:
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.
1yy5 FMS1 PROTEIN

(Saccharomyces
cerevisiae) 		PF01593
(Amino_oxidase) 		5 TYR A 450
ALA A 489
GLY A 491
LEU A  74
HIS A  67
 FAD  A 803 (-4.6A)
FAD  A 803 (-3.7A)
None
None
FAD  A 803 (-3.8A)
 1.18A 3ou7B-1yy5A:
2.4		 3ou7B-1yy5A:
16.67
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.
1zbs HYPOTHETICAL PROTEIN
PG1100

(Porphyromonas
gingivalis) 		PF01869
(BcrAD_BadFG) 		5 LEU A 274
ALA A  95
GLY A  67
GLY A 100
ALA A  75
 None
 1.15A 3ou7B-1zbsA:
undetectable		 3ou7B-1zbsA:
21.69
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.
2ak3 ADENYLATE KINASE
ISOENZYME-3

(Bos taurus) 		PF00406
(ADK)
PF05191
(ADK_lid) 		5 LEU A  39
GLY A  89
SER A  35
LEU A  77
ALA A  97
 None
AMP  A 226 (-4.7A)
None
None
None
 1.15A 3ou7B-2ak3A:
undetectable		 3ou7B-2ak3A:
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.
2avn UBIQUINONE/MENAQUINO
NE BIOSYNTHESIS
METHYLTRANSFERASE-RE
LATED PROTEIN

(Thermotoga
maritima) 		PF08241
(Methyltransf_11) 		5 TYR A  16
GLY A  52
TRP A  56
SER A  73
MET A  76
 SAI  A1300 (-4.9A)
SAI  A1300 (-3.5A)
None
SAI  A1300 (-4.7A)
SAI  A1300 ( 4.2A)
 0.46A 3ou7B-2avnA:
19.1		 3ou7B-2avnA:
26.29
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.
2bb0 IMIDAZOLONEPROPIONAS
E

(Bacillus
subtilis) 		PF01979
(Amidohydro_1) 		5 TYR A  59
ALA A  50
GLY A  41
LEU A  15
ALA A 376
 None
 1.15A 3ou7B-2bb0A:
undetectable		 3ou7B-2bb0A:
20.29
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.
2dgk GLUTAMATE
DECARBOXYLASE BETA

(Escherichia
coli) 		PF00282
(Pyridoxal_deC) 		5 ALA A 245
GLY A 248
TRP A 286
GLY A 210
HIS A 241
 PLP  A1500 (-3.4A)
None
None
None
None
 1.05A 3ou7B-2dgkA:
undetectable		 3ou7B-2dgkA:
19.59
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.
2dph FORMALDEHYDE
DISMUTASE

(Pseudomonas
putida) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 TYR A 301
GLY A 299
GLY A  46
SER A  47
ALA A 192
 None
NAD  A1403 ( 3.7A)
NAD  A1403 (-3.2A)
NAD  A1403 (-2.6A)
NAD  A1403 ( 3.6A)
 1.06A 3ou7B-2dphA:
6.2		 3ou7B-2dphA:
20.65
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.
2gs9 HYPOTHETICAL PROTEIN
TT1324

(Thermus
thermophilus) 		PF08241
(Methyltransf_11) 		5 TYR A  11
GLY A  47
TRP A  51
SER A  66
MET A  69
 None
SAH  A 301 (-3.5A)
SAH  A 301 (-4.6A)
SAH  A 301 (-4.5A)
SAH  A 301 (-4.2A)
 0.71A 3ou7B-2gs9A:
15.9		 3ou7B-2gs9A:
24.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2h3g BIOSYNTHETIC PROTEIN

(Bacillus
anthracis) 		PF03309
(Pan_kinase) 		5 LEU X 246
ALA X  12
GLY X   8
SER X  63
LEU X  14
 None
None
EDO  X 501 (-3.6A)
None
None
 1.12A 3ou7B-2h3gX:
undetectable		 3ou7B-2h3gX:
22.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ibn INOSITOL OXYGENASE

(Homo sapiens) 		PF05153
(MIOX) 		5 LEU A  79
ALA A 130
GLY A 133
LEU A  83
ALA A 138
 None
 1.11A 3ou7B-2ibnA:
undetectable		 3ou7B-2ibnA:
22.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2m9p SERINE PROTEASE
SUBUNIT NS2B, SERINE
PROTEASE NS3

(Dengue virus) 		PF00949
(Peptidase_S7)
PF01002
(Flavi_NS2B) 		5 LEU A 210
TYR A 222
GLY A 194
GLY A 197
SER A 196
 None
 1.06A 3ou7B-2m9pA:
undetectable		 3ou7B-2m9pA:
20.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ox4 PUTATIVE MANDELATE
RACEMASE

(Zymomonas
mobilis) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 ALA A  38
GLY A 290
GLY A  92
LEU A  53
ALA A  41
 None
 1.17A 3ou7B-2ox4A:
undetectable		 3ou7B-2ox4A:
19.22
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.
2px0 FLAGELLAR
BIOSYNTHESIS PROTEIN
FLHF

(Bacillus
subtilis) 		PF00448
(SRP54) 		5 LEU A 288
GLY A 187
GLY A 182
SER A 183
ALA A 193
 None
GNP  A   1 ( 3.2A)
None
None
None
 1.10A 3ou7B-2px0A:
undetectable		 3ou7B-2px0A:
22.19
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.
2qo3 ERYAII ERYTHROMYCIN
POLYKETIDE SYNTHASE
MODULES 3 AND 4

(Saccharopolyspora
erythraea) 		PF00109
(ketoacyl-synt)
PF00698
(Acyl_transf_1)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		5 LEU A 206
ALA A 380
GLY A 228
GLY A 383
ALA A 154
 None
 1.12A 3ou7B-2qo3A:
undetectable		 3ou7B-2qo3A:
13.91
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.
2qzp ACYLAMINO-ACID-RELEA
SING ENZYME

(Aeropyrum
pernix) 		PF00326
(Peptidase_S9) 		5 LEU A 455
ALA A 467
GLY A 443
GLY A 465
ALA A 469
 None
 0.87A 3ou7B-2qzpA:
2.6		 3ou7B-2qzpA:
17.64
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.
2r5f TRANSCRIPTIONAL
REGULATOR, PUTATIVE

(Pseudomonas
syringae group
genomosp. 3) 		PF04198
(Sugar-bind) 		5 ALA A 296
GLY A 255
GLY A 300
LEU A 302
ALA A 292
 None
 1.10A 3ou7B-2r5fA:
2.9		 3ou7B-2r5fA:
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.
2r66 GLYCOSYL
TRANSFERASE, GROUP 1

(Halothermothrix
orenii) 		PF00534
(Glycos_transf_1)
PF00862
(Sucrose_synth) 		5 TYR A 352
ALA A 385
GLY A 435
LEU A 397
ALA A 363
 None
 1.09A 3ou7B-2r66A:
2.9		 3ou7B-2r66A:
17.25
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.
2uzz N-METHYL-L-TRYPTOPHA
N OXIDASE

(Escherichia
coli) 		PF01266
(DAO) 		5 ALA A  16
GLY A  18
GLY A  11
SER A  10
MET A  30
 None
None
FAD  A1373 (-3.4A)
None
None
 1.05A 3ou7B-2uzzA:
undetectable		 3ou7B-2uzzA:
21.18
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.
2wvg PYRUVATE
DECARBOXYLASE

(Zymomonas
mobilis) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		5 ALA A  63
GLY A  59
GLY A  65
ALA A 426
HIS A  20
 None
 1.17A 3ou7B-2wvgA:
undetectable		 3ou7B-2wvgA:
16.75
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.
2z01 PHOSPHORIBOSYLFORMYL
GLYCINAMIDINE
CYCLO-LIGASE

(Geobacillus
kaustophilus) 		PF00586
(AIRS)
PF02769
(AIRS_C) 		5 GLY A  96
GLY A 243
LEU A 305
ALA A 229
HIS A 246
 None
 1.06A 3ou7B-2z01A:
undetectable		 3ou7B-2z01A:
22.73
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.
2z2n VIRGINIAMYCIN B
LYASE

(Staphylococcus
aureus) 		no annotation 5 LEU A 196
ALA A 153
GLY A 149
SER A 150
LEU A 154
 None
 1.00A 3ou7B-2z2nA:
undetectable		 3ou7B-2z2nA:
18.64
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.
2z37 CHITINASE

(Brassica juncea) 		PF00182
(Glyco_hydro_19) 		5 ALA A 289
GLY A 261
SER A 266
MET A 264
LEU A 282
 None
 1.07A 3ou7B-2z37A:
undetectable		 3ou7B-2z37A:
21.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zo4 METALLO-BETA-LACTAMA
SE FAMILY PROTEIN

(Thermus
thermophilus) 		PF00753
(Lactamase_B) 		5 ALA A 172
GLY A 174
GLY A  99
ALA A 191
HIS A  75
 None
None
None
None
ZN  A 319 (-3.2A)
 1.16A 3ou7B-2zo4A:
undetectable		 3ou7B-2zo4A:
24.92
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.
3a0g HEMOGLOBIN SUBUNIT
BETA

(Cavia porcellus) 		PF00042
(Globin) 		5 ALA B  27
GLY B  29
GLY B  64
LEU B  68
HIS B 117
 None
 1.10A 3ou7B-3a0gB:
undetectable		 3ou7B-3a0gB:
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.
3br8 PROBABLE
ACYLPHOSPHATASE

(Bacillus
subtilis) 		PF00708
(Acylphosphatase) 		5 ALA A  31
GLY A  48
GLY A  82
MET A   1
ALA A  25
 None
 1.17A 3ou7B-3br8A:
undetectable		 3ou7B-3br8A:
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.
3c02 AQUAGLYCEROPORIN

(Plasmodium
falciparum) 		PF00230
(MIP) 		5 LEU A  69
ALA A  53
GLY A  51
GLY A  57
ALA A  30
 GOL  A 663 (-4.1A)
None
None
None
None
 1.03A 3ou7B-3c02A:
undetectable		 3ou7B-3c02A:
23.47
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.
3c4n UNCHARACTERIZED
PROTEIN DR_0571

(Deinococcus
radiodurans) 		PF01266
(DAO) 		5 ALA A 385
GLY A 383
TRP A  86
MET A  47
ALA A  99
 None
None
None
ADP  A 411 ( 4.9A)
None
 1.17A 3ou7B-3c4nA:
3.2		 3ou7B-3c4nA:
20.65
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.
3czx PUTATIVE
N-ACETYLMURAMOYL-L-A
LANINE AMIDASE

(Neisseria
meningitidis) 		PF01520
(Amidase_3) 		5 LEU A  60
ALA A 136
GLY A 140
LEU A 133
ALA A  91
 None
 1.06A 3ou7B-3czxA:
undetectable		 3ou7B-3czxA:
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.
3dtn PUTATIVE
METHYLTRANSFERASE
MM_2633

(Methanosarcina
mazei) 		PF13649
(Methyltransf_25) 		5 GLY A  52
SER A  75
MET A  78
ALA A 114
HIS A 119
 None
 0.64A 3ou7B-3dtnA:
17.7		 3ou7B-3dtnA:
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.
3dyj TALIN-1

(Mus musculus) 		no annotation 5 LEU A2283
ALA A2244
GLY A2246
GLY A2240
LEU A2216
 None
 1.17A 3ou7B-3dyjA:
undetectable		 3ou7B-3dyjA:
21.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3e23 UNCHARACTERIZED
PROTEIN RPA2492

(Rhodopseudomonas
palustris) 		PF08241
(Methyltransf_11) 		5 LEU A  14
TYR A  24
GLY A  53
GLY A  73
SER A  74
 SAM  A 221 (-4.4A)
SAM  A 221 (-4.7A)
SAM  A 221 (-3.2A)
SAM  A 221 (-3.2A)
SAM  A 221 (-4.6A)
 0.64A 3ou7B-3e23A:
19.1		 3ou7B-3e23A:
27.03
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.
3e23 UNCHARACTERIZED
PROTEIN RPA2492

(Rhodopseudomonas
palustris) 		PF08241
(Methyltransf_11) 		5 TYR A  24
GLY A  53
GLY A  73
SER A  74
ALA A 110
 SAM  A 221 (-4.7A)
SAM  A 221 (-3.2A)
SAM  A 221 (-3.2A)
SAM  A 221 (-4.6A)
SAM  A 221 (-4.3A)
 1.06A 3ou7B-3e23A:
19.1		 3ou7B-3e23A:
27.03
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.
3fpz THIAZOLE
BIOSYNTHETIC ENZYME

(Saccharomyces
cerevisiae) 		PF01946
(Thi4) 		5 GLY A 290
GLY A  74
SER A  75
MET A 309
ALA A 243
 AHZ  A1100 (-3.5A)
AHZ  A1100 (-3.6A)
AHZ  A1100 (-3.6A)
AHZ  A1100 (-3.3A)
None
 1.05A 3ou7B-3fpzA:
2.1		 3ou7B-3fpzA:
23.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hbx GLUTAMATE
DECARBOXYLASE 1

(Arabidopsis
thaliana) 		PF00282
(Pyridoxal_deC) 		5 ALA A 246
GLY A 249
TRP A 287
GLY A 211
HIS A 242
 LLP  A 277 ( 3.3A)
None
None
None
None
 1.07A 3ou7B-3hbxA:
undetectable		 3ou7B-3hbxA:
17.86
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.
3m49 TRANSKETOLASE

(Bacillus
anthracis) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		5 ALA A 423
GLY A 421
GLY A 426
MET A 128
ALA A 449
 None
 1.06A 3ou7B-3m49A:
2.1		 3ou7B-3m49A:
15.50
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.
3mi9 CELL DIVISION
PROTEIN KINASE 9

(Homo sapiens) 		PF00069
(Pkinase) 		5 LEU A 165
TYR A 194
GLY A 214
LEU A 134
ALA A 220
 None
 1.07A 3ou7B-3mi9A:
undetectable		 3ou7B-3mi9A:
20.12
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.
3now UNC-45 PROTEIN,
SD10334P

(Drosophila
melanogaster) 		PF11701
(UNC45-central) 		5 LEU A 472
GLY A 495
GLY A 490
LEU A 488
ALA A 511
 None
 0.85A 3ou7B-3nowA:
undetectable		 3ou7B-3nowA:
14.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3now UNC-45 PROTEIN,
SD10334P

(Drosophila
melanogaster) 		PF11701
(UNC45-central) 		5 LEU A 472
GLY A 495
GLY A 490
LEU A 488
ALA A 512
 None
 1.13A 3ou7B-3nowA:
undetectable		 3ou7B-3nowA:
14.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3obz PHYTANOYL-COA
DIOXYGENASE
DOMAIN-CONTAINING
PROTEIN 1

(Homo sapiens) 		PF05721
(PhyH) 		5 LEU A 278
GLY A 104
GLY A  74
SER A  73
HIS A 263
 None
None
None
None
AKG  A 481 ( 4.8A)
 1.14A 3ou7B-3obzA:
undetectable		 3ou7B-3obzA:
21.36
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ou6 SAM-DEPENDENT
METHYLTRANSFERASE

(Streptomyces
luridus) 		PF13649
(Methyltransf_25) 		12 LEU A  12
TYR A  22
ALA A  54
GLY A  56
TRP A  60
GLY A  76
SER A  77
MET A  80
LEU A  99
ALA A 114
TRP A 116
HIS A 119
 SAM  A 300 ( 3.9A)
SAM  A 300 (-4.4A)
SAM  A 300 (-3.4A)
SAM  A 300 (-3.1A)
None
SAM  A 300 (-3.3A)
SAM  A 300 (-4.5A)
SAM  A 300 (-4.0A)
SAM  A 300 (-3.9A)
SAM  A 300 (-3.6A)
None
SO4  A 301 (-4.0A)
 0.16A 3ou7B-3ou6A:
38.6		 3ou7B-3ou6A:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3px2 N-METHYLTRANSFERASE

(Streptomyces
fradiae) 		PF13649
(Methyltransf_25) 		5 TYR A  22
ALA A  58
GLY A  60
SER A  81
MET A  84
 SAH  A 263 (-4.6A)
SAH  A 263 (-3.5A)
SAH  A 263 (-3.3A)
SAH  A 263 (-4.7A)
SAH  A 263 (-4.5A)
 0.43A 3ou7B-3px2A:
17.3		 3ou7B-3px2A:
28.46
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.
3q98 TRANSCARBAMYLASE

(Escherichia
coli) 		PF00185
(OTCace)
PF02729
(OTCace_N) 		5 LEU A 159
ALA A 118
GLY A  63
GLY A 120
SER A  65
 None
 1.10A 3ou7B-3q98A:
undetectable		 3ou7B-3q98A:
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.
3qvq PHOSPHODIESTERASE
OLEI02445

(Oleispira
antarctica) 		PF03009
(GDPD) 		5 LEU A 155
GLY A 168
SER A 148
LEU A 182
ALA A 173
 None
None
G3P  A 301 ( 4.4A)
None
None
 1.10A 3ou7B-3qvqA:
undetectable		 3ou7B-3qvqA:
22.14
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.
3uog ALCOHOL
DEHYDROGENASE

(Sinorhizobium
meliloti) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 LEU A 306
GLY A 182
LEU A 299
ALA A 157
TRP A 155
 None
 1.09A 3ou7B-3uogA:
4.8		 3ou7B-3uogA:
22.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3v4y SERINE/THREONINE-PRO
TEIN PHOSPHATASE
PP1-ALPHA CATALYTIC
SUBUNIT

(Homo sapiens) 		PF00149
(Metallophos)
PF16891
(STPPase_N) 		5 LEU A  75
TYR A 255
ALA A 279
GLY A 254
SER A 268
 None
 1.13A 3ou7B-3v4yA:
undetectable		 3ou7B-3v4yA:
22.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3w15 PEROXISOMAL
TARGETING SIGNAL 2
RECEPTOR

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		5 LEU A 216
ALA A 223
GLY A 240
GLY A 220
SER A 219
 NO3  A 401 (-4.4A)
None
None
None
None
 0.99A 3ou7B-3w15A:
undetectable		 3ou7B-3w15A:
21.56
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.
4d65 PORIN 2

(Providencia
stuartii) 		PF00267
(Porin_1) 		5 GLY A 191
GLY A 175
SER A 193
LEU A 149
ALA A 179
 LDA  A1370 ( 4.6A)
LDA  A1383 ( 4.2A)
None
LDA  A1365 ( 4.3A)
None
 1.06A 3ou7B-4d65A:
undetectable		 3ou7B-4d65A:
18.62
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.
4emi TODA

(Pseudomonas
putida) 		PF07992
(Pyr_redox_2)
PF14759
(Reductase_C) 		5 LEU A 394
ALA A 350
GLY A 349
GLY A 344
LEU A 352
 None
 1.13A 3ou7B-4emiA:
2.5		 3ou7B-4emiA:
21.18
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.
4jlw GLUTATHIONE-INDEPEND
ENT FORMALDEHYDE
DEHYDROGENASE

(Pseudomonas
aeruginosa) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 TYR A 303
GLY A 301
GLY A  48
SER A  49
ALA A 193
 None
NAD  A 403 ( 3.7A)
NAD  A 403 (-3.0A)
NAD  A 403 ( 3.0A)
NAD  A 403 ( 4.1A)
 1.13A 3ou7B-4jlwA:
6.2		 3ou7B-4jlwA:
19.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4kry ACETYL ESTERASE

(Escherichia
coli) 		PF07859
(Abhydrolase_3) 		5 LEU A 209
ALA A 259
GLY A 258
TRP A 194
HIS A 292
 None
None
None
None
SEB  A 165 ( 4.1A)
 1.15A 3ou7B-4kryA:
3.4		 3ou7B-4kryA:
22.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4myw ENVELOPE
GLYCOPROTEIN D

(Human
alphaherpesvirus
2) 		PF01537
(Herpes_glycop_D) 		5 ALA A 155
SER A 142
LEU A 236
ALA A  65
TRP A 241
 None
 1.03A 3ou7B-4mywA:
undetectable		 3ou7B-4mywA:
19.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4q05 ESTERASE E25

(uncultured
bacterium) 		PF07859
(Abhydrolase_3) 		5 GLY A 183
GLY A 213
SER A 185
LEU A 276
ALA A 209
 None
 1.16A 3ou7B-4q05A:
2.9		 3ou7B-4q05A:
20.55
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.
4q9d BENZOYLFORMATE
DECARBOXYLASE

(Mycolicibacterium
smegmatis) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		5 ALA A  81
GLY A  83
TRP A 407
LEU A  72
ALA A  55
 None
 1.07A 3ou7B-4q9dA:
undetectable		 3ou7B-4q9dA:
17.71
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.
4q9d BENZOYLFORMATE
DECARBOXYLASE

(Mycolicibacterium
smegmatis) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		5 GLY A  83
TRP A 407
GLY A  79
LEU A  72
ALA A  55
 None
 0.83A 3ou7B-4q9dA:
undetectable		 3ou7B-4q9dA:
17.71
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.
4qi7 CELLOBIOSE
DEHYDROGENASE

(Neurospora
crassa) 		PF00732
(GMC_oxred_N)
PF00734
(CBM_1)
PF05199
(GMC_oxred_C)
PF16010
(CDH-cyt) 		5 LEU A 419
ALA A 239
GLY A 241
GLY A 315
ALA A 755
 None
FAD  A 902 (-3.3A)
None
None
None
 1.07A 3ou7B-4qi7A:
2.4		 3ou7B-4qi7A:
14.42
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.
4qme AMINOPEPTIDASE N

(Neisseria
meningitidis) 		PF01433
(Peptidase_M1)
PF11940
(DUF3458)
PF17432
(DUF3458_C) 		5 LEU A 833
ALA A 796
GLY A 801
LEU A 630
HIS A 836
 None
 1.12A 3ou7B-4qmeA:
undetectable		 3ou7B-4qmeA:
13.02
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.
4qmk TYPE III SECRETION
SYSTEM EFFECTOR
PROTEIN EXOU

(Pseudomonas
fluorescens) 		PF01734
(Patatin) 		5 ALA A  95
GLY A  90
GLY A  61
SER A  60
ALA A 261
 None
 1.12A 3ou7B-4qmkA:
undetectable		 3ou7B-4qmkA:
16.33
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.
4rvw ZNUD

(Neisseria
meningitidis) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		5 LEU A 640
GLY A  55
GLY A 599
SER A 598
ALA A  61
 None
 1.15A 3ou7B-4rvwA:
undetectable		 3ou7B-4rvwA:
15.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4um8 INTEGRIN ALPHA-V
INTEGRIN BETA-6

(Homo sapiens;
Homo sapiens) 		PF01839
(FG-GAP)
PF08441
(Integrin_alpha2)
PF00362
(Integrin_beta)
PF17205
(PSI_integrin) 		6 GLY A 157
GLY A 175
SER A 176
LEU B 265
ALA A 109
HIS A 113
 None
 1.45A 3ou7B-4um8A:
undetectable		 3ou7B-4um8A:
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.
4xdt FAD:PROTEIN FMN
TRANSFERASE

(Treponema
pallidum) 		PF02424
(ApbE) 		5 LEU A  45
ALA A 164
GLY A 166
LEU A  52
ALA A 162
 None
FAD  A 401 (-2.6A)
None
FAD  A 401 ( 3.9A)
FAD  A 401 ( 3.2A)
 1.12A 3ou7B-4xdtA:
undetectable		 3ou7B-4xdtA:
23.65
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.
4yqy PUTATIVE
DEHYDROGENASE

(Sulfitobacter
sp. NAS-14.1) 		PF13561
(adh_short_C2) 		5 ALA A 143
GLY A 156
GLY A 149
ALA A 140
HIS A 192
 None
 1.15A 3ou7B-4yqyA:
5.7		 3ou7B-4yqyA:
24.39
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.
4yu4 HEMOGLOBIN

(Helogale
parvula) 		PF00042
(Globin) 		5 GLY A  22
GLY A  18
SER A  19
ALA A  28
HIS A 112
 None
 1.15A 3ou7B-4yu4A:
undetectable		 3ou7B-4yu4A:
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.
4z26 PUTATIVE GMC-TYPE
OXIDOREDUCTASE R135

(Acanthamoeba
polyphaga
mimivirus) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		5 GLY A 100
GLY A 233
LEU A 237
ALA A  38
HIS A  40
 FAD  A 901 (-3.3A)
None
None
FAD  A 901 (-3.6A)
None
 1.14A 3ou7B-4z26A:
undetectable		 3ou7B-4z26A:
14.74
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.
4z3n PUTATIVE DRUG/SODIUM
ANTIPORTER

(Escherichia
coli) 		PF01554
(MatE) 		5 LEU A 314
GLY A 260
GLY A  93
SER A  94
ALA A  83
 None
None
None
None
OLC  A 507 ( 3.9A)
 1.14A 3ou7B-4z3nA:
undetectable		 3ou7B-4z3nA:
20.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zpi PUTATIVE
OXIDASE/HYDROXYLASE

(Streptomyces
hygroscopicus) 		PF05721
(PhyH) 		5 LEU A  36
ALA A 221
GLY A  88
GLY A  90
LEU A 219
 None
 1.18A 3ou7B-4zpiA:
undetectable		 3ou7B-4zpiA:
24.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5bp8 ENT-COPALYL
DIPHOSPHATE SYNTHASE

(Streptomyces
platensis) 		PF00432
(Prenyltrans)
PF13243
(SQHop_cyclase_C) 		5 LEU A 101
GLY A  51
GLY A  57
LEU A  59
ALA A  46
 None
SO4  A 704 (-3.3A)
None
None
None
 1.03A 3ou7B-5bp8A:
undetectable		 3ou7B-5bp8A:
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.
5dm3 L-GLUTAMINE
SYNTHETASE

(Chromohalobacter
salexigens) 		PF00120
(Gln-synt_C) 		5 ALA A 239
TRP A  96
SER A 152
LEU A 148
ALA A 234
 None
 1.04A 3ou7B-5dm3A:
undetectable		 3ou7B-5dm3A:
18.71
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.
5eyt ADENYLOSUCCINATE
LYASE

(Schistosoma
mansoni) 		PF00206
(Lyase_1)
PF10397
(ADSL_C) 		5 LEU A 206
ALA A 193
GLY A 195
GLY A 103
LEU A  40
 None
 1.06A 3ou7B-5eytA:
undetectable		 3ou7B-5eytA:
20.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5g0q BETA-GLUCURONIDASE

(Acidobacterium
capsulatum) 		PF03662
(Glyco_hydro_79n) 		5 LEU A 307
ALA A 394
GLY A 469
LEU A 356
ALA A 383
 None
 0.91A 3ou7B-5g0qA:
undetectable		 3ou7B-5g0qA:
19.25
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.
5g5z ABC TRANSPORTER,
SUBSTRATE-BINDING
PROTEIN

(Streptococcus
pneumoniae) 		PF01547
(SBP_bac_1) 		5 LEU A 449
GLY A 348
GLY A 170
SER A 175
ALA A 429
 None
 1.03A 3ou7B-5g5zA:
undetectable		 3ou7B-5g5zA:
18.25
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.
5gp4 GLUTAMATE
DECARBOXYLASE

(Lactobacillus
brevis) 		no annotation 5 ALA C 248
GLY C 251
TRP C 289
GLY C 213
HIS C 244
 PLP  C 501 (-3.1A)
None
None
None
None
 1.07A 3ou7B-5gp4C:
undetectable		 3ou7B-5gp4C:
18.61
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.
5h02 GLYCINE SARCOSINE
N-METHYLTRANSFERASE

(Methanohalophilus
portucalensis) 		PF13649
(Methyltransf_25) 		5 ALA A  67
GLY A  69
GLY A  89
SER A  90
MET A  93
 SAH  A 301 (-3.9A)
SAH  A 301 (-3.3A)
SAH  A 301 (-3.4A)
SAH  A 301 ( 4.9A)
SAH  A 301 (-3.9A)
 0.48A 3ou7B-5h02A:
17.4		 3ou7B-5h02A:
24.57
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.
5hxs SODIUM,CALCIUM
EXCHANGER

(Methanocaldococcus
jannaschii) 		PF01699
(Na_Ca_ex) 		5 LEU A 254
ALA A 244
GLY A 248
SER A 249
ALA A 239
 None
 1.13A 3ou7B-5hxsA:
undetectable		 3ou7B-5hxsA:
22.61
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.
5je3 METHYL TRANSFERASE

(Burkholderia
glumae) 		PF13847
(Methyltransf_31) 		5 ALA A  47
GLY A  49
SER A  71
MET A  74
ALA A 111
 SAH  A 301 (-3.2A)
SAH  A 301 (-3.6A)
SAH  A 301 ( 4.8A)
SAH  A 301 ( 4.5A)
SAH  A 301 (-3.8A)
 0.43A 3ou7B-5je3A:
16.0		 3ou7B-5je3A:
23.94
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.
5lp7 ACETYL-COA
ACETYLTRANSFERASE

(Bacillus
subtilis) 		no annotation 5 ALA H 356
GLY H 113
GLY H 352
MET H  53
ALA H   9
 None
 1.13A 3ou7B-5lp7H:
undetectable		 3ou7B-5lp7H:
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.
5m95 DIVALENT METAL
CATION TRANSPORTER
MNTH

(Staphylococcus
capitis) 		PF01566
(Nramp) 		5 LEU A 323
ALA A 126
GLY A 130
SER A 131
LEU A 385
 None
 1.11A 3ou7B-5m95A:
undetectable		 3ou7B-5m95A:
19.20
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.
5n8o DNA HELICASE I

(Escherichia
coli) 		PF07057
(TraI)
PF08751
(TrwC)
PF13604
(AAA_30) 		5 ALA A 800
GLY A 804
GLY A 538
SER A 537
ALA A 796
 None
 1.00A 3ou7B-5n8oA:
2.8		 3ou7B-5n8oA:
8.26
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.
5nxn PORIN 1

(Providencia
stuartii) 		no annotation 5 GLY A 193
GLY A 177
SER A 195
LEU A 152
ALA A 181
 None
 1.02A 3ou7B-5nxnA:
undetectable		 3ou7B-5nxnA:
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.
5onu OUTER MEMBRANE
PROTEIN OMPU

(Vibrio cholerae) 		no annotation 5 LEU A 138
ALA A 219
GLY A 231
GLY A 233
LEU A 217
 None
 1.16A 3ou7B-5onuA:
undetectable		 3ou7B-5onuA:
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.
5u7x NOD FACTOR BINDING
LECTIN-NUCLEOTIDE
PHOSPHOHYDROLASE

(Vigna
unguiculata) 		PF01150
(GDA1_CD39) 		5 LEU F  94
ALA F  87
GLY F  14
SER F  49
LEU F 103
 None
None
PO4  F 502 (-3.4A)
None
None
 0.98A 3ou7B-5u7xF:
undetectable		 3ou7B-5u7xF:
19.18
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.
5um2 ABC TRANSPORTER
SULFATE BINDING
PROTEIN

(Xanthomonas
citri) 		PF13531
(SBP_bac_11) 		5 ALA A 225
GLY A 184
GLY A  95
SER A  96
ALA A 243
 SO4  A 401 (-3.4A)
SO4  A 401 (-3.3A)
SO4  A 401 (-3.6A)
SO4  A 401 (-4.4A)
None
 0.90A 3ou7B-5um2A:
undetectable		 3ou7B-5um2A:
22.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5yp3 DIPEPTIDYL
AMINOPEPTIDASE 4

(Pseudoxanthomonas
mexicana) 		no annotation 5 ALA A 635
GLY A 611
GLY A 633
LEU A 681
ALA A 637
 None
 1.10A 3ou7B-5yp3A:
undetectable		 3ou7B-5yp3A:
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.
6az0 MITOCHONDRIAL INNER
MEMBRANE I-AAA
PROTEASE
SUPERCOMPLEX SUBUNIT
YME1

(Saccharomyces
cerevisiae) 		no annotation 5 LEU A 678
TYR A 606
GLY A 543
LEU A 688
HIS A 686
 None
 1.02A 3ou7B-6az0A:
undetectable		 3ou7B-6az0A:
18.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6bq1 PHOSPHATIDYLINOSITOL
4-KINASE III ALPHA
(PI4KA)

(Homo sapiens) 		no annotation 5 LEU A1177
ALA A1230
GLY A1226
GLY A1217
MET A1221
 None
 1.13A 3ou7B-6bq1A:
undetectable		 3ou7B-6bq1A:
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.
6c2h CYSTATHIONINE
BETA-SYNTHASE

(Saccharomyces
cerevisiae) 		no annotation 5 ALA A  90
GLY A  93
GLY A 120
LEU A 116
ALA A  57
 None
None
NA  A 404 (-4.0A)
None
None
 1.16A 3ou7B-6c2hA:
2.3		 3ou7B-6c2hA:
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.
6f5z 24-STEROL
C-METHYLTRANSFERASE

(Haloferax
volcanii) 		no annotation 5 GLY A  48
TRP A 108
GLY A  70
SER A  71
MET A  74
 SAH  A 301 ( 3.7A)
None
SAH  A 301 (-3.6A)
None
SAH  A 301 (-4.0A)
 1.16A 3ou7B-6f5zA:
17.9		 3ou7B-6f5zA:
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.
6gu8 -

(-) 		no annotation 5 ALA A 262
GLY A 255
SER A 278
LEU A 133
ALA A 227
 None
EDO  A 505 ( 4.9A)
None
None
None
 1.08A 3ou7B-6gu8A:
undetectable		 3ou7B-6gu8A:
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.
1a6t IGG1 FAB1-IA FAB
(HEAVY CHAIN)

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 TYR B  27
ASP B 101
ASP B  97
 None
 0.72A 3ou7B-1a6tB:
undetectable		 3ou7B-1a6tB:
22.08
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.
1ffv CUTL, MOLYBDOPROTEIN
OF CARBON MONOXIDE
DEHYDROGENASE

(Hydrogenophaga
pseudoflava) 		PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2) 		3 TYR B 557
ASP B 501
ASP B 645
 None
 0.78A 3ou7B-1ffvB:
undetectable		 3ou7B-1ffvB:
15.04
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.
1gnx BETA-GLUCOSIDASE

(Streptomyces
sp.) 		PF00232
(Glyco_hydro_1) 		3 TYR A  70
ASP A  68
ASP A  64
 None
 0.93A 3ou7B-1gnxA:
undetectable		 3ou7B-1gnxA:
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.
1jzn GALACTOSE-SPECIFIC
LECTIN

(Crotalus atrox) 		PF00059
(Lectin_C) 		3 TYR A 100
ASP A 120
ASP A  93
 GAL  A 137 ( 4.1A)
CA  A1138 ( 3.0A)
None
 0.87A 3ou7B-1jznA:
undetectable		 3ou7B-1jznA:
19.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ks8 ENDO-B-1,4-GLUCANASE

(Nasutitermes
takasagoensis) 		PF00759
(Glyco_hydro_9) 		3 TYR A 140
ASP A  43
ASP A 143
 None
 0.89A 3ou7B-1ks8A:
undetectable		 3ou7B-1ks8A:
21.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1n60 CARBON MONOXIDE
DEHYDROGENASE LARGE
CHAIN

(Oligotropha
carboxidovorans) 		PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2) 		3 TYR B 563
ASP B 507
ASP B 651
 None
 0.75A 3ou7B-1n60B:
undetectable		 3ou7B-1n60B:
14.00
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.
1pz3 ALPHA-L-ARABINOFURAN
OSIDASE

(Geobacillus
stearothermophilus) 		PF06964
(Alpha-L-AF_C) 		3 TYR A  40
ASP A  48
ASP A  55
 None
 0.96A 3ou7B-1pz3A:
undetectable		 3ou7B-1pz3A:
17.46
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.
1sy6 OKT3 FAB HEAVY CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 TYR H  27
ASP H 107
ASP H 102
 None
 0.73A 3ou7B-1sy6H:
undetectable		 3ou7B-1sy6H:
24.31
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.
1t5j HYPOTHETICAL PROTEIN
MJ1187

(Methanocaldococcus
jannaschii) 		PF03747
(ADP_ribosyl_GH) 		3 TYR A 189
ASP A 192
ASP A 194
 None
 0.98A 3ou7B-1t5jA:
undetectable		 3ou7B-1t5jA:
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.
1v02 DHURRINASE

(Sorghum bicolor) 		PF00232
(Glyco_hydro_1) 		3 TYR A  78
ASP A  76
ASP A  72
 None
 0.94A 3ou7B-1v02A:
undetectable		 3ou7B-1v02A:
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.
1v5f PYRUVATE OXIDASE

(Aerococcus
viridans) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		3 TYR A 472
ASP A 442
ASP A 388
 TPP  A1602 ( 4.3A)
MG  A1603 ( 2.8A)
None
 0.99A 3ou7B-1v5fA:
undetectable		 3ou7B-1v5fA:
16.78
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.
1wcg THIOGLUCOSIDASE

(Brevicoryne
brassicae) 		PF00232
(Glyco_hydro_1) 		3 TYR A  58
ASP A  56
ASP A  52
 None
 0.93A 3ou7B-1wcgA:
undetectable		 3ou7B-1wcgA:
16.67
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.
1wzn SAM-DEPENDENT
METHYLTRANSFERASE

(Pyrococcus
horikoshii) 		PF13649
(Methyltransf_25) 		3 TYR A   5
ASP A  70
ASP A  96
 SAH  A1001 (-3.5A)
SAH  A1001 (-2.7A)
SAH  A1001 (-3.3A)
 0.64A 3ou7B-1wznA:
19.1		 3ou7B-1wznA:
28.69
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.
2amg 1,4-ALPHA-D-GLUCAN
MALTOTETRAHYDROLASE

(Pseudomonas
stutzeri) 		PF00128
(Alpha-amylase)
PF09081
(DUF1921) 		3 TYR A 297
ASP A 291
ASP A 294
 None
 0.92A 3ou7B-2amgA:
undetectable		 3ou7B-2amgA:
20.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2bg9 ACETYLCHOLINE
RECEPTOR PROTEIN,
DELTA CHAIN

(Torpedo
marmorata) 		PF02931
(Neur_chan_LBD)
PF02932
(Neur_chan_memb) 		3 TYR C 202
ASP C 214
ASP C 161
 None
 0.71A 3ou7B-2bg9C:
undetectable		 3ou7B-2bg9C:
19.53
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.
2bgh VINORINE SYNTHASE

(Rauvolfia
serpentina) 		PF02458
(Transferase) 		3 TYR A  75
ASP A  91
ASP A  88
 None
 0.95A 3ou7B-2bghA:
undetectable		 3ou7B-2bghA:
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.
2ckb ALPHA, BETA T CELL
RECEPTOR

(Mus musculus) 		PF07686
(V-set)
PF09291
(DUF1968) 		3 TYR A 117
ASP A 147
ASP A 145
 None
 0.87A 3ou7B-2ckbA:
undetectable		 3ou7B-2ckbA:
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.
2e3z BETA-GLUCOSIDASE

(Phanerochaete
chrysosporium) 		PF00232
(Glyco_hydro_1) 		3 TYR A  58
ASP A  56
ASP A  52
 None
 0.91A 3ou7B-2e3zA:
undetectable		 3ou7B-2e3zA:
19.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2gas ISOFLAVONE REDUCTASE

(Medicago sativa) 		PF05368
(NmrA) 		3 TYR A 160
ASP A 127
ASP A 291
 None
 0.85A 3ou7B-2gasA:
4.6		 3ou7B-2gasA:
22.48
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.
2gtt NUCLEOPROTEIN

(Rabies
lyssavirus) 		PF00945
(Rhabdo_ncap) 		3 TYR A  73
ASP A  69
ASP A  48
 None
 0.76A 3ou7B-2gttA:
undetectable		 3ou7B-2gttA:
20.48
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.
2ke5 RAS-RELATED PROTEIN
RAL-B

(Homo sapiens) 		PF00071
(Ras) 		3 TYR A  43
ASP A  68
ASP A  49
 None
 0.94A 3ou7B-2ke5A:
undetectable		 3ou7B-2ke5A:
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.
2p18 GLYOXALASE II

(Leishmania
infantum) 		PF00753
(Lactamase_B)
PF16123
(HAGH_C) 		3 TYR A 190
ASP A 201
ASP A 197
 None
 0.98A 3ou7B-2p18A:
undetectable		 3ou7B-2p18A:
22.29
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.
2rhp THROMBOSPONDIN-2

(Homo sapiens) 		PF02412
(TSP_3)
PF05735
(TSP_C)
PF07645
(EGF_CA)
PF12947
(EGF_3) 		3 TYR A 878
ASP A 874
ASP A 866
 None
CA  A   9 ( 2.3A)
NAG  A   4 (-3.7A)
 1.00A 3ou7B-2rhpA:
undetectable		 3ou7B-2rhpA:
15.48
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.
2wok CLAVULANIC ACID
BIOSYNTHESIS
OLIGOPEPTIDE BINDING
PROTEIN 2

(Streptomyces
clavuligerus) 		PF00496
(SBP_bac_5) 		3 TYR A  52
ASP A  44
ASP A  47
 None
 0.90A 3ou7B-2wokA:
undetectable		 3ou7B-2wokA:
18.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wpt COLICIN-E2 IMMUNITY
PROTEIN

(Escherichia
coli) 		PF01320
(Colicin_Pyocin) 		3 TYR A  55
ASP A  62
ASP A  58
 None
 0.99A 3ou7B-2wptA:
undetectable		 3ou7B-2wptA:
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.
2x8k HYPOTHETICAL PROTEIN
19.1

(Bacillus phage
SPP1) 		PF05709
(Sipho_tail) 		3 TYR A 130
ASP A  93
ASP A  91
 None
 0.59A 3ou7B-2x8kA:
undetectable		 3ou7B-2x8kA:
22.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xy9 ANGIOTENSIN-CONVERTI
NG ENZYME

(Homo sapiens) 		PF01401
(Peptidase_M2) 		3 TYR A 523
ASP A 415
ASP A 453
 3ES  A1635 (-3.4A)
3ES  A1635 ( 3.9A)
None
 0.87A 3ou7B-2xy9A:
undetectable		 3ou7B-2xy9A:
17.06
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.
2y2w ARABINOFURANOSIDASE

(Bifidobacterium
longum) 		PF06964
(Alpha-L-AF_C) 		3 TYR A  80
ASP A  88
ASP A  95
 None
 0.90A 3ou7B-2y2wA:
undetectable		 3ou7B-2y2wA:
18.45
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.
3ayx MEMBRANE-BOUND
HYDROGENASE LARGE
SUBUNIT

(Hydrogenovibrio
marinus) 		PF00374
(NiFeSe_Hases) 		3 TYR A 308
ASP A 483
ASP A 478
 None
 0.98A 3ou7B-3ayxA:
undetectable		 3ou7B-3ayxA:
15.47
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.
3cih PUTATIVE
ALPHA-RHAMNOSIDASE

(Bacteroides
thetaiotaomicron) 		PF17389
(Bac_rhamnosid6H)
PF17390
(Bac_rhamnosid_C) 		3 TYR A 136
ASP A  26
ASP A  53
 None
 0.79A 3ou7B-3cihA:
undetectable		 3ou7B-3cihA:
15.41
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.
3ctp PERIPLASMIC BINDING
PROTEIN/LACI
TRANSCRIPTIONAL
REGULATOR

(Alkaliphilus
metalliredigens) 		PF13377
(Peripla_BP_3) 		3 TYR A 157
ASP A 155
ASP A 310
 None
 0.86A 3ou7B-3ctpA:
2.3		 3ou7B-3ctpA:
21.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dh9 THIOREDOXIN
REDUCTASE 1

(Drosophila
melanogaster) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		3 TYR A 329
ASP A 306
ASP A 326
 None
None
FAD  A 500 (-3.1A)
 1.00A 3ou7B-3dh9A:
undetectable		 3ou7B-3dh9A:
19.13
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.
3duu IG-LIKE PROTEIN

(Mus musculus) 		PF07686
(V-set) 		3 TYR B  97
ASP B 100
ASP B 101
 PG4  B 115 ( 4.5A)
KDO  B 114 (-4.1A)
None
 0.89A 3ou7B-3duuB:
undetectable		 3ou7B-3duuB:
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.
3ecq ENDO-ALPHA-N-ACETYLG
ALACTOSAMINIDASE

(Streptococcus
pneumoniae) 		PF12905
(Glyco_hydro_101)
PF17451
(Glyco_hyd_101C) 		3 TYR A1060
ASP A 631
ASP A1091
 None
 0.94A 3ou7B-3ecqA:
undetectable		 3ou7B-3ecqA:
9.17
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.
3fai BETA-LACTAMASE

(Aeromonas
hydrophila) 		PF00753
(Lactamase_B) 		3 TYR A 191
ASP A 179
ASP A 177
 None
GOL  A 319 ( 3.8A)
SO4  A 315 (-4.3A)
 0.96A 3ou7B-3faiA:
undetectable		 3ou7B-3faiA:
26.44
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.
3g5a FMN
ADENYLYLTRANSFERASE

([Candida]
glabrata) 		PF01507
(PAPS_reduct) 		3 TYR A 188
ASP A 186
ASP A 181
 None
None
FMN  A 306 (-3.5A)
 0.77A 3ou7B-3g5aA:
1.8		 3ou7B-3g5aA:
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.
3gbh NAD(P)H-FLAVIN
OXIDOREDUCTASE

(Staphylococcus
epidermidis) 		PF00881
(Nitroreductase) 		3 TYR A  94
ASP A  90
ASP A 141
 None
 0.91A 3ou7B-3gbhA:
undetectable		 3ou7B-3gbhA:
22.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jsa HOMOSERINE
DEHYDROGENASE

(Thermoplasma
volcanium) 		PF00742
(Homoserine_dh)
PF03447
(NAD_binding_3) 		3 TYR A 142
ASP A 319
ASP A 113
 None
 0.87A 3ou7B-3jsaA:
undetectable		 3ou7B-3jsaA:
22.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jtw DIHYDROFOLATE
REDUCTASE

(Pediococcus
pentosaceus) 		PF01872
(RibD_C) 		3 TYR A  71
ASP A  73
ASP A  48
 None
 0.79A 3ou7B-3jtwA:
undetectable		 3ou7B-3jtwA:
21.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kci PROBABLE E3
UBIQUITIN-PROTEIN
LIGASE HERC2

(Homo sapiens) 		PF00415
(RCC1) 		3 TYR A4174
ASP A4171
ASP A4183
 None
 0.75A 3ou7B-3kciA:
undetectable		 3ou7B-3kciA:
19.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kzv UNCHARACTERIZED
OXIDOREDUCTASE
YIR035C

(Saccharomyces
cerevisiae) 		PF00106
(adh_short) 		3 TYR A 244
ASP A 138
ASP A 182
 None
 0.71A 3ou7B-3kzvA:
5.7		 3ou7B-3kzvA:
23.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3l19 CALCIUM/CALMODULIN
DEPENDENT PROTEIN
KINASE WITH A KINASE
DOMAIN AND 4
CALMODULIN LIKE EF
HANDS

(Cryptosporidium
parvum) 		PF13499
(EF-hand_7) 		3 TYR A 429
ASP A 423
ASP A 416
 None
CA  A   1 (-3.0A)
None
 0.77A 3ou7B-3l19A:
undetectable		 3ou7B-3l19A:
23.46
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.
3l2n PEPTIDASE M14,
CARBOXYPEPTIDASE A

(Shewanella
denitrificans) 		PF00246
(Peptidase_M14) 		3 TYR A 358
ASP A 299
ASP A 346
 None
 0.98A 3ou7B-3l2nA:
undetectable		 3ou7B-3l2nA:
20.55
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.
3l91 ACYL-HOMOSERINE
LACTONE ACYLASE PVDQ
SUBUNIT BETA

(Pseudomonas
aeruginosa) 		PF01804
(Penicil_amidase) 		3 TYR B 516
ASP B 545
ASP B 614
 None
 0.89A 3ou7B-3l91B:
undetectable		 3ou7B-3l91B:
17.06
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.
3lij CALCIUM/CALMODULIN
DEPENDENT PROTEIN
KINASE WITH A KINASE
DOMAIN AND 4
CALMODULIN LIKE EF
HANDS

(Cryptosporidium
parvum) 		PF00069
(Pkinase)
PF13499
(EF-hand_7) 		3 TYR A 429
ASP A 423
ASP A 416
 None
CA  A 518 (-3.1A)
None
 0.77A 3ou7B-3lijA:
undetectable		 3ou7B-3lijA:
16.57
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.
3o6n APL1

(Anopheles
gambiae) 		PF00560
(LRR_1)
PF13855
(LRR_8) 		3 TYR A 220
ASP A 199
ASP A 167
 None
 0.80A 3ou7B-3o6nA:
undetectable		 3ou7B-3o6nA:
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.
3odp PUTATIVE
TAGATOSE-6-PHOSPHATE
KETOSE/ALDOSE
ISOMERASE

(Clostridium
novyi) 		PF01380
(SIS) 		3 TYR A  18
ASP A 371
ASP A 171
 None
 0.94A 3ou7B-3odpA:
undetectable		 3ou7B-3odpA:
18.64
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ou6 SAM-DEPENDENT
METHYLTRANSFERASE

(Streptomyces
luridus) 		PF13649
(Methyltransf_25) 		3 TYR A  15
ASP A  75
ASP A  98
 SAM  A 300 ( 3.5A)
SAM  A 300 (-2.8A)
SAM  A 300 (-4.0A)
 0.06A 3ou7B-3ou6A:
38.6		 3ou7B-3ou6A:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ppc 5-METHYLTETRAHYDROPT
EROYLTRIGLUTAMATE--H
OMOCYSTEINE
METHYLTRANSFERASE

(Candida
albicans) 		PF01717
(Meth_synt_2)
PF08267
(Meth_synt_1) 		3 TYR A  65
ASP A  71
ASP A  62
 None
 0.63A 3ou7B-3ppcA:
undetectable		 3ou7B-3ppcA:
15.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ptk BETA-GLUCOSIDASE
OS4BGLU12

(Oryza sativa) 		PF00232
(Glyco_hydro_1) 		3 TYR A  68
ASP A  66
ASP A  62
 None
ZN  A 487 (-2.2A)
None
 0.95A 3ou7B-3ptkA:
undetectable		 3ou7B-3ptkA:
16.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qpm PEROXIREDOXIN

(Larimichthys
crocea) 		PF00578
(AhpC-TSA)
PF10417
(1-cysPrx_C) 		3 TYR A 180
ASP A 168
ASP A 140
 None
 0.95A 3ou7B-3qpmA:
undetectable		 3ou7B-3qpmA:
24.91
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.
3u62 SHIKIMATE
DEHYDROGENASE

(Thermotoga
maritima) 		PF01488
(Shikimate_DH)
PF08501
(Shikimate_dh_N) 		3 TYR A  91
ASP A  75
ASP A  94
 None
 0.98A 3ou7B-3u62A:
4.3		 3ou7B-3u62A:
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.
3v7n THREONINE SYNTHASE

(Burkholderia
thailandensis) 		PF00291
(PALP)
PF14821
(Thr_synth_N) 		3 TYR A 164
ASP A 127
ASP A 157
 None
None
MLA  A 484 (-4.8A)
 1.00A 3ou7B-3v7nA:
undetectable		 3ou7B-3v7nA:
18.63
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.
3vil BETA-GLUCOSIDASE

(Neotermes
koshunensis) 		PF00232
(Glyco_hydro_1) 		3 TYR A  84
ASP A  82
ASP A  78
 None
 0.86A 3ou7B-3vilA:
undetectable		 3ou7B-3vilA:
18.48
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.
3vxi DYP

(Bjerkandera
adusta) 		PF04261
(Dyp_perox) 		3 TYR A 293
ASP A 295
ASP A 299
 None
 0.89A 3ou7B-3vxiA:
undetectable		 3ou7B-3vxiA:
20.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wh7 BETA-GLUCOSIDASE

(metagenomes) 		PF00232
(Glyco_hydro_1) 		3 TYR A  58
ASP A  56
ASP A  52
 None
 0.89A 3ou7B-3wh7A:
undetectable		 3ou7B-3wh7A:
19.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4aw7 GH86A
BETA-PORPHYRANASE

(Bacteroides
plebeius) 		no annotation 3 TYR A 109
ASP A  57
ASP A 327
 K  A1617 (-4.8A)
None
None
 0.59A 3ou7B-4aw7A:
undetectable		 3ou7B-4aw7A:
18.27
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.
4boo ACETYLCHOLINE
RECEPTOR DELTA
SUBUNIT

(Torpedo
marmorata) 		PF02931
(Neur_chan_LBD)
PF02932
(Neur_chan_memb) 		3 TYR C 202
ASP C 214
ASP C 161
 None
 0.69A 3ou7B-4booC:
undetectable		 3ou7B-4booC:
18.32
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.
4c2k 3-KETOACYL-COA
THIOLASE,
MITOCHONDRIAL

(Homo sapiens) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		3 TYR A  20
ASP A 255
ASP A  26
 MES  A1401 (-4.7A)
None
None
 0.69A 3ou7B-4c2kA:
undetectable		 3ou7B-4c2kA:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4c90 ALPHA-GLUCURONIDASE
GH115

(Bacteroides
ovatus) 		PF15979
(Glyco_hydro_115) 		3 TYR A 155
ASP A 149
ASP A  62
 None
 0.88A 3ou7B-4c90A:
undetectable		 3ou7B-4c90A:
13.43
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.
4dmo N-HYDROXYARYLAMINE
O-ACETYLTRANSFERASE

(Bacillus cereus) 		PF00797
(Acetyltransf_2) 		3 TYR A  78
ASP A  82
ASP A   3
 None
 0.92A 3ou7B-4dmoA:
undetectable		 3ou7B-4dmoA:
20.57
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.
4ffw FAB HEAVY CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		3 TYR D  27
ASP D 105
ASP D 101
 None
 0.74A 3ou7B-4ffwD:
undetectable		 3ou7B-4ffwD:
23.46
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.
4gd3 HYDROGENASE-1 SMALL
CHAIN

(Escherichia
coli) 		no annotation 3 TYR S 182
ASP S 173
ASP S 171
 None
 0.97A 3ou7B-4gd3S:
undetectable		 3ou7B-4gd3S:
18.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hz8 BETA-GLUCOSIDASE

(uncultured
bacterium) 		PF00232
(Glyco_hydro_1) 		3 TYR A  95
ASP A  93
ASP A  89
 None
 0.94A 3ou7B-4hz8A:
undetectable		 3ou7B-4hz8A:
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.
4jcl CYCLOMALTODEXTRIN
GLUCANOTRANSFERASE

(Paenibacillus
macerans) 		PF00128
(Alpha-amylase)
PF00686
(CBM_20)
PF01833
(TIG) 		3 TYR A 361
ASP A 326
ASP A 329
 None
 0.93A 3ou7B-4jclA:
undetectable		 3ou7B-4jclA:
15.40
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.
4kqb PROTEIN H03A11.1

(Caenorhabditis
elegans) 		PF06702
(Fam20C) 		3 TYR A 208
ASP A 399
ASP A 359
 None
 0.78A 3ou7B-4kqbA:
undetectable		 3ou7B-4kqbA:
18.79
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.
4l1m E3 UBIQUITIN-PROTEIN
LIGASE HERC2

(Homo sapiens) 		PF00415
(RCC1) 		3 TYR A 634
ASP A 631
ASP A 643
 None
 0.87A 3ou7B-4l1mA:
undetectable		 3ou7B-4l1mA:
20.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mb5 CHITINASE 60

(Moritella
marina) 		PF00704
(Glyco_hydro_18)
PF16403
(DUF5011) 		3 TYR A 377
ASP A 267
ASP A 213
 None
 0.69A 3ou7B-4mb5A:
undetectable		 3ou7B-4mb5A:
18.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mq0 PARKIA BIGLOBOSA
LECTIN (PBL)

(Parkia
biglobosa) 		PF01419
(Jacalin) 		3 TYR A 283
ASP A 285
ASP A 166
 MMA  A 503 (-4.2A)
MMA  A 503 (-3.0A)
None
 0.77A 3ou7B-4mq0A:
undetectable		 3ou7B-4mq0A:
17.86
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.
4o2w E3 UBIQUITIN-PROTEIN
LIGASE HERC1

(Homo sapiens) 		PF00415
(RCC1) 		3 TYR A4111
ASP A4108
ASP A4120
 None
 0.91A 3ou7B-4o2wA:
undetectable		 3ou7B-4o2wA:
20.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4pcs ALPHA-L-FUCOSIDASE

(Bacteroides
thetaiotaomicron) 		PF01120
(Alpha_L_fucos) 		3 TYR A 149
ASP A 183
ASP A 188
 None
 0.85A 3ou7B-4pcsA:
undetectable		 3ou7B-4pcsA:
18.59
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.
4ptx GLYCOSIDE HYDROLASE
FAMILY 1

(Halothermothrix
orenii) 		PF00232
(Glyco_hydro_1) 		3 TYR A  58
ASP A  56
ASP A  52
 None
 0.89A 3ou7B-4ptxA:
undetectable		 3ou7B-4ptxA:
17.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qg5 PUTATIVE
PHOSPHOGLUCOMUTASE

(Leishmania
major) 		PF00408
(PGM_PMM_IV)
PF02878
(PGM_PMM_I)
PF02879
(PGM_PMM_II)
PF02880
(PGM_PMM_III) 		3 TYR A 229
ASP A 411
ASP A 299
 None
None
MG  A 601 (-2.9A)
 0.88A 3ou7B-4qg5A:
undetectable		 3ou7B-4qg5A:
17.03
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.
4r1d UNCHARACTERIZED
PROTEIN

(Pseudomonas
aeruginosa) 		no annotation 3 TYR A 431
ASP A 497
ASP A 541
 None
 1.00A 3ou7B-4r1dA:
undetectable		 3ou7B-4r1dA:
16.38
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.
4r6w PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE

(Plasmodium
falciparum) 		PF13649
(Methyltransf_25) 		3 TYR A  19
ASP A  85
ASP A 110
 SAH  A 302 ( 4.1A)
SAH  A 302 (-2.6A)
SAH  A 302 (-3.6A)
 0.78A 3ou7B-4r6wA:
17.9		 3ou7B-4r6wA:
19.01
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.
4tlh ETHANOLAMINE
UTILIZATION PROTEIN
EUTL

(Clostridium
perfringens) 		PF00936
(BMC) 		3 TYR A 124
ASP A  44
ASP A  42
 None
 0.94A 3ou7B-4tlhA:
undetectable		 3ou7B-4tlhA:
21.88
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.
4uoo LIPOTEICHOIC ACID
SYNTHASE

(Listeria
monocytogenes) 		PF00884
(Sulfatase) 		3 TYR A 248
ASP A 556
ASP A 561
 None
 0.96A 3ou7B-4uooA:
1.4		 3ou7B-4uooA:
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.
4uyd BROMODOMAIN-CONTAINI
NG PROTEIN 4

(Homo sapiens) 		PF00439
(Bromodomain) 		3 TYR A 118
ASP A 128
ASP A 106
 None
 0.97A 3ou7B-4uydA:
undetectable		 3ou7B-4uydA:
16.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4wyr ACETYL-COA
ACETYLTRANSFERASE

(Clostridium
acetobutylicum) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		3 TYR A  17
ASP A 251
ASP A  23
 None
 0.64A 3ou7B-4wyrA:
undetectable		 3ou7B-4wyrA:
19.23
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.
4zfm PUTATIVE
6-PHOSPHO-BETA-GALAC
TOBIOSIDASE

(Geobacillus
stearothermophilus) 		PF00232
(Glyco_hydro_1) 		3 TYR A  61
ASP A  59
ASP A  55
 None
IMD  A 507 (-3.4A)
None
 0.87A 3ou7B-4zfmA:
undetectable		 3ou7B-4zfmA:
19.18
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.
5a2r ANGIOTENSIN-CONVERTI
NG ENZYME

(Drosophila
melanogaster) 		PF01401
(Peptidase_M2) 		3 TYR A 507
ASP A 399
ASP A 437
 MLT  A1615 (-4.0A)
None
None
 0.99A 3ou7B-5a2rA:
undetectable		 3ou7B-5a2rA:
18.42
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.
5cg0 BETA-GLUCOSIDASE

(Spodoptera
frugiperda) 		PF00232
(Glyco_hydro_1) 		3 TYR A  78
ASP A  76
ASP A  72
 None
 0.91A 3ou7B-5cg0A:
undetectable		 3ou7B-5cg0A:
19.48
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.
5dt5 BETA-GLUCOSIDASE

(Exiguobacterium
antarcticum) 		PF00232
(Glyco_hydro_1) 		3 TYR A  55
ASP A  53
ASP A  49
 None
 0.98A 3ou7B-5dt5A:
undetectable		 3ou7B-5dt5A:
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.
5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE

(Bacillus
megaterium) 		PF00067
(p450) 		3 TYR A 166
ASP A 151
ASP A 144
 None
 0.86A 3ou7B-5e78A:
undetectable		 3ou7B-5e78A:
19.74
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.
5gnx BETA-GLUCOSIDASE

(metagenome) 		PF00232
(Glyco_hydro_1) 		3 TYR A  63
ASP A  61
ASP A  57
 None
 0.95A 3ou7B-5gnxA:
undetectable		 3ou7B-5gnxA:
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.
5gqf LACTO-N-BIOSIDASE

(Bifidobacterium
longum) 		no annotation 3 TYR A 183
ASP A 236
ASP A 291
 None
 0.90A 3ou7B-5gqfA:
undetectable		 3ou7B-5gqfA:
17.50
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.
5hjo GLUCOSIDASE 2
SUBUNIT BETA

(Mus musculus) 		PF12999
(PRKCSH-like) 		3 TYR B  55
ASP B  63
ASP B  49
 None
CA  B 202 (-3.4A)
DGO  B 201 ( 3.8A)
 0.75A 3ou7B-5hjoB:
undetectable		 3ou7B-5hjoB:
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.
5jbo BETA-GLUCOSIDASE

(Trichoderma
harzianum) 		PF00232
(Glyco_hydro_1) 		3 TYR A  60
ASP A  58
ASP A  54
 None
 0.93A 3ou7B-5jboA:
undetectable		 3ou7B-5jboA:
16.84
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.
5k0w CLASS B
CARBAPENEMASE GOB-18

(Elizabethkingia
meningoseptica) 		PF00753
(Lactamase_B) 		3 TYR A 215
ASP A 135
ASP A 126
 None
 0.89A 3ou7B-5k0wA:
undetectable		 3ou7B-5k0wA:
20.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ksh PENICILLIN-BINDING
PROTEIN 2

(Neisseria
gonorrhoeae) 		PF00905
(Transpeptidase)
PF03717
(PBP_dimer) 		3 TYR A  54
ASP A 219
ASP A 222
 None
 0.68A 3ou7B-5kshA:
undetectable		 3ou7B-5kshA:
16.39
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.
5l2p ARYLESTERASE

(Sulfolobus
solfataricus) 		PF07859
(Abhydrolase_3) 		3 TYR A 120
ASP A 128
ASP A 113
 None
 0.90A 3ou7B-5l2pA:
3.1		 3ou7B-5l2pA:
20.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5lx8 SUSD HOMOLOG

(Bacteroides
thetaiotaomicron) 		PF07980
(SusD_RagB)
PF14322
(SusD-like_3) 		3 TYR A 391
ASP A 318
ASP A 382
 None
NA  A 608 ( 4.3A)
None
 1.00A 3ou7B-5lx8A:
undetectable		 3ou7B-5lx8A:
15.86
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.
5ogz -

(-) 		no annotation 3 TYR A  58
ASP A  56
ASP A  52
 None
 0.92A 3ou7B-5ogzA:
undetectable		 3ou7B-5ogzA:
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.
5tnv AP ENDONUCLEASE,
FAMILY PROTEIN 2

(Mycolicibacterium
smegmatis) 		PF01261
(AP_endonuc_2) 		3 TYR A 175
ASP A 144
ASP A  92
 None
 1.00A 3ou7B-5tnvA:
undetectable		 3ou7B-5tnvA:
21.65
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.
5vba LYSOZYME, ESX-1
SECRETION-ASSOCIATED
PROTEIN ESPG1
CHIMERA

(Mycobacterium
kansasii;
Escherichia
virus T4) 		PF00959
(Phage_lysozyme)
PF14011
(ESX-1_EspG) 		3 TYR A1025
ASP A1020
ASP A  72
 None
 0.95A 3ou7B-5vbaA:
undetectable		 3ou7B-5vbaA:
21.06
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.
5w21 KLOTHO

(Homo sapiens) 		no annotation 3 TYR A 129
ASP A 127
ASP A 123
 None
 0.88A 3ou7B-5w21A:
undetectable		 3ou7B-5w21A:
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.
5wb1 ENVELOPE PROTEIN
US28, NANOBODY 7
FUSION PROTEIN

(Lama glama;
Human
betaherpesvirus
5) 		no annotation 3 TYR A 138
ASP A 128
ASP A  69
 None
 0.81A 3ou7B-5wb1A:
undetectable		 3ou7B-5wb1A:
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.
5wka BETA-GLUCOSIDASE

(metagenome) 		no annotation 3 TYR A  54
ASP A  52
ASP A  48
 None
 0.92A 3ou7B-5wkaA:
undetectable		 3ou7B-5wkaA:
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.
5wp4 PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE
1

(Arabidopsis
thaliana) 		no annotation 3 TYR A 246
ASP A 312
ASP A 338
 SAH  A 703 ( 4.0A)
SAH  A 703 (-2.6A)
SAH  A 703 (-3.3A)
 0.78A 3ou7B-5wp4A:
19.7		 3ou7B-5wp4A:
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.
5yj6 DOCKERIN TYPE I
REPEAT-CONTAINING
PROTEIN

(Ruminiclostridium
thermocellum) 		no annotation 3 TYR A 327
ASP A 297
ASP A 255
 33O  A 801 (-4.4A)
None
None
 1.00A 3ou7B-5yj6A:
undetectable		 3ou7B-5yj6A:
undetectable