SIMILAR PATTERNS OF AMINO ACIDS FOR 3OU7_B_SAMB300_0

List of similar pattern of amino acids derived from ASSAM search

Hit pattern: 3D amino acid arrangements similar to known drug binding site

Query pattern: Residues from known binding site for annotated drug that match the hit pattern


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