SIMILAR PATTERNS OF AMINO ACIDS FOR 3OU7_C_SAMC300_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.
1bev BOVINE ENTEROVIRUS
COAT PROTEINS VP1 TO
VP4
BOVINE ENTEROVIRUS
COAT PROTEINS VP1 TO
VP4

(Enterovirus E;
Enterovirus E) 		PF00073
(Rhv)
PF00073
(Rhv) 		5 GLY 3 100
SER 3  95
LEU 3 102
ALA 1 107
TRP 1 111
 None
 1.26A 3ou7C-1bev3:
undetectable		 3ou7C-1bev3:
20.38
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.
1cxa CYTOCHROME C2

(Rhodobacter
sphaeroides) 		PF00034
(Cytochrom_C) 		5 LEU A  87
TYR A  90
ALA A  48
TRP A  71
HIS A  75
 None
None
HEM  A 126 (-4.4A)
HEM  A 126 (-4.0A)
None
 1.05A 3ou7C-1cxaA:
undetectable		 3ou7C-1cxaA:
20.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1e33 ARYLSULFATASE A

(Homo sapiens) 		PF00884
(Sulfatase)
PF14707
(Sulfatase_C) 		5 LEU P 271
ALA P 264
GLY P 266
LEU P 268
ALA P 205
 None
 1.31A 3ou7C-1e33P:
undetectable		 3ou7C-1e33P:
19.75
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.
1ej6 LAMBDA1

(Reovirus sp.) 		no annotation 5 LEU B 979
ALA B 927
MET B 922
LEU B 984
ALA B1021
 None
 1.26A 3ou7C-1ej6B:
undetectable		 3ou7C-1ej6B:
10.45
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.
1gwc GLUTATHIONE
S-TRANSFERASE TSI-1

(Aegilops
tauschii) 		PF00043
(GST_C)
PF02798
(GST_N) 		5 LEU A  59
TYR A  32
ALA A  24
LEU A  73
ALA A 204
 None
 1.33A 3ou7C-1gwcA:
undetectable		 3ou7C-1gwcA:
22.45
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.
1hno D3,D2-ENOYL COA
ISOMERASE ECI1

(Saccharomyces
cerevisiae) 		PF00378
(ECH_1) 		5 TYR A  38
ALA A 129
GLY A 160
LEU A 165
ALA A 123
 None
 1.29A 3ou7C-1hnoA:
undetectable		 3ou7C-1hnoA:
20.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ibj CYSTATHIONINE
BETA-LYASE

(Arabidopsis
thaliana) 		PF01053
(Cys_Met_Meta_PP) 		5 LEU A 108
TYR A 109
TYR A 125
ALA A 137
LEU A 322
 None
 1.15A 3ou7C-1ibjA:
undetectable		 3ou7C-1ibjA:
19.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1izo CYTOCHROME P450
152A1

(Bacillus
subtilis) 		PF00067
(p450) 		5 GLY A 211
SER A 210
LEU A 102
ALA A 233
HIS A 220
 None
 1.27A 3ou7C-1izoA:
undetectable		 3ou7C-1izoA:
23.19
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.
1mb9 BETA-LACTAM
SYNTHETASE

(Streptomyces
clavuligerus) 		PF00733
(Asn_synthase)
PF13537
(GATase_7) 		5 TYR A 144
ALA A 160
TRP A 314
LEU A  13
ALA A  29
 None
 1.32A 3ou7C-1mb9A:
4.0		 3ou7C-1mb9A:
21.62
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.
1q5q PROTEASOME
ALPHA-TYPE SUBUNIT 1
PROTEASOME BETA-TYPE
SUBUNIT 1

(Rhodococcus
erythropolis;
Rhodococcus
erythropolis) 		PF00227
(Proteasome)
PF00227
(Proteasome) 		5 ALA A  82
GLY A  86
SER A  88
ALA A  77
HIS H  65
 None
 1.20A 3ou7C-1q5qA:
undetectable		 3ou7C-1q5qA:
23.62
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.
1sml PROTEIN
(PENICILLINASE)

(Stenotrophomonas
maltophilia) 		PF00753
(Lactamase_B) 		5 TYR A  11
ALA A  90
GLY A 117
LEU A 114
HIS A  84
 None
None
None
None
ZN  A 271 (-3.2A)
 1.24A 3ou7C-1smlA:
undetectable		 3ou7C-1smlA:
25.17
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.
1tqy ACTINORHODIN
POLYKETIDE PUTATIVE
BETA-KETOACYL
SYNTHASE 2

(Streptomyces
coelicolor) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 ALA B 232
GLY B 336
SER B 335
LEU B 340
ALA B  82
 None
 1.34A 3ou7C-1tqyB:
undetectable		 3ou7C-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.
1v5f PYRUVATE OXIDASE

(Aerococcus
viridans) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		5 LEU A  32
ALA A 101
GLY A  76
LEU A 103
ALA A 159
 None
 1.34A 3ou7C-1v5fA:
undetectable		 3ou7C-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.
1vq7 50S RIBOSOMAL
PROTEIN L30P

(Haloarcula
marismortui) 		PF00327
(Ribosomal_L30) 		5 LEU W 101
SER W  58
LEU W  34
ALA W  53
HIS W   2
 None
 1.35A 3ou7C-1vq7W:
undetectable		 3ou7C-1vq7W:
22.67
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.
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
 1.03A 3ou7C-1w1kA:
undetectable		 3ou7C-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.
1xmp PHOSPHORIBOSYLAMINOI
MIDAZOLE CARBOXYLASE

(Bacillus
anthracis) 		PF00731
(AIRC) 		5 ALA A 129
GLY A 133
SER A 134
LEU A 143
ALA A 124
 None
 1.35A 3ou7C-1xmpA:
undetectable		 3ou7C-1xmpA:
21.24
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.
1yjk PEPTIDYL-GLYCINE
ALPHA-AMIDATING
MONOOXYGENASE

(Rattus
norvegicus) 		PF01082
(Cu2_monooxygen)
PF03712
(Cu2_monoox_C) 		5 LEU A 317
GLY A 252
SER A 251
LEU A 289
ALA A 339
 None
 1.27A 3ou7C-1yjkA:
undetectable		 3ou7C-1yjkA:
20.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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)
 1.13A 3ou7C-1yy5A:
2.5		 3ou7C-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.
2avn UBIQUINONE/MENAQUINO
NE BIOSYNTHESIS
METHYLTRANSFERASE-RE
LATED PROTEIN

(Thermotoga
maritima) 		PF08241
(Methyltransf_11) 		5 TYR A   9
TYR A  16
TRP A  56
SER A  73
MET A  76
 SAI  A1300 (-3.8A)
SAI  A1300 (-4.9A)
None
SAI  A1300 (-4.7A)
SAI  A1300 ( 4.2A)
 0.74A 3ou7C-2avnA:
19.0		 3ou7C-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.
2b61 HOMOSERINE
O-ACETYLTRANSFERASE

(Haemophilus
influenzae) 		PF00561
(Abhydrolase_1) 		5 TYR A 276
ALA A 149
GLY A 142
SER A 143
ALA A 153
 None
 1.33A 3ou7C-2b61A:
2.4		 3ou7C-2b61A:
20.47
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.
2fv0 UNSATURATED
GLUCURONYL HYDROLASE

(Bacillus sp.
GL1) 		PF07470
(Glyco_hydro_88) 		5 LEU A  53
ALA A  99
GLY A 370
LEU A  95
ALA A 109
 None
 1.24A 3ou7C-2fv0A:
undetectable		 3ou7C-2fv0A:
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.
2i6b ADENOSINE KINASE

(Homo sapiens) 		PF00294
(PfkB) 		5 LEU A  28
ALA A 124
LEU A  52
ALA A 136
HIS A  45
 None
None
None
89I  A 500 (-3.4A)
None
 1.33A 3ou7C-2i6bA:
3.2		 3ou7C-2i6bA:
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.
2iuc ALKALINE PHOSPHATASE

(Antarctic
bacterium TAB5) 		PF00245
(Alk_phosphatase) 		5 ALA B 167
GLY B 169
SER B 131
LEU B 215
ALA B 238
 None
 1.28A 3ou7C-2iucB:
undetectable		 3ou7C-2iucB:
21.35
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.
2iuc ALKALINE PHOSPHATASE

(Antarctic
bacterium TAB5) 		PF00245
(Alk_phosphatase) 		5 ALA B 167
GLY B 169
SER B 132
LEU B 215
ALA B 238
 None
 1.23A 3ou7C-2iucB:
undetectable		 3ou7C-2iucB:
21.35
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.
2ixb ALPHA-N-ACETYLGALACT
OSAMINIDASE

(Elizabethkingia
meningoseptica) 		PF01408
(GFO_IDH_MocA) 		5 TYR A 217
GLY A 257
LEU A 303
ALA A 252
HIS A 299
 None
 1.32A 3ou7C-2ixbA:
3.0		 3ou7C-2ixbA:
17.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2j0a BETA-1,3-N-ACETYLGLU
COSAMINYLTRANSFERASE
MANIC FRINGE

(Mus musculus) 		PF02434
(Fringe) 		5 ALA A 215
GLY A 217
SER A 218
LEU A 119
ALA A 208
 None
 1.24A 3ou7C-2j0aA:
undetectable		 3ou7C-2j0aA:
22.56
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.
2jbm NICOTINATE-NUCLEOTID
E PYROPHOSPHORYLASE

(Homo sapiens) 		PF01729
(QRPTase_C)
PF02749
(QRPTase_N) 		5 LEU A  69
TRP A  49
GLY A 102
LEU A 100
ALA A  47
 None
 1.32A 3ou7C-2jbmA:
undetectable		 3ou7C-2jbmA:
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.
2ozg GCN5-RELATED
N-ACETYLTRANSFERASE

(Trichormus
variabilis) 		PF13527
(Acetyltransf_9)
PF13530
(SCP2_2) 		5 LEU A 358
TRP A  70
GLY A 134
SER A 135
LEU A 287
 None
 1.34A 3ou7C-2ozgA:
undetectable		 3ou7C-2ozgA:
20.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2rdx MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME,
PUTATIVE

(Roseovarius
nubinhibens) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 TYR A 100
GLY A 270
SER A 267
ALA A  72
HIS A  98
 None
 1.22A 3ou7C-2rdxA:
undetectable		 3ou7C-2rdxA:
24.20
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.
2uy3 ENDOCHITINASE

(Saccharomyces
cerevisiae) 		PF00704
(Glyco_hydro_18) 		5 TYR A 214
ALA A 254
GLY A 256
SER A 257
ALA A 290
 H33  A1311 (-4.7A)
None
None
None
None
 1.16A 3ou7C-2uy3A:
undetectable		 3ou7C-2uy3A:
20.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2v7b BENZOATE-COENZYME A
LIGASE

(Paraburkholderia
xenovorans) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		5 LEU A 116
TYR A 112
ALA A 126
LEU A 148
ALA A 129
 None
 1.20A 3ou7C-2v7bA:
undetectable		 3ou7C-2v7bA:
17.89
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.
2vsa MOSQUITOCIDAL TOXIN

(Lysinibacillus
sphaericus) 		PF05588
(Botulinum_HA-17)
PF14200
(RicinB_lectin_2) 		5 LEU A 359
GLY A 376
SER A 323
LEU A 361
TRP A 338
 None
 1.25A 3ou7C-2vsaA:
undetectable		 3ou7C-2vsaA:
12.41
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.
2wk1 NOVP

(Actinoalloteichus
cyanogriseus) 		PF05711
(TylF) 		5 LEU A 166
TYR A 164
GLY A 106
ALA A  27
HIS A  63
 None
 1.22A 3ou7C-2wk1A:
8.8		 3ou7C-2wk1A:
23.67
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.
2xj6 ASCORBATE PEROXIDASE

(Glycine max) 		PF00141
(peroxidase) 		5 GLY A 162
SER A 160
LEU A  37
ALA A  44
HIS A  42
 HEM  A1001 ( 3.9A)
HEM  A1001 ( 3.8A)
HEM  A1001 ( 4.3A)
None
None
 1.28A 3ou7C-2xj6A:
undetectable		 3ou7C-2xj6A:
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.
2xyd ANGIOTENSIN-CONVERTI
NG ENZYME

(Homo sapiens) 		PF01401
(Peptidase_M2) 		5 LEU A 570
TYR A 573
TYR A 424
ALA A 396
HIS A 512
 None
 1.24A 3ou7C-2xydA:
undetectable		 3ou7C-2xydA:
16.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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
 0.96A 3ou7C-2z2nA:
undetectable		 3ou7C-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 TYR A 258
ALA A 289
SER A 266
MET A 264
LEU A 282
 None
 1.12A 3ou7C-2z37A:
undetectable		 3ou7C-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.
2zec TRYPTASE BETA 2

(Homo sapiens) 		PF00089
(Trypsin) 		5 LEU A  33
ALA A  57
TRP A 229
GLY A  46
ALA A 101
 None
 1.24A 3ou7C-2zecA:
undetectable		 3ou7C-2zecA:
20.61
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.
3dla GLUTAMINE-DEPENDENT
NAD(+) SYNTHETASE

(Mycobacterium
tuberculosis) 		PF00795
(CN_hydrolase)
PF02540
(NAD_synthase) 		5 ALA A 198
SER A 186
MET A 179
LEU A 171
ALA A  16
 None
 1.19A 3ou7C-3dlaA:
undetectable		 3ou7C-3dlaA:
16.37
Potential target for repurposing, i.e. matched protein structure has less than 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  17
TYR A  24
GLY A  73
SER A  74
 SAM  A 221 (-4.4A)
SAM  A 221 (-3.8A)
SAM  A 221 (-4.7A)
SAM  A 221 (-3.2A)
SAM  A 221 (-4.6A)
 0.93A 3ou7C-3e23A:
19.0		 3ou7C-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.
3egw RESPIRATORY NITRATE
REDUCTASE 1 ALPHA
CHAIN

(Escherichia
coli) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF14710
(Nitr_red_alph_N) 		5 LEU A 214
ALA A 203
GLY A 187
ALA A 595
HIS A 604
 None
 1.36A 3ou7C-3egwA:
3.7		 3ou7C-3egwA:
11.17
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.
3fnc PUTATIVE
ACETYLTRANSFERASE

(Listeria
innocua) 		PF13673
(Acetyltransf_10) 		5 LEU A  89
TYR A  88
TYR A  45
ALA A  72
GLY A  70
 EDO  A 165 (-4.9A)
EDO  A 167 (-4.1A)
MLI  A 161 (-4.5A)
None
None
 1.35A 3ou7C-3fncA:
undetectable		 3ou7C-3fncA:
18.83
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.
3fnc PUTATIVE
ACETYLTRANSFERASE

(Listeria
innocua) 		PF13673
(Acetyltransf_10) 		5 TYR A  45
ALA A  72
GLY A  70
LEU A 102
ALA A  85
 MLI  A 161 (-4.5A)
None
None
None
None
 1.30A 3ou7C-3fncA:
undetectable		 3ou7C-3fncA:
18.83
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.
3fnc PUTATIVE
ACETYLTRANSFERASE

(Listeria
innocua) 		PF13673
(Acetyltransf_10) 		5 TYR A  88
TYR A  45
ALA A  72
GLY A  70
LEU A 102
 EDO  A 167 (-4.1A)
MLI  A 161 (-4.5A)
None
None
None
 1.23A 3ou7C-3fncA:
undetectable		 3ou7C-3fncA:
18.83
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.
3fpz THIAZOLE
BIOSYNTHETIC ENZYME

(Saccharomyces
cerevisiae) 		PF01946
(Thi4) 		5 ALA A 289
GLY A  77
SER A  75
MET A 309
LEU A 232
 None
None
AHZ  A1100 (-3.6A)
AHZ  A1100 (-3.3A)
None
 1.21A 3ou7C-3fpzA:
2.1		 3ou7C-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.
3h7n NUCLEOPORIN NUP120

(Saccharomyces
cerevisiae) 		PF11715
(Nup160) 		5 LEU A 205
TYR A 204
GLY A 181
LEU A 183
TRP A 246
 None
 1.29A 3ou7C-3h7nA:
undetectable		 3ou7C-3h7nA:
13.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hoa THERMOSTABLE
CARBOXYPEPTIDASE 1

(Thermus
thermophilus) 		PF02074
(Peptidase_M32) 		5 LEU A 235
ALA A 224
SER A 229
LEU A 240
ALA A 219
 None
 1.35A 3ou7C-3hoaA:
undetectable		 3ou7C-3hoaA:
20.17
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.
3iup PUTATIVE
NADPH:QUINONE
OXIDOREDUCTASE

(Cupriavidus
pinatubonensis) 		no annotation 5 LEU A 284
TYR A 285
GLY A 248
LEU A 252
HIS A 176
 None
NDP  A 401 (-4.0A)
None
None
None
 1.25A 3ou7C-3iupA:
4.2		 3ou7C-3iupA:
19.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3iup PUTATIVE
NADPH:QUINONE
OXIDOREDUCTASE

(Cupriavidus
pinatubonensis) 		no annotation 5 TYR A 285
GLY A 248
LEU A 252
ALA A 180
HIS A 176
 NDP  A 401 (-4.0A)
None
None
NDP  A 401 ( 4.1A)
None
 1.35A 3ou7C-3iupA:
4.2		 3ou7C-3iupA:
19.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kje CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE
COMPLEX, ACCESSORY
PROTEIN COOC

(Carboxydothermus
hydrogenoformans) 		PF01656
(CbiA) 		5 LEU A 242
ALA A  17
GLY A  19
MET A  24
ALA A   4
 None
 1.32A 3ou7C-3kjeA:
undetectable		 3ou7C-3kjeA:
19.69
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.
3l6v DNA GYRASE SUBUNIT A

(Xanthomonas
campestris) 		PF03989
(DNA_gyraseA_C) 		5 ALA A 776
GLY A 824
SER A 825
LEU A 822
ALA A 793
 None
 1.27A 3ou7C-3l6vA:
undetectable		 3ou7C-3l6vA:
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.
3lke ENOYL-COA HYDRATASE

(Bacillus
halodurans) 		PF00378
(ECH_1) 		5 LEU A  28
ALA A 112
GLY A 115
MET A 120
ALA A 132
 None
 1.21A 3ou7C-3lkeA:
undetectable		 3ou7C-3lkeA:
21.94
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.
3n2b DIAMINOPIMELATE
DECARBOXYLASE

(Vibrio cholerae) 		PF00278
(Orn_DAP_Arg_deC)
PF02784
(Orn_Arg_deC_N) 		5 ALA A 281
GLY A 285
SER A 369
LEU A  38
ALA A  59
 None
 1.30A 3ou7C-3n2bA:
undetectable		 3ou7C-3n2bA:
20.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3nut PRECORRIN-3
METHYLASE

(Rhodobacter
capsulatus) 		PF00590
(TP_methylase) 		5 TYR A 163
GLY A  11
SER A  80
LEU A  17
ALA A 120
 SAH  A1501 (-4.4A)
None
SAH  A1501 (-3.9A)
None
None
 1.32A 3ou7C-3nutA:
undetectable		 3ou7C-3nutA:
23.48
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.
3oky PLEXIN-A2

(Mus musculus) 		PF01403
(Sema)
PF01437
(PSI) 		5 LEU A  53
TYR A 245
ALA A 436
LEU A 495
ALA A 316
 None
 1.29A 3ou7C-3okyA:
undetectable		 3ou7C-3okyA:
17.43
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  15
TYR A  22
ALA A  54
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 ( 3.5A)
SAM  A 300 (-4.4A)
SAM  A 300 (-3.4A)
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)
 0.13A 3ou7C-3ou6A:
39.2		 3ou7C-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  14
TYR A  22
ALA A  58
SER A  81
MET A  84
 SAH  A 263 ( 3.9A)
SAH  A 263 (-4.6A)
SAH  A 263 (-3.5A)
SAH  A 263 (-4.7A)
SAH  A 263 (-4.5A)
 0.75A 3ou7C-3px2A:
17.2		 3ou7C-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.
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
 1.08A 3ou7C-3qvqA:
undetectable		 3ou7C-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.
3vw1 PUTATIVE REGULATORY
PROTEIN

(Salmonella
enterica) 		PF00440
(TetR_N) 		5 LEU A 109
ALA A  17
LEU A  54
ALA A  12
HIS A  61
 None
 1.09A 3ou7C-3vw1A:
undetectable		 3ou7C-3vw1A:
21.62
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.
3zyt ESTERASE A

(Paenarthrobacter
nitroguajacolicus) 		PF00144
(Beta-lactamase) 		5 LEU A 219
TYR A 148
GLY A 113
LEU A 118
ALA A 245
 None
 1.33A 3ou7C-3zytA:
undetectable		 3ou7C-3zytA:
21.74
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.
4b29 DIMETHYLSULFONIOPROP
IONATE LYASE

(Roseovarius
nubinhibens) 		PF16867
(DMSP_lyase) 		5 LEU A  91
TYR A  81
TRP A 126
GLY A  87
ALA A 169
 None
 1.22A 3ou7C-4b29A:
undetectable		 3ou7C-4b29A:
22.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4b2n 70 KDA PROTEIN

(Xanthomonas sp.
35Y) 		no annotation 5 ALA A 218
GLY A 247
SER A 248
MET A 285
ALA A 222
 HEM  A 700 ( 4.9A)
None
None
None
None
 1.24A 3ou7C-4b2nA:
undetectable		 3ou7C-4b2nA:
17.36
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.
4b4o EPIMERASE FAMILY
PROTEIN SDR39U1

(Homo sapiens) 		PF01370
(Epimerase)
PF08338
(DUF1731) 		5 ALA A  55
GLY A   6
LEU A  89
ALA A 102
TRP A 103
 None
 1.23A 3ou7C-4b4oA:
2.2		 3ou7C-4b4oA:
20.71
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.
4ewp 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3

(Micrococcus
luteus) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		5 TYR A 126
ALA A 174
SER A  90
LEU A 146
ALA A  21
 None
 1.23A 3ou7C-4ewpA:
undetectable		 3ou7C-4ewpA:
23.81
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.
4fl3 TYROSINE-PROTEIN
KINASE SYK

(Homo sapiens) 		PF00017
(SH2)
PF07714
(Pkinase_Tyr) 		5 LEU A 365
TYR A 364
ALA A 421
GLY A 437
LEU A 446
 None
 1.11A 3ou7C-4fl3A:
undetectable		 3ou7C-4fl3A:
16.48
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.
4fsp PROBABLE PORIN

(Pseudomonas
aeruginosa) 		PF03573
(OprD) 		5 TYR A 198
GLY A 213
SER A 197
LEU A 231
HIS A 210
 C8E  A 408 ( 3.9A)
None
None
None
C8E  A 408 ( 4.2A)
 1.27A 3ou7C-4fspA:
undetectable		 3ou7C-4fspA:
20.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4igg CATENIN ALPHA-1

(Homo sapiens) 		PF01044
(Vinculin) 		5 LEU A 318
GLY A 315
SER A 314
LEU A 382
ALA A 335
 None
 1.29A 3ou7C-4iggA:
undetectable		 3ou7C-4iggA:
15.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4q16 NH(3)-DEPENDENT
NAD(+) SYNTHETASE

(Deinococcus
radiodurans) 		PF02540
(NAD_synthase) 		5 LEU A  52
TRP A 212
GLY A  64
LEU A  66
ALA A 199
 None
 1.30A 3ou7C-4q16A:
2.7		 3ou7C-4q16A:
23.18
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.
4tvo MALATE DEHYDROGENASE

(Mycobacterium
tuberculosis) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 ALA A 252
GLY A 129
SER A 155
MET A 267
LEU A  87
 None
 1.27A 3ou7C-4tvoA:
4.5		 3ou7C-4tvoA:
22.32
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.
4z26 PUTATIVE GMC-TYPE
OXIDOREDUCTASE R135

(Acanthamoeba
polyphaga
mimivirus) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		5 LEU A  25
TRP A 618
LEU A  35
ALA A 232
HIS A  23
 None
 1.21A 3ou7C-4z26A:
2.3		 3ou7C-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.
4z26 PUTATIVE GMC-TYPE
OXIDOREDUCTASE R135

(Acanthamoeba
polyphaga
mimivirus) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		5 LEU A  25
TYR A  24
TRP A 618
LEU A  35
ALA A 232
 None
 1.35A 3ou7C-4z26A:
2.3		 3ou7C-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.
4z64 PHYTOSULFOKINE
RECEPTOR 1

(Arabidopsis
thaliana) 		PF00560
(LRR_1)
PF08263
(LRRNT_2)
PF13855
(LRR_8) 		5 LEU A 412
ALA A 382
GLY A 384
LEU A 386
ALA A 377
 None
 1.24A 3ou7C-4z64A:
undetectable		 3ou7C-4z64A:
15.25
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.
4z9r OMEGA-3
POLYUNSATURATED
FATTY ACID SYNTHASE
SUBUNIT PFAD

(Shewanella
oneidensis) 		PF03060
(NMO) 		5 LEU A 286
ALA A 230
SER A 225
LEU A 293
ALA A 265
 None
 1.34A 3ou7C-4z9rA:
undetectable		 3ou7C-4z9rA:
18.86
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.
5a31 ANAPHASE-PROMOTING
COMPLEX SUBUNIT 1

(Homo sapiens) 		PF12859
(ANAPC1) 		5 ALA A1297
GLY A1299
MET A1304
ALA A1252
HIS A1602
 None
 1.33A 3ou7C-5a31A:
undetectable		 3ou7C-5a31A:
9.57
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.
5b7i CRISPR-ASSOCIATED
NUCLEASE/HELICASE
CAS3 SUBTYPE
I-F/YPEST

(Pseudomonas
aeruginosa) 		no annotation 5 LEU A 154
ALA A 119
GLY A 214
LEU A 216
ALA A 357
 None
 1.20A 3ou7C-5b7iA:
undetectable		 3ou7C-5b7iA:
12.15
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.
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
 1.05A 3ou7C-5dm3A:
undetectable		 3ou7C-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.
5f8e METHYLTRANSFERASE

(Mycobacterium
tuberculosis) 		PF13847
(Methyltransf_31) 		5 LEU A 307
TYR A 132
GLY A 311
LEU A 314
ALA A 247
 None
None
None
None
SAH  A 400 ( 4.2A)
 1.27A 3ou7C-5f8eA:
15.0		 3ou7C-5f8eA:
21.84
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.
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 3ou7C-5g0qA:
undetectable		 3ou7C-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.
5g0q BETA-GLUCURONIDASE

(Acidobacterium
capsulatum) 		PF03662
(Glyco_hydro_79n) 		5 LEU A 307
GLY A 469
SER A 468
LEU A 356
ALA A 383
 None
 1.20A 3ou7C-5g0qA:
undetectable		 3ou7C-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.
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 3ou7C-5hxsA:
undetectable		 3ou7C-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.
5ir6 BD-TYPE QUINOL
OXIDASE SUBUNIT I

(Geobacillus
stearothermophilus) 		PF01654
(Cyt_bd_oxida_I) 		5 LEU A 332
ALA A 200
GLY A 362
LEU A 359
ALA A 219
 None
 1.35A 3ou7C-5ir6A:
undetectable		 3ou7C-5ir6A:
20.14
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.
5l5g PLEXIN-A2

(Mus musculus) 		PF01403
(Sema)
PF01437
(PSI)
PF01833
(TIG) 		5 LEU A  53
TYR A 245
ALA A 436
LEU A 495
ALA A 316
 None
 1.28A 3ou7C-5l5gA:
undetectable		 3ou7C-5l5gA:
11.20
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.
5lc5 NADH DEHYDROGENASE
[UBIQUINONE]
IRON-SULFUR PROTEIN
7, MITOCHONDRIAL
NADH DEHYDROGENASE
[UBIQUINONE]
IRON-SULFUR PROTEIN
2, MITOCHONDRIAL

(Bos taurus;
Bos taurus) 		PF01058
(Oxidored_q6)
PF00346
(Complex1_49kDa) 		5 LEU D 106
ALA B  53
GLY D 426
LEU D  83
ALA B  89
 None
SF4  B 201 (-3.3A)
None
None
None
 1.26A 3ou7C-5lc5D:
undetectable		 3ou7C-5lc5D:
21.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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 3ou7C-5m95A:
undetectable		 3ou7C-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.
5n03 GLUTACONATE
COA-TRANSFERASE
FAMILY, SUBUNIT B

(Myxococcus
xanthus) 		no annotation 5 LEU D  77
TYR D  76
GLY D  58
SER D  59
ALA D  32
 None
 1.26A 3ou7C-5n03D:
2.2		 3ou7C-5n03D:
25.29
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.
5thm ESTERASE-6

(Drosophila
melanogaster) 		PF00135
(COesterase) 		5 ALA A 231
GLY A 235
SER A 237
LEU A 249
ALA A 227
 None
None
MLY  A 267 ( 3.8A)
MLY  A 250 ( 3.7A)
None
 1.14A 3ou7C-5thmA:
undetectable		 3ou7C-5thmA:
19.21
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.
5uam ULVAN LYASE-PL25

(Pseudoalteromonas
sp. PLSV) 		PF15892
(BNR_4) 		5 TYR A 188
TYR A 246
ALA A 207
GLY A 186
HIS A 123
 EDO  A 511 ( 3.0A)
EDO  A 511 ( 3.8A)
EDO  A 509 (-3.0A)
None
PO4  A 503 (-3.7A)
 1.33A 3ou7C-5uamA:
undetectable		 3ou7C-5uamA:
18.03
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.
5vho 26S PROTEASOME
NON-ATPASE
REGULATORY SUBUNIT
10

(Homo sapiens) 		PF00023
(Ank)
PF12796
(Ank_2) 		5 LEU G  93
ALA G 130
GLY G 128
LEU G 126
ALA G 134
 None
 1.30A 3ou7C-5vhoG:
undetectable		 3ou7C-5vhoG:
24.50
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.
5xfl CATENIN ALPHA-2

(Mus musculus) 		no annotation 5 LEU A 316
GLY A 313
SER A 312
LEU A 380
ALA A 333
 None
 1.31A 3ou7C-5xflA:
undetectable		 3ou7C-5xflA:
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.
5y4e ANKYRIN-2,ANKYRIN-2

(Homo sapiens) 		PF00023
(Ank)
PF12796
(Ank_2) 		5 ALA A1339
GLY A1310
SER A1309
ALA A1368
HIS A1377
 None
 1.27A 3ou7C-5y4eA:
undetectable		 3ou7C-5y4eA:
21.95
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.
5yim SDEA

(Legionella
pneumophila) 		no annotation 5 ALA A 299
GLY A 434
SER A 435
LEU A 306
ALA A 787
 None
 1.35A 3ou7C-5yimA:
undetectable		 3ou7C-5yimA:
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.
5z06 BDI_3064 PROTEIN

(Parabacteroides
distasonis) 		no annotation 5 TYR A 517
GLY A 506
SER A 509
LEU A 461
HIS A 475
 GOL  A 805 (-4.6A)
None
None
None
GOL  A 805 (-4.6A)
 1.32A 3ou7C-5z06A:
undetectable		 3ou7C-5z06A:
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.
6at7 PHENYLALANINE
AMMONIA-LYASE

(Sorghum bicolor) 		no annotation 5 TYR A 158
ALA A  80
GLY A 160
SER A 159
HIS A 377
 None
 1.25A 3ou7C-6at7A:
undetectable		 3ou7C-6at7A:
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
ALA A 689
GLY A 543
HIS A 686
 None
 1.14A 3ou7C-6az0A:
2.4		 3ou7C-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.
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
 1.01A 3ou7C-6az0A:
2.4		 3ou7C-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.
6b4h NUCLEOPORIN GLE1

(Chaetomium
thermophilum) 		no annotation 5 TYR A 484
ALA A 491
SER A 486
LEU A 492
ALA A 451
 None
 1.21A 3ou7C-6b4hA:
undetectable		 3ou7C-6b4hA:
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.
6dzs HOMOSERINE
DEHYDROGENASE

(Mycolicibacterium
hassiacum) 		no annotation 5 LEU A 277
ALA A 241
GLY A 245
LEU A 274
ALA A 236
 None
 1.26A 3ou7C-6dzsA:
3.0		 3ou7C-6dzsA:
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.
6ez8 HUNTINGTIN

(Homo sapiens) 		no annotation 5 LEU A1828
TYR A 957
GLY A1773
LEU A1747
HIS A1765
 None
 1.34A 3ou7C-6ez8A:
undetectable		 3ou7C-6ez8A:
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.
6g0c UBIQUITINATING/DEUBI
QUITINATING ENZYME
SDEA

(Legionella
pneumophila) 		no annotation 5 ALA A 299
GLY A 434
SER A 435
LEU A 306
ALA A 787
 None
 1.26A 3ou7C-6g0cA:
undetectable		 3ou7C-6g0cA:
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 3ou7C-6gu8A:
undetectable		 3ou7C-6gu8A:
undetectable