SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '415'


List of Similar Pattern of Amino Acids

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 on the DrReposER ID to view details on interfaces and similar patterns of amino acids)
(Click on the view link on the last column to view superposed patterns of amino acids)
Filter list by:
DrReposER ID / Desc. Hit
PDBID		 Hit
Macromolecule		 Res.
Matches		 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.
1AV2_A_DVAA6_0
(GRAMICIDIN A)		 4fom POLIOVIRUS
RECEPTOR-RELATED
PROTEIN 3
(Homo
sapiens) 		3 / 3 ALA A  68
VAL A 168
TRP A  70
 None
NAG  A 415 ( 4.6A)
NAG  A 415 ( 4.1A)
 0.96A 1av2A-4fomA:
undetectable
1av2B-4fomA:
undetectable		 1av2A-4fomA:
4.86
1av2B-4fomA:
4.86
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1CET_A_CLQA1001_0
(PROTEIN (L-LACTATE
DEHYDROGENASE))		 4q3n MGS-M5
(unidentified) 		6 / 9 VAL A   9
GLY A  10
ASP A  35
ILE A  36
TYR A  66
ALA A  79
 None
CL  A 402 ( 4.1A)
None
None
GOL  A 415 (-4.5A)
None
 0.78A 1cetA-4q3nA:
41.7		 1cetA-4q3nA:
32.73
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.
1EI6_A_PPFA410_1
(PHOSPHONOACETATE
HYDROLASE)		 2zkt 2,3-BISPHOSPHOGLYCER
ATE-INDEPENDENT
PHOSPHOGLYCERATE
MUTASE
(Pyrococcus
horikoshii) 		4 / 5 ASP A 305
HIS A 309
HIS A 347
HIS A 356
 ZN  A 415 (-2.3A)
ZN  A 415 (-3.5A)
ZN  A 414 (-3.5A)
ZN  A 415 (-3.5A)
 0.48A 1ei6A-2zktA:
17.6		 1ei6A-2zktA:
23.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1EI6_C_PPFC413_1
(PHOSPHONOACETATE
HYDROLASE)		 2zkt 2,3-BISPHOSPHOGLYCER
ATE-INDEPENDENT
PHOSPHOGLYCERATE
MUTASE
(Pyrococcus
horikoshii) 		5 / 8 ASP A  13
ASP A 305
HIS A 309
HIS A 347
HIS A 356
 ZN  A 414 (-2.2A)
ZN  A 415 (-2.3A)
ZN  A 415 (-3.5A)
ZN  A 414 (-3.5A)
ZN  A 415 (-3.5A)
 0.53A 1ei6C-2zktA:
17.5		 1ei6C-2zktA:
23.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ERR_A_RALA600_2
(ESTROGEN RECEPTOR)		 2xa2 TREHALOSE-SYNTHASE
TRET
(Pyrococcus
horikoshii) 		4 / 6 LEU A 169
HIS A  92
LEU A  59
LEU A  62
 None
UPG  A1415 (-4.6A)
None
None
 0.94A 1errA-2xa2A:
undetectable		 1errA-2xa2A:
20.33
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.
1IOL_A_ESTA400_1
(ESTROGENIC 17-BETA
HYDROXYSTEROID
DEHYDROGENASE)		 4aq4 SN-GLYCEROL-3-PHOSPH
ATE-BINDING
PERIPLASMIC PROTEIN
UGPB
(Escherichia
coli) 		5 / 11 SER A 247
GLY A 249
LEU A  14
GLY A 284
HIS A   8
 G3P  A1415 (-2.5A)
None
GOL  A1416 (-4.6A)
G3P  A1415 (-3.4A)
None
 1.37A 1iolA-4aq4A:
undetectable		 1iolA-4aq4A:
22.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MEH_A_MOAA600_1
(INOSINE-5'-MONOPHOSP
HATE DEHYDROGENASE)		 2ok8 PUTATIVE
FERREDOXIN--NADP
REDUCTASE
(Plasmodium
falciparum) 		5 / 10 SER A 106
SER A 183
ILE A 182
GLU A  50
GLY A  51
 None
FAD  A 415 ( 4.3A)
None
None
None
 1.18A 1mehA-2ok8A:
undetectable		 1mehA-2ok8A:
20.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MT1_C_AG2C7004_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE BETA
CHAIN
PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE ALPHA
CHAIN)		 2nsa TRIGGER FACTOR
(Thermotoga
maritima) 		4 / 6 ALA A 391
LEU A 384
GLU A 359
LEU A 363
 SO4  A 415 (-3.8A)
None
SO4  A 415 (-3.0A)
None
 0.84A 1mt1D-2nsaA:
undetectable
1mt1E-2nsaA:
undetectable		 1mt1D-2nsaA:
22.22
1mt1E-2nsaA:
14.71
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.
1N4F_A_ASRA141_0
(LYSOZYME C)		 4aq4 SN-GLYCEROL-3-PHOSPH
ATE-BINDING
PERIPLASMIC PROTEIN
UGPB
(Escherichia
coli) 		4 / 6 GLY A 283
THR A 122
PRO A 123
SER A 248
 G3P  A1415 (-3.0A)
None
None
None
 0.72A 1n4fA-4aq4A:
undetectable		 1n4fA-4aq4A:
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.
1NV8_A_SAMA300_0
(HEMK PROTEIN)		 5u4t PUTATIVE GENTAMICIN
METHYLTRANSFERASE
(Micromonospora
echinospora) 		5 / 12 GLY A 131
GLY A 133
VAL A 153
ASN A 194
PRO A 196
 SAH  A 414 (-3.0A)
SAH  A 414 (-2.8A)
SAH  A 414 (-4.2A)
TRS  A 415 ( 2.3A)
SAH  A 414 ( 3.2A)
 0.45A 1nv8A-5u4tA:
15.3		 1nv8A-5u4tA:
25.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1OPJ_B_STIB4_2
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE ABL1)		 2nsa TRIGGER FACTOR
(Thermotoga
maritima) 		4 / 6 LEU A 384
VAL A 397
ILE A 392
ARG A 338
 None
None
SO4  A 415 (-4.7A)
None
 1.12A 1opjB-2nsaA:
undetectable		 1opjB-2nsaA:
22.60
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.
1PG2_A_ADNA552_1
(METHIONYL-TRNA
SYNTHETASE)		 5k0t METHIONINE--TRNA
LIGASE
(Brucella
suis) 		8 / 11 ALA A  11
GLY A  22
HIS A  23
GLU A  26
GLY A 262
ASP A 264
ILE A 265
HIS A 291
 415  A 601 ( 4.0A)
None
None
None
None
None
415  A 601 ( 4.0A)
None
 0.44A 1pg2A-5k0tA:
40.6		 1pg2A-5k0tA:
28.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1QAO_A_SAMA245_0
(ERMC'
METHYLTRANSFERASE)		 5u4t PUTATIVE GENTAMICIN
METHYLTRANSFERASE
(Micromonospora
echinospora) 		6 / 12 GLY A 131
GLY A 133
ASP A 179
ASN A 194
PRO A 196
ILE A 214
 SAH  A 414 (-3.0A)
SAH  A 414 (-2.8A)
SAH  A 414 (-2.9A)
TRS  A 415 ( 2.3A)
SAH  A 414 ( 3.2A)
IOD  A 409 (-4.2A)
 0.75A 1qaoA-5u4tA:
10.2		 1qaoA-5u4tA:
17.63
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.
1W5U_A_DVAA6_0
(GRAMICIDIN D)		 4fom POLIOVIRUS
RECEPTOR-RELATED
PROTEIN 3
(Homo
sapiens) 		3 / 3 ALA A  68
VAL A 168
TRP A  70
 None
NAG  A 415 ( 4.6A)
NAG  A 415 ( 4.1A)
 0.95A 1w5uA-4fomA:
undetectable
1w5uB-4fomA:
undetectable		 1w5uA-4fomA:
4.86
1w5uB-4fomA:
4.86
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.
1W5U_B_DVAB6_0
(GRAMICIDIN D)		 4fom POLIOVIRUS
RECEPTOR-RELATED
PROTEIN 3
(Homo
sapiens) 		3 / 3 TRP A  70
ALA A  68
VAL A 168
 NAG  A 415 ( 4.1A)
None
NAG  A 415 ( 4.6A)
 0.93A 1w5uA-4fomA:
undetectable
1w5uB-4fomA:
undetectable		 1w5uA-4fomA:
4.86
1w5uB-4fomA:
4.86
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.
1YMX_A_CFXA1001_2
(BETA-LACTAMASE
CTX-M-9)		 2rc5 FERREDOXIN-NADP
REDUCTASE
(Leptospira
interrogans) 		4 / 5 TYR A  96
PRO A 179
THR A 150
SER A 153
 FAD  A 415 (-4.0A)
None
None
None
 1.33A 1ymxA-2rc5A:
undetectable		 1ymxA-2rc5A:
21.05
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.
1ZQ9_A_SAMA4000_0
(PROBABLE
DIMETHYLADENOSINE
TRANSFERASE)		 2xa2 TREHALOSE-SYNTHASE
TRET
(Pyrococcus
horikoshii) 		5 / 12 HIS A 155
ILE A 156
LEU A 169
VAL A 114
ILE A  78
 None
UPG  A1415 (-4.3A)
None
None
None
 1.01A 1zq9A-2xa2A:
4.0		 1zq9A-2xa2A:
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.
2C12_C_SPMC1434_1
(NITROALKANE OXIDASE)		 4b0n POLYKETIDE SYNTHASE
III
(Ectocarpus
siliculosus) 		5 / 12 LEU A 125
VAL A 133
ALA A 132
LEU A 166
ASP A 171
 None
None
None
MLA  A1415 (-4.1A)
None
 1.15A 2c12C-4b0nA:
undetectable		 2c12C-4b0nA:
22.69
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.
2DRD_A_MIYA2001_1
(ACRB)		 2xa2 TREHALOSE-SYNTHASE
TRET
(Pyrococcus
horikoshii) 		5 / 9 GLN A 236
GLU A 334
ILE A 350
ALA A 326
VAL A 347
 None
UPG  A1415 (-3.0A)
None
None
None
 1.28A 2drdA-2xa2A:
undetectable		 2drdA-2xa2A:
15.83
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.
2HKK_A_ALEA300_1
(CARBONIC ANHYDRASE 2)		 4ikn AP-3 COMPLEX SUBUNIT
MU-1
(Rattus
norvegicus) 		4 / 6 HIS A 313
ASN A 374
ILE A 190
GLN A 415
 HIS  A 313 ( 1.0A)
ASN  A 374 ( 0.6A)
ILE  A 190 ( 0.7A)
GLN  A 415 ( 0.6A)
 1.16A 2hkkA-4iknA:
undetectable		 2hkkA-4iknA:
22.55
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.
2IZQ_A_DVAA6_0
(GRAMICIDIN D)		 4fom POLIOVIRUS
RECEPTOR-RELATED
PROTEIN 3
(Homo
sapiens) 		3 / 3 ALA A  68
VAL A 168
TRP A  70
 None
NAG  A 415 ( 4.6A)
NAG  A 415 ( 4.1A)
 0.99A 2izqA-4fomA:
undetectable
2izqB-4fomA:
undetectable		 2izqA-4fomA:
4.86
2izqB-4fomA:
4.86
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.
2IZQ_D_DVAD6_0
(GRAMICIDIN D)		 4fom POLIOVIRUS
RECEPTOR-RELATED
PROTEIN 3
(Homo
sapiens) 		3 / 3 TRP A  70
ALA A  68
VAL A 168
 NAG  A 415 ( 4.1A)
None
NAG  A 415 ( 4.6A)
 0.83A 2izqC-4fomA:
undetectable
2izqD-4fomA:
undetectable		 2izqC-4fomA:
4.86
2izqD-4fomA:
4.86
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.
2NXE_B_SAMB303_0
(RIBOSOMAL PROTEIN
L11
METHYLTRANSFERASE)		 5u4t PUTATIVE GENTAMICIN
METHYLTRANSFERASE
(Micromonospora
echinospora) 		5 / 12 ASP A 129
GLY A 131
GLY A 133
LEU A 137
ASN A 194
 SAH  A 414 ( 3.7A)
SAH  A 414 (-3.0A)
SAH  A 414 (-2.8A)
SAH  A 414 ( 3.7A)
TRS  A 415 ( 2.3A)
 0.20A 2nxeB-5u4tA:
13.1		 2nxeB-5u4tA:
25.23
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.
2OXT_C_SAMC300_1
(NUCLEOSIDE-2'-O-METH
YLTRANSFERASE)		 1kc8 RIBOSOMAL PROTEIN
L18
(Haloarcula
marismortui) 		4 / 4 SER O  29
GLY O  30
HIS O 131
ASP O 124
 A  A2415 ( 3.7A)
None
None
None
 1.37A 2oxtC-1kc8O:
undetectable		 2oxtC-1kc8O:
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.
2V57_A_PRLA1188_0
(TETR FAMILY
TRANSCRIPTIONAL
REPRESSOR LFRR)		 2x0f WSAF
(Geobacillus
stearothermophil
us) 		4 / 8 SER A 202
ASN A 201
ASP A 171
ARG A 254
 None
None
None
GOL  A1415 (-4.0A)
 1.01A 2v57A-2x0fA:
undetectable		 2v57A-2x0fA:
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.
2V57_C_PRLC1187_0
(TETR FAMILY
TRANSCRIPTIONAL
REPRESSOR LFRR)		 2x0f WSAF
(Geobacillus
stearothermophil
us) 		4 / 8 SER A 202
ASN A 201
ASP A 171
ARG A 254
 None
None
None
GOL  A1415 (-4.0A)
 1.01A 2v57C-2x0fA:
undetectable		 2v57C-2x0fA:
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.
2W98_B_P1ZB1357_1
(PROSTAGLANDIN
REDUCTASE 2)		 4arv PHYTASE
(Yersinia
kristensenii) 		4 / 6 LYS A 261
LEU A 323
ASN A 329
ASP A 307
 None
None
None
PO4  A1415 (-2.8A)
 1.36A 2w98A-4arvA:
undetectable
2w98B-4arvA:
undetectable		 2w98A-4arvA:
22.57
2w98B-4arvA:
22.57
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2X1L_A_ADNA601_1
(METHIONYL-TRNA
SYNTHETASE)		 5k0t METHIONINE--TRNA
LIGASE
(Brucella
suis) 		9 / 11 ALA A  11
ALA A  13
GLY A  22
HIS A  23
GLU A  26
GLY A 262
ASP A 264
ILE A 265
HIS A 291
 415  A 601 ( 4.0A)
None
None
None
None
None
None
415  A 601 ( 4.0A)
None
 0.44A 2x1lA-5k0tA:
50.4		 2x1lA-5k0tA:
61.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2X1L_B_ADNB601_1
(METHIONYL-TRNA
SYNTHETASE)		 5k0t METHIONINE--TRNA
LIGASE
(Brucella
suis) 		10 / 12 ALA A  11
ALA A  13
GLY A  22
HIS A  23
GLU A  26
GLY A 262
ASP A 264
ILE A 265
HIS A 291
LEU A 294
 415  A 601 ( 4.0A)
None
None
None
None
None
None
415  A 601 ( 4.0A)
None
None
 0.54A 2x1lB-5k0tA:
53.8		 2x1lB-5k0tA:
61.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2X1L_C_ADNC601_1
(METHIONYL-TRNA
SYNTHETASE)		 5k0t METHIONINE--TRNA
LIGASE
(Brucella
suis) 		9 / 11 ALA A  11
ALA A  13
GLY A  22
HIS A  23
GLU A  26
GLY A 262
ASP A 264
ILE A 265
HIS A 291
 415  A 601 ( 4.0A)
None
None
None
None
None
None
415  A 601 ( 4.0A)
None
 0.35A 2x1lC-5k0tA:
53.5		 2x1lC-5k0tA:
61.44
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.
2X9G_A_LYAA1270_2
(PTERIDINE REDUCTASE)		 3qt4 CATHEPSIN-L-LIKE
MIDGUT CYSTEINE
PROTEINASE
(Tenebrio
molitor) 		3 / 3 MET A  59
VAL A  53
GLU A  43
 PG4  A 415 (-4.6A)
None
None
 0.88A 2x9gA-3qt4A:
undetectable		 2x9gA-3qt4A:
20.35
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.
2XF3_A_J01A500_1
(ORF12)		 4d47 LEVANSUCRASE
(Erwinia
amylovora) 		5 / 10 VAL A 179
LEU A  69
LEU A 146
GLY A 133
ALA A 132
 None
None
None
None
FRU  A1415 ( 4.7A)
 1.26A 2xf3A-4d47A:
1.9		 2xf3A-4d47A:
22.24
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.
2XKW_B_P1BB1475_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 2rc5 FERREDOXIN-NADP
REDUCTASE
(Leptospira
interrogans) 		5 / 12 ILE A 283
GLU A 304
SER A  97
ALA A 178
ILE A 271
 None
None
FAD  A 415 (-3.1A)
FAD  A 415 ( 3.9A)
None
 1.20A 2xkwB-2rc5A:
undetectable		 2xkwB-2rc5A:
20.31
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.
2YFB_A_ACTA501_0
(METHYL-ACCEPTING
CHEMOTAXIS
TRANSDUCER)		 2iv0 ISOCITRATE
DEHYDROGENASE
(Archaeoglobus
fulgidus) 		4 / 7 ASP A 305
VAL A 127
ARG A 125
ILE A 147
 ZN  A1415 (-2.5A)
None
None
None
 0.81A 2yfbA-2iv0A:
undetectable		 2yfbA-2iv0A:
19.90
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.
2YFB_B_ACTB501_0
(METHYL-ACCEPTING
CHEMOTAXIS
TRANSDUCER)		 2iv0 ISOCITRATE
DEHYDROGENASE
(Archaeoglobus
fulgidus) 		4 / 6 ASP A 305
VAL A 127
ARG A 125
ILE A 147
 ZN  A1415 (-2.5A)
None
None
None
 0.87A 2yfbB-2iv0A:
undetectable		 2yfbB-2iv0A:
19.90
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.
2ZIF_A_SAMA298_0
(PUTATIVE
MODIFICATION
METHYLASE)		 5ex8 CYTOCHROME P450
(Streptomyces
toyocaensis) 		5 / 12 PHE A 186
PHE A 228
GLY A 224
THR A 223
LEU A  85
 None
EDO  A 402 (-4.2A)
EDO  A 415 (-3.7A)
EDO  A 415 ( 4.3A)
HEM  A 401 (-3.9A)
 1.24A 2zifA-5ex8A:
undetectable		 2zifA-5ex8A:
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.
2ZIF_B_SAMB298_0
(PUTATIVE
MODIFICATION
METHYLASE)		 5ex8 CYTOCHROME P450
(Streptomyces
toyocaensis) 		5 / 12 PHE A 186
PHE A 228
GLY A 224
THR A 223
LEU A  85
 None
EDO  A 402 (-4.2A)
EDO  A 415 (-3.7A)
EDO  A 415 ( 4.3A)
HEM  A 401 (-3.9A)
 1.20A 2zifB-5ex8A:
undetectable		 2zifB-5ex8A:
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.
2ZJ0_A_2FAA500_1
(ADENOSYLHOMOCYSTEINA
SE)		 4arv PHYTASE
(Yersinia
kristensenii) 		5 / 12 LEU A 224
ASP A 328
GLU A 221
GLY A  19
HIS A  18
 None
None
None
None
PO4  A1415 (-3.9A)
 1.44A 2zj0A-4arvA:
undetectable		 2zj0A-4arvA:
23.12
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.
2ZUL_A_SAMA376_0
(PROBABLE RIBOSOMAL
RNA SMALL SUBUNIT
METHYLTRANSFERASE)		 5u4t PUTATIVE GENTAMICIN
METHYLTRANSFERASE
(Micromonospora
echinospora) 		5 / 12 GLY A 131
GLY A 133
LEU A 137
ASN A 194
PRO A 196
 SAH  A 414 (-3.0A)
SAH  A 414 (-2.8A)
SAH  A 414 ( 3.7A)
TRS  A 415 ( 2.3A)
SAH  A 414 ( 3.2A)
 0.43A 2zulA-5u4tA:
14.9		 2zulA-5u4tA:
25.55
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.
3CE6_A_ADNA500_1
(ADENOSYLHOMOCYSTEINA
SE)		 4arv PHYTASE
(Yersinia
kristensenii) 		5 / 12 LEU A 224
ASP A 328
GLU A 221
GLY A  19
HIS A  18
 None
None
None
None
PO4  A1415 (-3.9A)
 1.46A 3ce6A-4arvA:
undetectable		 3ce6A-4arvA:
22.79
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.
3CE6_C_ADNC500_1
(ADENOSYLHOMOCYSTEINA
SE)		 4arv PHYTASE
(Yersinia
kristensenii) 		5 / 12 LEU A 224
ASP A 328
GLU A 221
GLY A  19
HIS A  18
 None
None
None
None
PO4  A1415 (-3.9A)
 1.47A 3ce6C-4arvA:
undetectable		 3ce6C-4arvA:
22.79
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.
3CJT_G_SAMG302_0
(RIBOSOMAL PROTEIN
L11
METHYLTRANSFERASE)		 5u4t PUTATIVE GENTAMICIN
METHYLTRANSFERASE
(Micromonospora
echinospora) 		6 / 12 GLY A 131
GLY A 133
SER A 134
VAL A 136
LEU A 137
ASN A 194
 SAH  A 414 (-3.0A)
SAH  A 414 (-2.8A)
SAH  A 414 ( 4.4A)
None
SAH  A 414 ( 3.7A)
TRS  A 415 ( 2.3A)
 0.27A 3cjtG-5u4tA:
12.3		 3cjtG-5u4tA:
25.23
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.
3CJT_K_SAMK302_0
(RIBOSOMAL PROTEIN
L11
METHYLTRANSFERASE)		 5u4t PUTATIVE GENTAMICIN
METHYLTRANSFERASE
(Micromonospora
echinospora) 		5 / 12 GLY A 131
SER A 134
VAL A 136
LEU A 137
ASN A 194
 SAH  A 414 (-3.0A)
SAH  A 414 ( 4.4A)
None
SAH  A 414 ( 3.7A)
TRS  A 415 ( 2.3A)
 0.22A 3cjtK-5u4tA:
12.4		 3cjtK-5u4tA:
25.23
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.
3DMF_A_SAMA388_0
(PROBABLE RIBOSOMAL
RNA SMALL SUBUNIT
METHYLTRANSFERASE)		 5u4t PUTATIVE GENTAMICIN
METHYLTRANSFERASE
(Micromonospora
echinospora) 		5 / 12 GLY A 131
GLY A 133
ASP A 179
ASN A 194
PRO A 196
 SAH  A 414 (-3.0A)
SAH  A 414 (-2.8A)
SAH  A 414 (-2.9A)
TRS  A 415 ( 2.3A)
SAH  A 414 ( 3.2A)
 0.42A 3dmfA-5u4tA:
14.9		 3dmfA-5u4tA:
25.55
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.
3DMH_A_SAMA384_0
(PROBABLE RIBOSOMAL
RNA SMALL SUBUNIT
METHYLTRANSFERASE)		 5u4t PUTATIVE GENTAMICIN
METHYLTRANSFERASE
(Micromonospora
echinospora) 		5 / 12 GLY A 131
GLY A 133
LEU A 137
ASN A 194
PRO A 196
 SAH  A 414 (-3.0A)
SAH  A 414 (-2.8A)
SAH  A 414 ( 3.7A)
TRS  A 415 ( 2.3A)
SAH  A 414 ( 3.2A)
 0.40A 3dmhA-5u4tA:
15.0		 3dmhA-5u4tA:
25.55
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.
3GRV_A_ADNA300_1
(DIMETHYLADENOSINE
TRANSFERASE)		 5u4t PUTATIVE GENTAMICIN
METHYLTRANSFERASE
(Micromonospora
echinospora) 		5 / 11 GLY A 131
GLY A 133
ASN A 194
PRO A 196
ILE A 214
 SAH  A 414 (-3.0A)
SAH  A 414 (-2.8A)
TRS  A 415 ( 2.3A)
SAH  A 414 ( 3.2A)
IOD  A 409 (-4.2A)
 0.73A 3grvA-5u4tA:
10.2		 3grvA-5u4tA:
21.25
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.
3KEE_B_30BB500_1
(GENOME POLYPROTEIN)		 4q1q ADHESIN/INVASIN TIBA
AUTOTRANSPORTER
(Escherichia
coli) 		5 / 12 GLY A 304
VAL A 225
GLY A 265
ALA A 268
ALA A 249
 289  A 435 ( 4.8A)
None
289  A 415 ( 3.7A)
None
None
 1.11A 3keeB-4q1qA:
undetectable		 3keeB-4q1qA:
23.68
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.
3KEE_C_30BC500_1
(GENOME POLYPROTEIN)		 4q1q ADHESIN/INVASIN TIBA
AUTOTRANSPORTER
(Escherichia
coli) 		5 / 12 GLY A 304
VAL A 225
GLY A 265
ALA A 268
ALA A 249
 289  A 435 ( 4.8A)
None
289  A 415 ( 3.7A)
None
None
 1.09A 3keeC-4q1qA:
undetectable		 3keeC-4q1qA:
23.68
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.
3KO0_D_TFPD201_1
(PROTEIN S100-A4)		 2rc5 FERREDOXIN-NADP
REDUCTASE
(Leptospira
interrogans) 		4 / 8 GLY A 176
CYH A 134
MET A 138
CYH A 139
 None
FAD  A 415 (-4.9A)
None
None
 0.70A 3ko0D-2rc5A:
undetectable
3ko0E-2rc5A:
undetectable		 3ko0D-2rc5A:
16.09
3ko0E-2rc5A:
16.09
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.
3KO0_D_TFPD201_1
(PROTEIN S100-A4)		 2rc5 FERREDOXIN-NADP
REDUCTASE
(Leptospira
interrogans) 		4 / 8 GLY A 273
CYH A 134
MET A 138
CYH A 139
 None
FAD  A 415 (-4.9A)
None
None
 0.89A 3ko0D-2rc5A:
undetectable
3ko0E-2rc5A:
undetectable		 3ko0D-2rc5A:
16.09
3ko0E-2rc5A:
16.09
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.
3KO0_J_TFPJ201_1
(PROTEIN S100-A4)		 2rc5 FERREDOXIN-NADP
REDUCTASE
(Leptospira
interrogans) 		4 / 8 GLY A 176
CYH A 134
MET A 138
CYH A 139
 None
FAD  A 415 (-4.9A)
None
None
 0.79A 3ko0B-2rc5A:
undetectable
3ko0J-2rc5A:
undetectable		 3ko0B-2rc5A:
16.09
3ko0J-2rc5A:
16.09
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.
3KO0_J_TFPJ201_1
(PROTEIN S100-A4)		 2rc5 FERREDOXIN-NADP
REDUCTASE
(Leptospira
interrogans) 		4 / 8 GLY A 273
CYH A 134
MET A 138
CYH A 139
 None
FAD  A 415 (-4.9A)
None
None
 0.87A 3ko0B-2rc5A:
undetectable
3ko0J-2rc5A:
undetectable		 3ko0B-2rc5A:
16.09
3ko0J-2rc5A:
16.09
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.
3L8L_B_DVAB6_0
(GRAMICIDIN D)		 4fom POLIOVIRUS
RECEPTOR-RELATED
PROTEIN 3
(Homo
sapiens) 		3 / 3 TRP A  70
ALA A  68
VAL A 168
 NAG  A 415 ( 4.1A)
None
NAG  A 415 ( 4.6A)
 0.96A 3l8lA-4fomA:
undetectable
3l8lB-4fomA:
undetectable		 3l8lA-4fomA:
4.86
3l8lB-4fomA:
4.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3L8L_D_DVAD6_0
(GRAMICIDIN D)		 4fom POLIOVIRUS
RECEPTOR-RELATED
PROTEIN 3
(Homo
sapiens) 		3 / 3 TRP A  70
ALA A  68
VAL A 168
 NAG  A 415 ( 4.1A)
None
NAG  A 415 ( 4.6A)
 0.85A 3l8lC-4fomA:
undetectable
3l8lD-4fomA:
undetectable		 3l8lC-4fomA:
4.86
3l8lD-4fomA:
4.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3LSL_A_PZIA801_0
(GLUTAMATE RECEPTOR 2)		 4b0n POLYKETIDE SYNTHASE
III
(Ectocarpus
siliculosus) 		4 / 8 SER A 162
GLY A 190
SER A 367
ASN A 199
 None
MLA  A1415 ( 3.5A)
None
None
 0.97A 3lslA-4b0nA:
undetectable
3lslD-4b0nA:
undetectable		 3lslA-4b0nA:
20.72
3lslD-4b0nA:
20.72
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.
3MBG_C_ACTC800_0
(FAD-LINKED
SULFHYDRYL OXIDASE
ALR)		 2iy8 PROTEIN PM0188
(Pasteurella
multocida) 		3 / 3 ASP A  33
ARG A  63
ALA A  39
 None
CSF  A1415 ( 3.1A)
None
 0.73A 3mbgC-2iy8A:
undetectable		 3mbgC-2iy8A:
16.36
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.
3MDV_B_CL6B506_1
(CHOLESTEROL
24-HYDROXYLASE)		 2rc5 FERREDOXIN-NADP
REDUCTASE
(Leptospira
interrogans) 		5 / 12 LEU A  32
LEU A 217
THR A 175
ILE A 177
ALA A 178
 None
None
FAD  A 415 (-3.4A)
None
FAD  A 415 ( 3.9A)
 0.55A 3mdvB-2rc5A:
undetectable		 3mdvB-2rc5A:
21.26
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.
3N23_C_OBNC1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)		 4b0n POLYKETIDE SYNTHASE
III
(Ectocarpus
siliculosus) 		5 / 11 ASP A 171
LEU A 174
VAL A 136
ALA A 132
PHE A 165
 None
None
None
None
MLA  A1415 (-4.3A)
 1.14A 3n23C-4b0nA:
undetectable		 3n23C-4b0nA:
17.67
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.
3NS1_L_PM6L1_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)		 3nfv ALGINATE LYASE
(Bacteroides
ovatus) 		4 / 8 THR A 321
LEU A 273
ALA A 331
ALA A 330
 EDO  A 415 (-4.9A)
None
None
EDO  A 405 ( 3.7A)
 0.86A 3ns1L-3nfvA:
undetectable		 3ns1L-3nfvA:
19.29
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.
3OHT_A_1N1A1000_2
(P38A)		 1jed SULFATE
ADENYLYLTRANSFERASE
(Saccharomyces
cerevisiae) 		3 / 3 GLU A 128
LEU A 145
LEU A 227
 None
None
TRS  A1415 ( 4.6A)
 0.78A 3ohtA-1jedA:
undetectable		 3ohtA-1jedA:
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.
3OHT_B_1N1B1000_2
(P38A)		 1jed SULFATE
ADENYLYLTRANSFERASE
(Saccharomyces
cerevisiae) 		3 / 3 GLU A 128
LEU A 145
LEU A 227
 None
None
TRS  A1415 ( 4.6A)
 0.74A 3ohtB-1jedA:
undetectable		 3ohtB-1jedA:
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.
3OI8_A_ADNA2_1
(UNCHARACTERIZED
PROTEIN)		 2zkt 2,3-BISPHOSPHOGLYCER
ATE-INDEPENDENT
PHOSPHOGLYCERATE
MUTASE
(Pyrococcus
horikoshii) 		4 / 6 ASN A 355
HIS A 309
PRO A 350
ASP A  13
 None
ZN  A 415 (-3.5A)
None
ZN  A 414 (-2.2A)
 0.91A 3oi8A-2zktA:
undetectable		 3oi8A-2zktA:
18.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3OI8_A_ADNA2_1
(UNCHARACTERIZED
PROTEIN)		 2zkt 2,3-BISPHOSPHOGLYCER
ATE-INDEPENDENT
PHOSPHOGLYCERATE
MUTASE
(Pyrococcus
horikoshii) 		4 / 6 ASN A 355
HIS A 309
PRO A 350
ASP A 346
 None
ZN  A 415 (-3.5A)
None
ZN  A 414 (-2.8A)
 1.07A 3oi8A-2zktA:
undetectable		 3oi8A-2zktA:
18.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ONN_A_ACTA270_0
(PROTEIN SSM1)		 4arv PHYTASE
(Yersinia
kristensenii) 		4 / 5 LEU A 224
ARG A  17
LEU A 249
PRO A 327
 None
PO4  A1415 (-4.0A)
None
None
 1.36A 3onnA-4arvA:
undetectable		 3onnA-4arvA:
20.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3P2K_A_SAMA6735_0
(16S RRNA METHYLASE)		 5u4t PUTATIVE GENTAMICIN
METHYLTRANSFERASE
(Micromonospora
echinospora) 		6 / 12 GLY A 135
GLY A 133
ASN A 194
ALA A 165
LEU A 137
THR A 174
 None
SAH  A 414 (-2.8A)
TRS  A 415 ( 2.3A)
None
SAH  A 414 ( 3.7A)
IOD  A 405 ( 4.3A)
 1.42A 3p2kA-5u4tA:
7.4		 3p2kA-5u4tA:
20.94
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.
3P2K_B_SAMB6735_0
(16S RRNA METHYLASE)		 5u4t PUTATIVE GENTAMICIN
METHYLTRANSFERASE
(Micromonospora
echinospora) 		6 / 12 GLY A 135
GLY A 133
ASN A 194
ALA A 165
LEU A 137
THR A 174
 None
SAH  A 414 (-2.8A)
TRS  A 415 ( 2.3A)
None
SAH  A 414 ( 3.7A)
IOD  A 405 ( 4.3A)
 1.44A 3p2kB-5u4tA:
7.4		 3p2kB-5u4tA:
20.94
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.
3Q87_B_SAMB300_0
(N6 ADENINE SPECIFIC
DNA METHYLASE)		 5u4t PUTATIVE GENTAMICIN
METHYLTRANSFERASE
(Micromonospora
echinospora) 		6 / 12 GLY A 131
ASP A 152
ASN A 154
ASP A 179
ASN A 194
PRO A 196
 SAH  A 414 (-3.0A)
SAH  A 414 (-2.1A)
None
SAH  A 414 (-2.9A)
TRS  A 415 ( 2.3A)
SAH  A 414 ( 3.2A)
 0.52A 3q87B-5u4tA:
13.2		 3q87B-5u4tA:
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.
3TL9_A_ROCA401_4
(PROTEASE)		 4zpl PROTEIN PCDHB1
(Mus
musculus) 		4 / 4 ASP A 131
ASP A 188
GLY A 196
THR A 143
 CA  A 415 (-2.5A)
CA  A 415 (-3.6A)
None
NAG  A 401 (-4.7A)
 1.38A 3tl9B-4zplA:
undetectable		 3tl9B-4zplA:
14.52
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.
3U9H_A_NCAA1163_0
(TANKYRASE-2)		 2ok8 PUTATIVE
FERREDOXIN--NADP
REDUCTASE
(Plasmodium
falciparum) 		4 / 8 GLY A 136
LYS A 143
TYR A 135
GLU A  34
 FAD  A 415 (-3.3A)
None
None
None
 0.86A 3u9hA-2ok8A:
undetectable		 3u9hA-2ok8A:
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.
3U9H_A_NCAA1163_0
(TANKYRASE-2)		 2ok8 PUTATIVE
FERREDOXIN--NADP
REDUCTASE
(Plasmodium
falciparum) 		4 / 8 GLY A 136
SER A 139
TYR A 135
GLU A  34
 FAD  A 415 (-3.3A)
FAD  A 415 (-2.6A)
None
None
 0.85A 3u9hA-2ok8A:
undetectable		 3u9hA-2ok8A:
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.
3U9H_B_NCAB1164_0
(TANKYRASE-2)		 2ok8 PUTATIVE
FERREDOXIN--NADP
REDUCTASE
(Plasmodium
falciparum) 		4 / 8 GLY A 136
LYS A 143
TYR A 135
GLU A  34
 FAD  A 415 (-3.3A)
None
None
None
 0.89A 3u9hB-2ok8A:
undetectable		 3u9hB-2ok8A:
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.
3U9H_B_NCAB1164_0
(TANKYRASE-2)		 2ok8 PUTATIVE
FERREDOXIN--NADP
REDUCTASE
(Plasmodium
falciparum) 		4 / 8 GLY A 136
SER A 139
TYR A 135
GLU A  34
 FAD  A 415 (-3.3A)
FAD  A 415 (-2.6A)
None
None
 0.85A 3u9hB-2ok8A:
undetectable		 3u9hB-2ok8A:
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.
3V8V_B_SAMB801_0
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE L)		 5u4t PUTATIVE GENTAMICIN
METHYLTRANSFERASE
(Micromonospora
echinospora) 		5 / 11 GLY A 133
ASP A 152
ASP A 179
ASN A 194
PRO A 196
 SAH  A 414 (-2.8A)
SAH  A 414 (-2.1A)
SAH  A 414 (-2.9A)
TRS  A 415 ( 2.3A)
SAH  A 414 ( 3.2A)
 0.64A 3v8vB-5u4tA:
14.4		 3v8vB-5u4tA:
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.
3W67_A_VIVA301_0
(ALPHA-TOCOPHEROL
TRANSFER PROTEIN)		 2py6 METHYLTRANSFERASE
FKBM
(Methylobacillus
flagellatus) 		5 / 11 SER A 239
ILE A 236
VAL A 270
LEU A 267
VAL A 285
 None
None
PEG  A 415 (-4.5A)
None
None
 0.96A 3w67A-2py6A:
0.2		 3w67A-2py6A:
21.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3W68_A_VIVA301_0
(ALPHA-TOCOPHEROL
TRANSFER PROTEIN)		 2py6 METHYLTRANSFERASE
FKBM
(Methylobacillus
flagellatus) 		5 / 12 TYR A 215
ILE A 236
VAL A 270
LEU A 267
VAL A 285
 None
None
PEG  A 415 (-4.5A)
None
None
 1.03A 3w68A-2py6A:
undetectable		 3w68A-2py6A:
21.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3WRK_D_CAMD502_0
(CAMPHOR
5-MONOOXYGENASE)		 4b0n POLYKETIDE SYNTHASE
III
(Ectocarpus
siliculosus) 		4 / 5 PHE A 165
LEU A 284
GLY A 193
VAL A 160
 MLA  A1415 (-4.3A)
ACD  A1416 (-4.3A)
ACD  A1416 ( 4.3A)
None
 1.03A 3wrkD-4b0nA:
undetectable		 3wrkD-4b0nA:
22.47
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.
4BJC_A_RPBA2162_1
(TANKYRASE-2)		 2ok8 PUTATIVE
FERREDOXIN--NADP
REDUCTASE
(Plasmodium
falciparum) 		4 / 8 GLY A 136
SER A 139
TYR A 135
GLU A  34
 FAD  A 415 (-3.3A)
FAD  A 415 (-2.6A)
None
None
 0.86A 4bjcA-2ok8A:
undetectable		 4bjcA-2ok8A:
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.
4DCM_A_SAMA401_0
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE G)		 5u4t PUTATIVE GENTAMICIN
METHYLTRANSFERASE
(Micromonospora
echinospora) 		7 / 11 ALA A 112
ASP A 129
GLY A 131
GLY A 133
ASP A 152
ASN A 194
PRO A 196
 SAH  A 414 ( 4.4A)
SAH  A 414 ( 3.7A)
SAH  A 414 (-3.0A)
SAH  A 414 (-2.8A)
SAH  A 414 (-2.1A)
TRS  A 415 ( 2.3A)
SAH  A 414 ( 3.2A)
 0.61A 4dcmA-5u4tA:
14.7		 4dcmA-5u4tA:
25.55
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.
4FFW_B_715B801_2
(DIPEPTIDYL PEPTIDASE
4)		 4isa UDP-3-O-[3-HYDROXYMY
RISTOYL]
N-ACETYLGLUCOSAMINE
DEACETYLASE
(Escherichia
coli) 		3 / 3 ARG A 237
TYR A 261
ASN A 268
 None
FMT  A 415 (-3.4A)
None
 0.91A 4ffwB-4isaA:
undetectable		 4ffwB-4isaA:
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.
4KR4_C_AICC401_1
(OUTER MEMBRANE
PROTEIN F)		 2jjp CYTOCHROME P450
113A1
(Saccharopolyspor
a
erythraea) 		4 / 8 ARG A 321
ARG A 283
ARG A 336
GLU A 259
 None
None
SO4  A 415 (-3.8A)
None
 1.14A 4kr4C-2jjpA:
undetectable		 4kr4C-2jjpA:
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.
4LB0_A_ACTA401_0
(UNCHARACTERIZED
PROTEIN)		 4aq4 SN-GLYCEROL-3-PHOSPH
ATE-BINDING
PERIPLASMIC PROTEIN
UGPB
(Escherichia
coli) 		5 / 9 SER A 247
GLY A 249
SER A 250
TYR A  42
ASP A 230
 G3P  A1415 (-2.5A)
None
None
GOL  A1416 ( 3.7A)
GOL  A1416 (-2.6A)
 1.47A 4lb0A-4aq4A:
undetectable		 4lb0A-4aq4A:
19.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4MK4_A_CHDA504_0
(FERROCHELATASE,
MITOCHONDRIAL)		 2x0f WSAF
(Geobacillus
stearothermophil
us) 		4 / 8 SER A 251
VAL A 252
VAL A 282
GLY A 301
 None
GOL  A1415 (-3.8A)
TRH  A 416 ( 4.4A)
None
 0.90A 4mk4A-2x0fA:
3.7		 4mk4A-2x0fA:
22.02
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.
4N48_B_SAMB601_1
(CAP-SPECIFIC MRNA
(NUCLEOSIDE-2'-O-)-M
ETHYLTRANSFERASE 1)		 4d47 LEVANSUCRASE
(Erwinia
amylovora) 		4 / 5 ASN A 359
PRO A 358
GLY A 360
ASP A 203
 None
None
None
FRU  A1415 (-2.9A)
 1.11A 4n48B-4d47A:
undetectable		 4n48B-4d47A:
23.52
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.
4NKV_A_AERA601_2
(STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE)		 5u4t PUTATIVE GENTAMICIN
METHYLTRANSFERASE
(Micromonospora
echinospora) 		4 / 5 LEU A 208
ASP A  95
GLU A 111
VAL A 136
 TRS  A 415 (-3.0A)
None
TRS  A 415 (-3.9A)
None
 1.26A 4nkvA-5u4tA:
undetectable		 4nkvA-5u4tA:
21.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4O2B_B_LOCB503_1
(TUBULIN ALPHA-1B
CHAIN
TUBULIN BETA-2B
CHAIN)		 2iy8 PROTEIN PM0188
(Pasteurella
multocida) 		3 / 3 SER A 356
ALA A 354
VAL A 353
 CSF  A1415 (-2.6A)
None
None
 0.49A 4o2bA-2iy8A:
5.3		 4o2bA-2iy8A:
19.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4O2B_D_LOCD503_1
(TUBULIN ALPHA-1B
CHAIN
TUBULIN BETA-2B
CHAIN)		 2iy8 PROTEIN PM0188
(Pasteurella
multocida) 		3 / 3 SER A 356
ALA A 354
VAL A 353
 CSF  A1415 (-2.6A)
None
None
 0.58A 4o2bC-2iy8A:
5.4		 4o2bC-2iy8A:
19.58
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4OKN_B_KANB403_1
(L-LACTATE
DEHYDROGENASE A
CHAIN)		 4q3n MGS-M5
(unidentified) 		5 / 9 ASP A  35
TYR A  66
ALA A  79
ARG A  95
ILE A  99
 None
GOL  A 415 (-4.5A)
None
None
None
 0.83A 4oknB-4q3nA:
42.5		 4oknB-4q3nA:
35.52
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.
4PEV_A_ADNA501_2
(MEMBRANE LIPOPROTEIN
FAMILY PROTEIN)		 3ife PEPTIDASE T
(Bacillus
anthracis) 		3 / 3 PRO A 116
LEU A 122
HIS A  96
 None
None
SO4  A 415 (-3.8A)
 0.72A 4pevA-3ifeA:
undetectable		 4pevA-3ifeA:
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.
4QZT_B_ACTB201_0
(RETINOL-BINDING
PROTEIN 2)		 2py6 METHYLTRANSFERASE
FKBM
(Methylobacillus
flagellatus) 		4 / 5 TYR A 369
TYR A 211
GLU A 238
LEU A 214
 None
None
PEG  A 415 (-4.7A)
None
 1.35A 4qztB-2py6A:
undetectable		 4qztB-2py6A:
14.81
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.
4XI3_D_29SD601_1
(ESTROGEN RECEPTOR)		 3wjp HYDROGENASE
EXPRESSION/FORMATION
PROTEIN HYPE
(Thermococcus
kodakarensis) 		5 / 12 THR A  62
GLU A 141
LEU A  66
HIS A 176
LEU A  76
 QCS  A 338 ( 3.6A)
GOL  A 415 ( 4.5A)
None
None
None
 1.29A 4xi3D-3wjpA:
undetectable		 4xi3D-3wjpA:
23.05
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.
5ALB_L_TIQL1210_1
(MEDI2452 HEAVY CHAIN
MEDI2452 LIGHT CHAIN)		 4d47 LEVANSUCRASE
(Erwinia
amylovora) 		5 / 11 SER A 353
ILE A 303
THR A 302
TYR A 352
LEU A  69
 FRU  A1415 ( 4.7A)
None
None
GLC  A1416 (-4.0A)
None
 1.45A 5albH-4d47A:
0.0		 5albH-4d47A:
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.
5AMK_A_EF2A151_1
(CEREBLON ISOFORM 4)		 5kn7 LIPID A BIOSYNTHESIS
LAUROYL
ACYLTRANSFERASE
(Acinetobacter
baumannii) 		4 / 8 PRO B 121
PHE B 123
TRP B 126
TYR B  79
 None
None
GOL  B 409 (-4.6A)
LMT  B 415 (-3.8A)
 1.32A 5amkA-5kn7B:
undetectable		 5amkA-5kn7B:
17.13
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.
5BS8_G_MFXG101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
DNA SUBSTRATE 24-MER
TTACGTGCATAGTCATTCAT
GACC)		 2atv RAS-LIKE
ESTROGEN-REGULATED
GROWTH INHIBITOR
(Homo
sapiens) 		4 / 7 ALA A 149
ARG A  14
GLY A  13
GLU A  94
 GDP  A 415 (-3.7A)
None
None
None
 0.88A 5bs8A-2atvA:
undetectable
5bs8C-2atvA:
undetectable
5bs8D-2atvA:
3.7		 5bs8A-2atvA:
17.43
5bs8C-2atvA:
17.43
5bs8D-2atvA:
24.06
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.
5BTG_E_LFXE101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
DNA SUBSTRATE 24-MER
GGTCATGAATGACTATGCAC
GTAA)		 2atv RAS-LIKE
ESTROGEN-REGULATED
GROWTH INHIBITOR
(Homo
sapiens) 		4 / 6 ALA A 149
ARG A  14
GLY A  13
GLU A  94
 GDP  A 415 (-3.7A)
None
None
None
 0.88A 5btgA-2atvA:
undetectable
5btgB-2atvA:
4.0
5btgC-2atvA:
undetectable		 5btgA-2atvA:
17.43
5btgB-2atvA:
24.06
5btgC-2atvA:
17.43
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.
5D0X_K_BO2K301_1
(PROTEASOME SUBUNIT
BETA TYPE-5
PROTEASOME SUBUNIT
BETA TYPE-6)		 3r64 NAD DEPENDENT
BENZALDEHYDE
DEHYDROGENASE
(Corynebacterium
glutamicum) 		5 / 9 SER A 412
ALA A 409
ALA A 406
GLY A 415
ALA A 418
 SER  A 412 ( 0.0A)
ALA  A 409 ( 0.0A)
ALA  A 406 ( 0.0A)
GLY  A 415 ( 0.0A)
ALA  A 418 ( 0.0A)
 0.97A 5d0xK-3r64A:
undetectable
5d0xL-3r64A:
undetectable		 5d0xK-3r64A:
17.26
5d0xL-3r64A:
18.73
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.
5D0X_Y_BO2Y301_1
(PROTEASOME SUBUNIT
BETA TYPE-5
PROTEASOME SUBUNIT
BETA TYPE-6)		 3r64 NAD DEPENDENT
BENZALDEHYDE
DEHYDROGENASE
(Corynebacterium
glutamicum) 		5 / 9 SER A 412
ALA A 409
ALA A 406
GLY A 415
ALA A 418
 SER  A 412 ( 0.0A)
ALA  A 409 ( 0.0A)
ALA  A 406 ( 0.0A)
GLY  A 415 ( 0.0A)
ALA  A 418 ( 0.0A)
 0.96A 5d0xY-3r64A:
undetectable
5d0xZ-3r64A:
undetectable		 5d0xY-3r64A:
17.26
5d0xZ-3r64A:
18.73
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.
5EWZ_B_BEZB301_0
(14-3-3 PROTEIN
ZETA/DELTA)		 1eu8 TREHALOSE/MALTOSE
BINDING PROTEIN
(Thermococcus
litoralis) 		3 / 3 MET A 245
GLN A 248
ARG A 243
 PT  A 415 (-3.2A)
None
None
 1.11A 5ewzB-1eu8A:
undetectable		 5ewzB-1eu8A:
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.
5FHR_A_SAMA303_1
(CATECHOL
O-METHYLTRANSFERASE)		 2jjp CYTOCHROME P450
113A1
(Saccharopolyspor
a
erythraea) 		4 / 5 GLU A 280
TYR A 284
SER A 338
ASP A 328
 None
None
SO4  A 415 (-3.3A)
None
 1.45A 5fhrA-2jjpA:
undetectable		 5fhrA-2jjpA:
20.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HP1_C_PPFC601_1
(HIV-1 REVERSE
TRANSCRIPTASE P66
SUBUNIT)		 2zkt 2,3-BISPHOSPHOGLYCER
ATE-INDEPENDENT
PHOSPHOGLYCERATE
MUTASE
(Pyrococcus
horikoshii) 		4 / 6 ASP A  13
GLY A  14
ASP A 346
LYS A 302
 ZN  A 414 (-2.2A)
None
ZN  A 414 (-2.8A)
ZN  A 415 ( 4.5A)
 1.18A 5hp1C-2zktA:
undetectable		 5hp1C-2zktA:
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.
5HWA_A_GCSA302_1
(CHITOSANASE)		 5k0t METHIONINE--TRNA
LIGASE
(Brucella
suis) 		4 / 7 THR A  96
ASP A  51
ASP A 232
GLY A  54
 None
415  A 601 (-3.1A)
415  A 601 ( 4.6A)
415  A 601 (-3.5A)
 0.93A 5hwaA-5k0tA:
undetectable		 5hwaA-5k0tA:
17.69
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.
5IKT_B_TLFB601_0
(PROSTAGLANDIN G/H
SYNTHASE 2)		 5mek CYTOSOLIC
SULFOTRANSFERASE 18
(Arabidopsis
thaliana) 		5 / 12 VAL A 274
ARG A 109
VAL A 254
LEU A 257
LEU A 151
 None
EDO  A 415 ( 3.7A)
None
None
None
 1.20A 5iktB-5mekA:
undetectable		 5iktB-5mekA:
20.79
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.
5JGL_B_SAMB301_1
(UBIE/COQ5 FAMILY
METHYLTRANSFERASE,
PUTATIVE)		 4d47 LEVANSUCRASE
(Erwinia
amylovora) 		3 / 3 ASP A 203
ASN A 200
PHE A 301
 FRU  A1415 (-2.9A)
None
None
 0.76A 5jglB-4d47A:
undetectable		 5jglB-4d47A:
21.28
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.
5LF3_B_BO2B305_1
(PROTEASOME SUBUNIT
BETA TYPE-6)		 2iy8 PROTEIN PM0188
(Pasteurella
multocida) 		5 / 12 THR A 267
THR A 268
THR A 269
SER A 356
MET A 144
 None
None
None
CSF  A1415 (-2.6A)
CSF  A1415 ( 3.8A)
 1.16A 5lf3b-2iy8A:
undetectable		 5lf3b-2iy8A:
17.59
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.
5LF3_N_BO2N304_1
(PROTEASOME SUBUNIT
BETA TYPE-6)		 2iy8 PROTEIN PM0188
(Pasteurella
multocida) 		5 / 12 THR A 267
THR A 268
THR A 269
SER A 356
MET A 144
 None
None
None
CSF  A1415 (-2.6A)
CSF  A1415 ( 3.8A)
 1.17A 5lf3N-2iy8A:
undetectable		 5lf3N-2iy8A:
17.59
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.
5M35_B_BEZB302_0
(14-3-3 PROTEIN
ZETA/DELTA)		 1eu8 TREHALOSE/MALTOSE
BINDING PROTEIN
(Thermococcus
litoralis) 		3 / 3 MET A 245
GLN A 248
ARG A 243
 PT  A 415 (-3.2A)
None
None
 1.05A 5m35B-1eu8A:
0.0		 5m35B-1eu8A:
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.
5M36_A_BEZA303_0
(14-3-3 PROTEIN
ZETA/DELTA)		 1eu8 TREHALOSE/MALTOSE
BINDING PROTEIN
(Thermococcus
litoralis) 		3 / 3 MET A 245
GLN A 248
ARG A 243
 PT  A 415 (-3.2A)
None
None
 1.03A 5m36A-1eu8A:
undetectable		 5m36A-1eu8A:
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.
5MVS_A_ADNA401_1
(HISTONE-LYSINE
N-METHYLTRANSFERASE,
H3 LYSINE-79
SPECIFIC)		 4d47 LEVANSUCRASE
(Erwinia
amylovora) 		4 / 7 GLY A 380
ALA A  71
ASP A  46
PHE A 365
 None
None
FRU  A1415 (-2.9A)
None
 0.98A 5mvsA-4d47A:
undetectable		 5mvsA-4d47A:
22.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5MVS_B_ADNB401_1
(HISTONE-LYSINE
N-METHYLTRANSFERASE,
H3 LYSINE-79
SPECIFIC)		 4d47 LEVANSUCRASE
(Erwinia
amylovora) 		4 / 8 GLY A 380
ALA A  71
ASP A  46
PHE A 365
 None
None
FRU  A1415 (-2.9A)
None
 0.98A 5mvsB-4d47A:
undetectable		 5mvsB-4d47A:
22.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ND2_B_TA1B601_1
(TUBULIN BETA-2B
CHAIN)		 1o75 47 KDA MEMBRANE
ANTIGEN
(Treponema
pallidum) 		5 / 12 VAL A 329
ASP A 328
ALA A 231
ARG A 259
LEU A 317
 None
None
XE  A1415 ( 4.5A)
None
None
 1.23A 5nd2B-1o75A:
undetectable		 5nd2B-1o75A:
21.10
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.
5NOO_C_D16C402_1
(THYMIDYLATE SYNTHASE)		 2iy8 PROTEIN PM0188
(Pasteurella
multocida) 		4 / 6 TYR A 358
ASP A 140
LEU A 200
GLY A 142
 None
None
None
CSF  A1415 (-3.4A)
 1.06A 5nooC-2iy8A:
undetectable		 5nooC-2iy8A:
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.
5VLM_C_CVIC301_1
(REGULATORY PROTEIN
TETR)		 2vbf BRANCHED-CHAIN
ALPHA-KETOACID
DECARBOXYLASE
(Lactococcus
lactis) 		4 / 7 GLN A 415
GLY A 413
ILE A 396
ASP A  57
 GLN  A 415 ( 0.6A)
GLY  A 413 ( 0.0A)
ILE  A 396 ( 0.7A)
ASP  A  57 ( 0.5A)
 1.16A 5vlmC-2vbfA:
undetectable		 5vlmC-2vbfA:
16.81
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.
5VOO_E_C2FE3001_0
(5-METHYLTETRAHYDROFO
LATE HOMOCYSTEINE
S-METHYLTRANSFERASE)		 1sd5 PUTATIVE
ANTITERMINATOR
(Mycobacterium
tuberculosis) 		5 / 12 GLU A 170
ARG A 131
VAL A 195
LEU A 196
GLY A 160
 None
None
IOD  A 415 ( 4.0A)
None
None
 1.17A 5vooE-1sd5A:
2.8		 5vooE-1sd5A:
21.94
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5VW4_A_NCAA403_0
(FERREDOXIN--NADP
REDUCTASE)		 2ok8 PUTATIVE
FERREDOXIN--NADP
REDUCTASE
(Plasmodium
falciparum) 		6 / 9 SER A 104
THR A 180
GLY A 181
CYH A 284
GLY A 285
GLU A 314
 FAD  A 415 (-3.8A)
FAD  A 415 (-3.3A)
None
None
None
FAD  A 415 ( 3.8A)
 0.62A 5vw4A-2ok8A:
30.2		 5vw4A-2ok8A:
32.04
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5VW4_A_NCAA403_0
(FERREDOXIN--NADP
REDUCTASE)		 2rc5 FERREDOXIN-NADP
REDUCTASE
(Leptospira
interrogans) 		7 / 9 SER A  97
THR A 175
GLY A 176
ALA A 178
CYH A 272
GLY A 273
GLU A 312
 FAD  A 415 (-3.1A)
FAD  A 415 (-3.4A)
None
FAD  A 415 ( 3.9A)
None
None
FAD  A 415 (-3.8A)
 0.59A 5vw4A-2rc5A:
35.6		 5vw4A-2rc5A:
37.28
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5VW5_A_NCAA403_0
(FERREDOXIN--NADP
REDUCTASE)		 2ok8 PUTATIVE
FERREDOXIN--NADP
REDUCTASE
(Plasmodium
falciparum) 		4 / 8 SER A 104
CYH A 284
GLY A 285
GLU A 314
 FAD  A 415 (-3.8A)
None
None
FAD  A 415 ( 3.8A)
 0.71A 5vw5A-2ok8A:
30.1		 5vw5A-2ok8A:
32.04
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5VW5_A_NCAA403_0
(FERREDOXIN--NADP
REDUCTASE)		 2ok8 PUTATIVE
FERREDOXIN--NADP
REDUCTASE
(Plasmodium
falciparum) 		5 / 8 SER A 104
THR A 180
GLY A 181
CYH A 284
GLY A 285
 FAD  A 415 (-3.8A)
FAD  A 415 (-3.3A)
None
None
None
 0.42A 5vw5A-2ok8A:
30.1		 5vw5A-2ok8A:
32.04
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5VW5_A_NCAA403_0
(FERREDOXIN--NADP
REDUCTASE)		 2rc5 FERREDOXIN-NADP
REDUCTASE
(Leptospira
interrogans) 		6 / 8 SER A  97
THR A 175
GLY A 176
CYH A 272
GLY A 273
GLU A 312
 FAD  A 415 (-3.1A)
FAD  A 415 (-3.4A)
None
None
None
FAD  A 415 (-3.8A)
 0.65A 5vw5A-2rc5A:
34.9		 5vw5A-2rc5A:
37.28
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5VW9_A_NCAA403_0
(FERREDOXIN--NADP
REDUCTASE)		 2ok8 PUTATIVE
FERREDOXIN--NADP
REDUCTASE
(Plasmodium
falciparum) 		6 / 8 SER A 104
THR A 180
GLY A 181
CYH A 284
GLY A 285
GLU A 314
 FAD  A 415 (-3.8A)
FAD  A 415 (-3.3A)
None
None
None
FAD  A 415 ( 3.8A)
 0.67A 5vw9A-2ok8A:
30.6		 5vw9A-2ok8A:
32.04
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5VW9_A_NCAA403_0
(FERREDOXIN--NADP
REDUCTASE)		 2rc5 FERREDOXIN-NADP
REDUCTASE
(Leptospira
interrogans) 		7 / 8 SER A  97
THR A 175
GLY A 176
ALA A 178
CYH A 272
GLY A 273
GLU A 312
 FAD  A 415 (-3.1A)
FAD  A 415 (-3.4A)
None
FAD  A 415 ( 3.9A)
None
None
FAD  A 415 (-3.8A)
 0.55A 5vw9A-2rc5A:
35.2		 5vw9A-2rc5A:
37.28
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.
5X7P_B_ACRB1431_1
(GLYCOSIDE HYDROLASE
FAMILY 31
ALPHA-GLUCOSIDASE)		 2xa2 TREHALOSE-SYNTHASE
TRET
(Pyrococcus
horikoshii) 		4 / 5 HIS A 273
TRP A 279
GLY A 269
ASN A 300
 None
None
UPG  A1415 (-2.9A)
None
 1.39A 5x7pB-2xa2A:
3.0		 5x7pB-2xa2A:
14.53
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.
5Y7P_G_CHDG401_0
(BILE SALT HYDROLASE)		 1t9h PROBABLE GTPASE ENGC
(Bacillus
subtilis) 		5 / 10 TYR A 137
ILE A 113
PHE A 100
LEU A 101
ALA A  95
 None
None
None
None
CA  A 415 ( 4.4A)
 1.20A 5y7pG-1t9hA:
undetectable		 5y7pG-1t9hA:
25.48
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.
6A4I_A_TRPA403_0
(TRYPTOPHAN
2,3-DIOXYGENASE)		 4ars HISTIDINE ACID
PHOSPHATASE
(Hafnia
alvei) 		4 / 8 TRP A 321
THR A 330
PRO A 331
ILE A 310
 GOL  A1415 ( 3.8A)
GOL  A1415 ( 4.4A)
None
None
 0.84A 6a4iA-4arsA:
undetectable		 6a4iA-4arsA:
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.
6AWT_D_BEZD202_0
(PR 10 PROTEIN)		 2xa2 TREHALOSE-SYNTHASE
TRET
(Pyrococcus
horikoshii) 		3 / 3 PHE A 240
ASP A 241
LYS A 244
 None
None
UPG  A1415 (-3.3A)
 0.88A 6awtD-2xa2A:
undetectable		 6awtD-2xa2A:
16.31
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.
6EW0_F_TA1F502_1
(TUBULIN BETA CHAIN)		 4rq9 PHOTORECEPTOR-HISTID
INE KINASE BPHP
(Stigmatella
aurantiaca) 		5 / 12 ASP A 105
LEU A  84
SER A 126
LEU A 121
LEU A  56
 None
None
GOL  A 415 ( 4.3A)
None
None
 1.18A 6ew0F-4rq9A:
undetectable		 6ew0F-4rq9A:
14.47
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.
6EW0_G_TA1G501_1
(TUBULIN BETA CHAIN)		 4rq9 PHOTORECEPTOR-HISTID
INE KINASE BPHP
(Stigmatella
aurantiaca) 		5 / 12 ASP A 105
LEU A  84
SER A 126
LEU A 121
LEU A  56
 None
None
GOL  A 415 ( 4.3A)
None
None
 1.19A 6ew0G-4rq9A:
undetectable		 6ew0G-4rq9A:
14.47
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.
6FN9_A_BEZA302_0
(14-3-3 PROTEIN
ZETA/DELTA)		 1eu8 TREHALOSE/MALTOSE
BINDING PROTEIN
(Thermococcus
litoralis) 		3 / 3 MET A 245
GLN A 248
ARG A 243
 PT  A 415 (-3.2A)
None
None
 1.09A 6fn9A-1eu8A:
undetectable		 6fn9A-1eu8A:
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.
6FNA_B_BEZB302_0
(14-3-3 PROTEIN
ZETA/DELTA)		 1eu8 TREHALOSE/MALTOSE
BINDING PROTEIN
(Thermococcus
litoralis) 		3 / 3 MET A 245
GLN A 248
ARG A 243
 PT  A 415 (-3.2A)
None
None
 1.06A 6fnaB-1eu8A:
0.0		 6fnaB-1eu8A:
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.
6FNB_A_BEZA301_0
(14-3-3 PROTEIN
ZETA/DELTA)		 1eu8 TREHALOSE/MALTOSE
BINDING PROTEIN
(Thermococcus
litoralis) 		3 / 3 MET A 245
GLN A 248
ARG A 243
 PT  A 415 (-3.2A)
None
None
 1.08A 6fnbA-1eu8A:
0.0		 6fnbA-1eu8A:
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.
6N91_A_DCFA401_0
(ADENOSINE DEAMINASE)		 2zkt 2,3-BISPHOSPHOGLYCER
ATE-INDEPENDENT
PHOSPHOGLYCERATE
MUTASE
(Pyrococcus
horikoshii) 		5 / 12 HIS A 347
LEU A 254
HIS A  64
ASP A  13
ASP A 305
 ZN  A 414 (-3.5A)
None
None
ZN  A 414 (-2.2A)
ZN  A 415 (-2.3A)
 1.21A 6n91A-2zktA:
undetectable		 6n91A-2zktA:
11.65
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.
6N91_B_DCFB401_0
(ADENOSINE DEAMINASE)		 2zkt 2,3-BISPHOSPHOGLYCER
ATE-INDEPENDENT
PHOSPHOGLYCERATE
MUTASE
(Pyrococcus
horikoshii) 		5 / 12 HIS A 347
LEU A 254
HIS A  64
ASP A  13
ASP A 305
 ZN  A 414 (-3.5A)
None
None
ZN  A 414 (-2.2A)
ZN  A 415 (-2.3A)
 1.22A 6n91B-2zktA:
undetectable		 6n91B-2zktA:
11.65