SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'MLY'


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.
1A29_A_TFPA153_1
(CALMODULIN)		 1lln ANTIVIRAL PROTEIN 3
(Phytolacca
americana) 		5 / 8 ILE A  63
LEU A  68
GLU A  23
ALA A  24
VAL A  48
 None
None
MLY  A  26 ( 3.2A)
None
None
 1.26A 1a29A-1llnA:
undetectable		 1a29A-1llnA:
20.15
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.
1A8U_A_BEZA295_0
(CHLOROPEROXIDASE T)		 5z5c CYSTEINE SYNTHASE
(Fusobacterium
nucleatum) 		5 / 10 GLY A 191
SER A 154
MET A 190
LEU A 238
LEU A 151
 MLY  A 194 ( 4.6A)
None
MLY  A 240 ( 3.5A)
None
None
 1.40A 1a8uA-5z5cA:
undetectable		 1a8uA-5z5cA:
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.
1A8U_B_BEZB294_0
(CHLOROPEROXIDASE T)		 5z5c CYSTEINE SYNTHASE
(Fusobacterium
nucleatum) 		5 / 10 GLY A 191
SER A 154
MET A 190
LEU A 238
LEU A 151
 MLY  A 194 ( 4.6A)
None
MLY  A 240 ( 3.5A)
None
None
 1.40A 1a8uB-5z5cA:
undetectable		 1a8uB-5z5cA:
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.
1CD2_A_FOLA307_0
(DIHYDROFOLATE
REDUCTASE)		 4fkm SIMILAR TO FERRIC
HYDROXAMATE RECEPTOR
1
(Staphylococcus
aureus) 		5 / 12 ALA A 264
THR A 256
PRO A 251
LEU A 190
ILE A 233
 MLY  A 263 ( 3.6A)
None
None
MLY  A 189 ( 4.5A)
MLY  A 229 ( 4.7A)
 1.04A 1cd2A-4fkmA:
undetectable		 1cd2A-4fkmA:
22.18
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.
1CD2_A_FOLA307_0
(DIHYDROFOLATE
REDUCTASE)		 5uvr PILO PROTEIN
(Pseudomonas
aeruginosa) 		5 / 12 ILE A 148
LEU A 167
THR A 197
PRO A 110
ILE A 146
 None
None
MLY  A 196 ( 3.7A)
None
None
 1.06A 1cd2A-5uvrA:
undetectable		 1cd2A-5uvrA:
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.
1CLA_A_CLMA221_0
(TYPE III
CHLORAMPHENICOL
ACETYLTRANSFERASE)		 4gxr MALONYL COA
SYNTHETASE,
BENZOATE-COA LIGASE
CHIMERIC PROTEIN
(Rhodopseudomonas
palustris;
Paraburkholderia
xenovorans) 		5 / 10 THR A  60
ALA A  58
LEU A  45
VAL A  44
ILE A 103
 None
None
None
None
MLY  A 102 ( 3.9A)
 1.31A 1claA-4gxrA:
undetectable		 1claA-4gxrA:
17.00
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.
1D1G_A_MTXA171_1
(DIHYDROFOLATE
REDUCTASE)		 2f4i HYPOTHETICAL PROTEIN
TM0957
(Thermotoga
maritima) 		5 / 12 ALA A 137
ILE A 204
LEU A 123
ILE A  96
THR A 138
 None
MLY  A 201 ( 4.6A)
None
None
None
 1.01A 1d1gA-2f4iA:
undetectable		 1d1gA-2f4iA:
25.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1D1G_B_MTXB171_1
(DIHYDROFOLATE
REDUCTASE)		 2f4i HYPOTHETICAL PROTEIN
TM0957
(Thermotoga
maritima) 		5 / 12 ALA A 137
ILE A 204
LEU A 123
ILE A  96
THR A 138
 None
MLY  A 201 ( 4.6A)
None
None
None
 0.99A 1d1gB-2f4iA:
undetectable		 1d1gB-2f4iA:
25.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1D4F_B_ADNB602_1
(S-ADENOSYLHOMOCYSTEI
NE HYDROLASE)		 4f6e SUPEROXIDE DISMUTASE
[MN], MITOCHONDRIAL
(Saccharomyces
cerevisiae) 		5 / 12 HIS A  81
ASP A 168
HIS A 172
GLY A  76
PHE A 135
 MN  A 301 (-3.4A)
MN  A 301 (-2.6A)
MN  A 301 (-3.4A)
MLY  A  72 ( 3.5A)
None
 1.03A 1d4fB-4f6eA:
undetectable		 1d4fB-4f6eA:
19.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1DF7_A_MTXA501_1
(DIHYDROFOLATE
REDUCTASE)		 2vd9 ALANINE RACEMASE
(Bacillus
anthracis) 		5 / 12 ILE A  36
ALA A  56
ILE A  19
LEU A 246
ILE A  26
 None
None
None
MLY  A 245 ( 4.1A)
MLY  A  27 ( 3.7A)
 0.89A 1df7A-2vd9A:
undetectable		 1df7A-2vd9A:
17.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1DG5_A_TOPA201_1
(DIHYDROFOLATE
REDUCTASE)		 2vd9 ALANINE RACEMASE
(Bacillus
anthracis) 		5 / 11 ILE A  36
ALA A  56
ILE A  19
LEU A 246
ILE A  26
 None
None
None
MLY  A 245 ( 4.1A)
MLY  A  27 ( 3.7A)
 0.86A 1dg5A-2vd9A:
undetectable		 1dg5A-2vd9A:
17.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1DHI_B_MTXB361_1
(DIHYDROFOLATE
REDUCTASE)		 2f4i HYPOTHETICAL PROTEIN
TM0957
(Thermotoga
maritima) 		5 / 11 ALA A 137
ILE A 204
LEU A 123
ILE A  96
THR A 138
 None
MLY  A 201 ( 4.6A)
None
None
None
 1.02A 1dhiB-2f4iA:
undetectable		 1dhiB-2f4iA:
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.
1DLS_A_MTXA188_1
(DIHYDROFOLATE
REDUCTASE)		 3egl DEGV FAMILY PROTEIN
(Corynebacterium
glutamicum) 		5 / 12 ILE A 240
PHE A 171
SER A 149
ILE A 146
LEU A 140
 PLM  A 275 ( 4.4A)
None
MLY  A 148 ( 4.2A)
None
None
 1.21A 1dlsA-3eglA:
undetectable		 1dlsA-3eglA:
19.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1DRA_B_MTXB361_1
(DIHYDROFOLATE
REDUCTASE)		 2f4i HYPOTHETICAL PROTEIN
TM0957
(Thermotoga
maritima) 		5 / 12 ALA A 137
ILE A 204
LEU A 123
ILE A  96
THR A 138
 None
MLY  A 201 ( 4.6A)
None
None
None
 0.99A 1draB-2f4iA:
undetectable		 1draB-2f4iA:
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.
1DRF_A_FOLA187_0
(DIHYDROFOLATE
REDUCTASE)		 3egl DEGV FAMILY PROTEIN
(Corynebacterium
glutamicum) 		6 / 12 ILE A 240
LEU A  72
PHE A 171
SER A 149
ILE A 146
LEU A 140
 PLM  A 275 ( 4.4A)
PLM  A 275 ( 4.2A)
None
MLY  A 148 ( 4.2A)
None
None
 1.26A 1drfA-3eglA:
undetectable		 1drfA-3eglA:
19.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1EPB_A_9CRA165_1
(EPIDIDYMAL RETINOIC
ACID-BINDING PROTEIN)		 3hsa PLECKSTRIN HOMOLOGY
DOMAIN
(Shewanella
amazonensis) 		5 / 12 ILE A  95
LEU A  53
ALA A 123
ILE A 119
ILE A 115
 None
MLY  A 104 ( 4.8A)
None
None
None
 0.97A 1epbA-3hsaA:
undetectable		 1epbA-3hsaA:
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.
1EQB_A_FFOA1293_2
(SERINE
HYDROXYMETHYLTRANSFE
RASE)		 1xl3 SECRETION CONTROL
PROTEIN
(Yersinia
pestis) 		3 / 3 SER A 129
GLU A 130
GLU A 131
 MLY  A 128 ( 4.0A)
None
None
 0.68A 1eqbD-1xl3A:
undetectable		 1eqbD-1xl3A:
22.13
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.
1EQB_C_FFOC3293_0
(SERINE
HYDROXYMETHYLTRANSFE
RASE)		 1xl3 SECRETION CONTROL
PROTEIN
(Yersinia
pestis) 		3 / 3 SER A 129
GLU A 130
GLU A 131
 MLY  A 128 ( 4.0A)
None
None
 0.68A 1eqbB-1xl3A:
undetectable		 1eqbB-1xl3A:
22.13
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.
1FM6_D_BRLD503_2
(PEROXISOME
PROLIFERATOR
ACTIVATED RECEPTOR
GAMMA)		 3rwx HYPOTHETICAL
BACTERIAL OUTER
MEMBRANE PROTEIN
(Bacteroides
fragilis) 		4 / 4 ILE A 121
LEU A 117
VAL A  74
ILE A  72
 MLY  A 126 ( 4.1A)
MLY  A 130 ( 4.3A)
None
None
 0.90A 1fm6D-3rwxA:
undetectable		 1fm6D-3rwxA:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1GTI_E_CCSE47_0
(GLUTATHIONE
S-TRANSFERASE)		 3oix PUTATIVE
DIHYDROOROTATE
DEHYDROGENASE
DIHYDROOROTATE
OXIDASE
(Streptococcus
mutans) 		4 / 7 THR A 109
LEU A  49
GLY A  47
LEU A  73
 None
None
MLY  A  45 ( 3.8A)
None
 0.99A 1gtiE-3oixA:
undetectable		 1gtiE-3oixA:
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.
1HK2_A_T44A3002_1
(SERUM ALBUMIN)		 2g9n EUKARYOTIC
INITIATION FACTOR
4A-I
(Homo
sapiens) 		4 / 8 ASN A  38
LEU A  39
LEU A  64
LYS A  69
 None
None
None
MLY  A  68 ( 3.2A)
 1.11A 1hk2A-2g9nA:
undetectable		 1hk2A-2g9nA:
16.70
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.
1HRK_A_CHDA1501_0
(FERROCHELATASE)		 5for PHOSPHOINOSITIDE
3-KINASE ADAPTER
PROTEIN 1
(Homo
sapiens) 		5 / 12 LEU A  81
LEU A  85
HIS A  42
LEU A  10
VAL A  64
 MLY  A  78 ( 4.3A)
None
None
None
None
 1.18A 1hrkA-5forA:
4.3		 1hrkA-5forA:
16.85
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.
1HRK_A_CHDA1503_0
(FERROCHELATASE)		 1lln ANTIVIRAL PROTEIN 3
(Phytolacca
americana) 		3 / 3 LEU A 226
PRO A 227
LEU A 230
 None
None
MLY  A 231 ( 4.0A)
 0.46A 1hrkA-1llnA:
undetectable		 1hrkA-1llnA:
20.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1HVY_B_D16B415_1
(THYMIDYLATE SYNTHASE)		 3rwx HYPOTHETICAL
BACTERIAL OUTER
MEMBRANE PROTEIN
(Bacteroides
fragilis) 		5 / 12 LEU A 213
GLY A 214
PHE A 216
LYS A 268
ALA A 210
 None
None
None
MLY  A 267 ( 3.2A)
None
 1.22A 1hvyB-3rwxA:
undetectable		 1hvyB-3rwxA:
21.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1HWK_A_117A2_1
(HMG-COA REDUCTASE)		 5z5c CYSTEINE SYNTHASE
(Fusobacterium
nucleatum) 		4 / 8 ARG A 104
SER A 101
SER A  74
LYS A  46
 MLY  A 303 ( 4.0A)
MLY  A 303 ( 2.7A)
CL  A 402 (-2.9A)
PLP  A 401 ( 1.3A)
 1.02A 1hwkA-5z5cA:
undetectable		 1hwkA-5z5cA:
11.14
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.
1HWK_C_117C4_1
(HMG-COA REDUCTASE)		 5z5c CYSTEINE SYNTHASE
(Fusobacterium
nucleatum) 		4 / 8 ARG A 104
SER A 101
SER A  74
LYS A  46
 MLY  A 303 ( 4.0A)
MLY  A 303 ( 2.7A)
CL  A 402 (-2.9A)
PLP  A 401 ( 1.3A)
 1.04A 1hwkC-5z5cA:
undetectable		 1hwkC-5z5cA:
11.14
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.
1HWK_D_117D3_2
(HMG-COA REDUCTASE)		 5z5c CYSTEINE SYNTHASE
(Fusobacterium
nucleatum) 		4 / 8 ARG A 104
SER A 101
SER A  74
LYS A  46
 MLY  A 303 ( 4.0A)
MLY  A 303 ( 2.7A)
CL  A 402 (-2.9A)
PLP  A 401 ( 1.3A)
 1.05A 1hwkD-5z5cA:
undetectable		 1hwkD-5z5cA:
11.14
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.
1IBG_H_OBNH1_1
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN))		 3kv0 HET-C2
(Podospora
anserina) 		4 / 6 HIS A 147
LEU A 143
PHE A 155
VAL A 151
 None
MLY  A 144 ( 4.3A)
None
MLY  A 152 ( 3.2A)
 1.00A 1ibgH-3kv0A:
undetectable		 1ibgH-3kv0A:
17.17
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.
1IBG_H_OBNH1_1
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN))		 4xl1 DELTA-LIKE PROTEIN
(Rattus
norvegicus) 		4 / 6 LEU B  62
PHE B  30
TYR B 169
VAL B 173
 MLY  B  63 ( 3.6A)
None
None
None
 1.32A 1ibgH-4xl1B:
undetectable		 1ibgH-4xl1B:
18.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1JB0_B_PQNB2002_1
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A2)		 3e3x BIPA
(Vibrio
parahaemolyticus) 		5 / 11 MET A  33
PHE A  35
SER A 107
ILE A 309
LEU A 104
 None
None
MLY  A 314 ( 4.8A)
None
None
 1.12A 1jb0B-3e3xA:
undetectable		 1jb0B-3e3xA:
18.21
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.
1KGL_A_RTLA175_1
(CELLULAR
RETINOL-BINDING
PROTEIN TYPE I)		 3kv0 HET-C2
(Podospora
anserina) 		4 / 7 LEU A  79
ILE A  36
THR A  38
GLN A  89
 MLY  A  76 ( 4.6A)
None
None
None
 1.22A 1kglA-3kv0A:
undetectable		 1kglA-3kv0A:
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.
1LIN_A_TFPA155_1
(CALMODULIN)		 1vk1 CONSERVED
HYPOTHETICAL PROTEIN
(Pyrococcus
furiosus) 		4 / 7 GLU A 131
PHE A 106
MET A 189
ALA A 187
 None
MLY  A 107 ( 4.8A)
None
None
 1.25A 1linA-1vk1A:
undetectable		 1linA-1vk1A:
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.
1LQT_B_ACTB1868_0
(FPRA)		 3zcj CAGL
(Helicobacter
pylori) 		3 / 3 ALA A 199
HIS A 200
VAL A 203
 MLY  A 195 ( 3.7A)
None
MLY  A 202 ( 3.3A)
 0.39A 1lqtB-3zcjA:
undetectable		 1lqtB-3zcjA:
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.
1LQT_B_ACTB1873_0
(FPRA)		 1vk1 CONSERVED
HYPOTHETICAL PROTEIN
(Pyrococcus
furiosus) 		3 / 3 ASP A 109
ASP A 195
LYS A 113
 MLY  A 112 ( 3.8A)
MLY  A 107 ( 4.2A)
MLY  A 112 ( 2.9A)
 1.04A 1lqtB-1vk1A:
undetectable		 1lqtB-1vk1A:
20.87
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.
1LQT_B_ACTB1873_0
(FPRA)		 4fkm SIMILAR TO FERRIC
HYDROXAMATE RECEPTOR
1
(Staphylococcus
aureus) 		3 / 3 ASP A  95
ASP A 115
LYS A  99
 MLY  A  98 ( 3.7A)
MLY  A 114 ( 4.1A)
MLY  A  98 ( 2.8A)
 0.87A 1lqtB-4fkmA:
undetectable		 1lqtB-4fkmA:
19.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1LQU_B_ACTB1425_0
(FPRA)		 3zcj CAGL
(Helicobacter
pylori) 		3 / 3 ALA A 199
HIS A 200
VAL A 203
 MLY  A 195 ( 3.7A)
None
MLY  A 202 ( 3.3A)
 0.39A 1lquB-3zcjA:
undetectable		 1lquB-3zcjA:
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.
1LQU_B_ACTB1430_0
(FPRA)		 1vk1 CONSERVED
HYPOTHETICAL PROTEIN
(Pyrococcus
furiosus) 		3 / 3 ASP A 109
ASP A 195
LYS A 113
 MLY  A 112 ( 3.8A)
MLY  A 107 ( 4.2A)
MLY  A 112 ( 2.9A)
 1.07A 1lquB-1vk1A:
undetectable		 1lquB-1vk1A:
20.87
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.
1LQU_B_ACTB1430_0
(FPRA)		 4fkm SIMILAR TO FERRIC
HYDROXAMATE RECEPTOR
1
(Staphylococcus
aureus) 		3 / 3 ASP A  95
ASP A 115
LYS A  99
 MLY  A  98 ( 3.7A)
MLY  A 114 ( 4.1A)
MLY  A  98 ( 2.8A)
 0.86A 1lquB-4fkmA:
undetectable		 1lquB-4fkmA:
19.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ME7_A_MOAA600_1
(INOSINE-5'-MONOPHOSP
HATE DEHYDROGENASE)		 4ozy POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE
(Pseudomonas
syringae
group
genomosp.
3) 		4 / 8 ASP A 331
SER A 357
ILE A 381
GLY A 334
 MLY  A 356 ( 3.5A)
MLY  A 356 ( 4.6A)
None
None
 0.78A 1me7A-4ozyA:
undetectable		 1me7A-4ozyA:
23.26
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.
1MEI_A_MOAA600_1
(INOSINE-5'-MONOPHOSP
HATE DEHYDROGENASE)		 4nk6 POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE
(Pseudomonas
syringae
group
genomosp.
3) 		4 / 8 ASP A 331
SER A 357
ILE A 381
GLY A 334
 MLY  A 356 ( 3.7A)
MLY  A 356 ( 4.5A)
None
None
 0.83A 1meiA-4nk6A:
undetectable		 1meiA-4nk6A:
20.84
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.
1MEI_A_MOAA600_1
(INOSINE-5'-MONOPHOSP
HATE DEHYDROGENASE)		 4ozy POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE
(Pseudomonas
syringae
group
genomosp.
3) 		4 / 8 ASP A 331
SER A 357
ILE A 381
GLY A 334
 MLY  A 356 ( 3.5A)
MLY  A 356 ( 4.6A)
None
None
 0.80A 1meiA-4ozyA:
undetectable		 1meiA-4ozyA:
23.26
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.
1MXG_A_ACRA442_1
(ALPHA AMYLASE)		 3e3x BIPA
(Vibrio
parahaemolyticus) 		5 / 11 GLY A 148
PHE A 124
GLY A 171
GLY A 202
GLY A 201
 MLY  A 147 ( 2.4A)
MLY  A 200 ( 4.7A)
None
MLY  A 147 ( 3.8A)
MLY  A 200 ( 2.4A)
 1.08A 1mxgA-3e3xA:
undetectable		 1mxgA-3e3xA:
21.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1P93_D_DEXD4999_2
(GLUCOCORTICOID
RECEPTOR)		 5ufk EFFECTOR PROTEIN
SIDK
(Legionella
pneumophila) 		4 / 5 LEU A 183
MET A 155
LEU A 159
GLN A 135
 MLY  A 180 ( 4.8A)
None
None
None
 1.32A 1p93D-5ufkA:
undetectable		 1p93D-5ufkA:
21.31
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.
1PNL_B_PACB559_0
(PENICILLIN
AMIDOHYDROLASE)		 5liy ALDO-KETO REDUCTASE
FAMILY 1 MEMBER B10
(Homo
sapiens) 		4 / 8 SER X  23
SER X 264
ALA X  31
ILE X 270
 MLY  X 263 ( 3.2A)
NAP  X 401 (-2.5A)
None
None
 1.21A 1pnlA-5liyX:
undetectable
1pnlB-5liyX:
undetectable		 1pnlA-5liyX:
20.38
1pnlB-5liyX:
21.40
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1Q13_A_TESA501_1
(PROSTAGLANDIN-E2
9-REDUCTASE)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		4 / 6 TYR A  24
TYR A  55
HIS A 117
GLU A 226
 MLY  A  25 (-3.6A)
NAD  A 327 ( 4.7A)
MRD  A 328 ( 3.9A)
MLY  A  27 ( 3.3A)
 0.89A 1q13A-3ln3A:
50.6		 1q13A-3ln3A:
65.02
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.
1QAB_F_RTLF2_0
(PROTEIN (RETINOL
BINDING PROTEIN))		 4p98 EXTRACELLULAR
SOLUTE-BINDING
PROTEIN
(Conexibacter
woesei) 		5 / 12 ALA A 185
LEU A 261
GLY A 181
LEU A 143
GLN A 142
 None
MLY  A 260 ( 4.1A)
None
None
BR  A 405 (-3.5A)
 1.06A 1qabF-4p98A:
undetectable		 1qabF-4p98A:
20.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1R55_A_097A518_1
(ADAM 33)		 5czw MYROILYSIN
(Myroides
profundi) 		6 / 10 ALA A  25
THR A 139
HIS A 142
GLU A 143
HIS A 146
HIS A 152
 MLY  A  26 ( 3.5A)
None
ZN  A 301 ( 3.4A)
ZN  A 301 ( 4.2A)
ZN  A 301 ( 3.3A)
ZN  A 301 ( 3.1A)
 0.75A 1r55A-5czwA:
7.1		 1r55A-5czwA:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1RA2_A_FOLA161_0
(DIHYDROFOLATE
REDUCTASE)		 2f4i HYPOTHETICAL PROTEIN
TM0957
(Thermotoga
maritima) 		5 / 12 ALA A 137
ILE A 204
LEU A 123
ILE A  96
THR A 138
 None
MLY  A 201 ( 4.6A)
None
None
None
 0.99A 1ra2A-2f4iA:
undetectable		 1ra2A-2f4iA:
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.
1RA3_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 2f4i HYPOTHETICAL PROTEIN
TM0957
(Thermotoga
maritima) 		5 / 12 ALA A 137
ILE A 204
LEU A 123
ILE A  96
THR A 138
 None
MLY  A 201 ( 4.6A)
None
None
None
 1.03A 1ra3A-2f4iA:
undetectable		 1ra3A-2f4iA:
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.
1RB2_A_FOLA161_0
(DIHYDROFOLATE
REDUCTASE)		 2f4i HYPOTHETICAL PROTEIN
TM0957
(Thermotoga
maritima) 		5 / 12 ALA A 137
ILE A 204
LEU A 123
ILE A  96
THR A 138
 None
MLY  A 201 ( 4.6A)
None
None
None
 1.00A 1rb2A-2f4iA:
undetectable		 1rb2A-2f4iA:
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.
1RB2_B_FOLB161_0
(DIHYDROFOLATE
REDUCTASE)		 4nge PRESEQUENCE
PROTEASE,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 12 ILE D 758
ALA D 753
PHE D 699
LEU D 765
ILE D 761
 None
MLY  D 704 ( 3.9A)
None
MLY  D 764 ( 4.1A)
None
 1.03A 1rb2B-4ngeD:
undetectable		 1rb2B-4ngeD:
10.55
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.
1RD7_A_FOLA161_0
(DIHYDROFOLATE
REDUCTASE)		 2f4i HYPOTHETICAL PROTEIN
TM0957
(Thermotoga
maritima) 		5 / 12 ALA A 137
ILE A 204
LEU A 123
ILE A  96
THR A 138
 None
MLY  A 201 ( 4.6A)
None
None
None
 1.01A 1rd7A-2f4iA:
undetectable		 1rd7A-2f4iA:
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.
1RMT_C_ADNC1503_1
(CLASS B ACID
PHOSPHATASE)		 4f6e SUPEROXIDE DISMUTASE
[MN], MITOCHONDRIAL
(Saccharomyces
cerevisiae) 		4 / 8 LEU A   7
TRP A   9
GLY A  12
ASP A  10
 MLY  A   8 ( 4.0A)
MLY  A   8 ( 4.7A)
None
None
 0.95A 1rmtC-4f6eA:
undetectable		 1rmtC-4f6eA:
21.46
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RQJ_A_RISA901_1
(GERANYLTRANSTRANSFER
ASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 11 LEU A  71
ASP A  74
ARG A  85
THR A 164
GLN A 198
 None
UNL  A 273 (-3.0A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.94A 1rqjA-2ftzA:
31.6		 1rqjA-2ftzA:
34.20
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RQJ_A_RISA901_1
(GERANYLTRANSTRANSFER
ASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		6 / 11 SER A  70
LEU A  71
ASP A  80
ARG A  85
THR A 164
GLN A 198
 UNL  A 273 (-3.7A)
None
MLY  A 223 ( 3.6A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.55A 1rqjA-2ftzA:
31.6		 1rqjA-2ftzA:
34.20
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RQJ_A_RISA901_1
(GERANYLTRANSTRANSFER
ASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 11 SER A  70
LEU A  71
THR A 164
GLN A 198
ASP A 201
 UNL  A 273 (-3.7A)
None
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
EDO  A 282 (-2.8A)
 0.92A 1rqjA-2ftzA:
31.6		 1rqjA-2ftzA:
34.20
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RQJ_B_RISB903_1
(GERANYLTRANSTRANSFER
ASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		6 / 11 SER A  70
LEU A  71
ASP A  74
ARG A  85
THR A 164
GLN A 198
 UNL  A 273 (-3.7A)
None
UNL  A 273 (-3.0A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.87A 1rqjB-2ftzA:
31.6		 1rqjB-2ftzA:
34.20
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RQJ_B_RISB903_1
(GERANYLTRANSTRANSFER
ASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		6 / 11 SER A  70
LEU A  71
ASP A  80
ARG A  85
THR A 164
GLN A 198
 UNL  A 273 (-3.7A)
None
MLY  A 223 ( 3.6A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.51A 1rqjB-2ftzA:
31.6		 1rqjB-2ftzA:
34.20
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RQJ_B_RISB903_1
(GERANYLTRANSTRANSFER
ASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 11 SER A  70
LEU A  71
THR A 164
GLN A 198
ASP A 201
 UNL  A 273 (-3.7A)
None
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
EDO  A 282 (-2.8A)
 0.89A 1rqjB-2ftzA:
31.6		 1rqjB-2ftzA:
34.20
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.
1RS7_A_ACTA860_0
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 2g9n EUKARYOTIC
INITIATION FACTOR
4A-I
(Homo
sapiens) 		4 / 5 GLY A  69
ILE A  67
VAL A  72
SER A  89
 MLY  A  68 ( 2.3A)
MLY  A  68 ( 3.9A)
None
None
 1.17A 1rs7A-2g9nA:
undetectable		 1rs7A-2g9nA:
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.
1RS7_A_ACTA860_0
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 2g9n EUKARYOTIC
INITIATION FACTOR
4A-I
(Homo
sapiens) 		4 / 5 GLY A  69
ILE A  67
VAL A 210
SER A  89
 MLY  A  68 ( 2.3A)
MLY  A  68 ( 3.9A)
None
None
 1.21A 1rs7A-2g9nA:
undetectable		 1rs7A-2g9nA:
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.
1RS7_A_ACTA860_0
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 3nym UNCHARACTERIZED
PROTEIN
(Neisseria
meningitidis) 		4 / 5 GLY A  15
ILE A  12
TRP A  40
VAL A  27
 None
MLY  A   8 ( 3.9A)
MLY  A  39 ( 4.1A)
None
 1.26A 1rs7A-3nymA:
undetectable		 1rs7A-3nymA:
16.43
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.
1RS7_B_ACTB861_0
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 2g9n EUKARYOTIC
INITIATION FACTOR
4A-I
(Homo
sapiens) 		4 / 6 GLY A  69
ILE A  67
VAL A  72
SER A  89
 MLY  A  68 ( 2.3A)
MLY  A  68 ( 3.9A)
None
None
 1.09A 1rs7B-2g9nA:
undetectable		 1rs7B-2g9nA:
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.
1RX2_A_FOLA161_0
(DIHYDROFOLATE
REDUCTASE)		 2f4i HYPOTHETICAL PROTEIN
TM0957
(Thermotoga
maritima) 		5 / 12 ALA A 137
ILE A 204
LEU A 123
ILE A  96
THR A 138
 None
MLY  A 201 ( 4.6A)
None
None
None
 0.98A 1rx2A-2f4iA:
undetectable		 1rx2A-2f4iA:
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.
1S1X_A_NVPA999_1
(REVERSE
TRANSCRIPTASE)		 4jdu AEROTOLERANCE-RELATE
D MEMBRANE PROTEIN
(Bacteroides
fragilis) 		4 / 8 LEU A  96
VAL A 225
GLY A 224
LEU A 112
 None
None
None
MLY  A 116 ( 4.5A)
 1.00A 1s1xA-4jduA:
2.0		 1s1xA-4jduA:
17.57
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1S2A_A_IMNA2001_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C3)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		6 / 12 TYR A  24
TRP A  86
HIS A 117
GLU A 192
TYR A 216
GLN A 222
 MLY  A  25 (-3.6A)
None
MRD  A 328 ( 3.9A)
None
NAD  A 327 (-3.4A)
NAD  A 327 (-3.7A)
 0.72A 1s2aA-3ln3A:
49.1		 1s2aA-3ln3A:
65.02
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.
1SDT_B_MK1B902_1
(PROTEASE RETROPEPSIN)		 2f4i HYPOTHETICAL PROTEIN
TM0957
(Thermotoga
maritima) 		5 / 10 LEU A 125
GLY A 180
ILE A 213
VAL A 112
ILE A 110
 None
None
None
MLY  A 113 ( 2.9A)
None
 0.96A 1sdtA-2f4iA:
undetectable		 1sdtA-2f4iA:
17.65
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.
1SQN_B_NDRB2001_0
(PROGESTERONE
RECEPTOR)		 4f6e SUPEROXIDE DISMUTASE
[MN], MITOCHONDRIAL
(Saccharomyces
cerevisiae) 		5 / 12 LEU A 114
LEU A 117
LEU A 120
LEU A 103
LEU A 164
 None
None
MLY  A 119 ( 4.6A)
None
MLY  A 138 ( 4.3A)
 0.99A 1sqnB-4f6eA:
undetectable		 1sqnB-4f6eA:
19.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1T46_A_STIA3_2
(HOMO SAPIENS V-KIT
HARDY-ZUCKERMAN 4
FELINE SARCOMA VIRAL
ONCOGENE HOMOLOG)		 5x68 KYNURENINE
3-MONOOXYGENASE
(Homo
sapiens) 		4 / 7 VAL A  19
CYH A 139
CYH A 324
ARG A 349
 FAD  A 401 (-3.5A)
MLY  A 138 ( 4.3A)
None
None
 1.07A 1t46A-5x68A:
undetectable		 1t46A-5x68A:
14.43
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.
1TV8_B_SAMB2501_0
(MOLYBDENUM COFACTOR
BIOSYNTHESIS PROTEIN
A)		 1vk1 CONSERVED
HYPOTHETICAL PROTEIN
(Pyrococcus
furiosus) 		4 / 7 THR A 101
THR A 222
SER A 219
VAL A 161
 MLY  A 221 ( 4.7A)
MLY  A 221 ( 4.3A)
MLY  A 159 ( 4.5A)
None
 1.16A 1tv8B-1vk1A:
undetectable		 1tv8B-1vk1A:
23.50
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.
1TW4_A_CHDA131_0
(FATTY ACID-BINDING
PROTEIN)		 3oix PUTATIVE
DIHYDROOROTATE
DEHYDROGENASE
DIHYDROOROTATE
OXIDASE
(Streptococcus
mutans) 		5 / 11 ILE A 140
THR A 147
LEU A 129
THR A 109
HIS A 110
 None
None
None
None
MLY  A 114 ( 4.8A)
 0.96A 1tw4A-3oixA:
undetectable		 1tw4A-3oixA:
16.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1UWJ_A_BAXA1723_2
(B-RAF PROTO-ONCOGENE
SERINE/THREONINE-PRO
TEIN KINASE)		 5thm ESTERASE-6
(Drosophila
melanogaster) 		4 / 7 ILE A 223
LEU A 184
ILE A 135
ILE A 168
 None
None
None
MLY  A 169 ( 3.7A)
 0.81A 1uwjA-5thmA:
undetectable		 1uwjA-5thmA:
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.
1UWJ_B_BAXB1723_2
(B-RAF PROTO-ONCOGENE
SERINE/THREONINE-PRO
TEIN KINASE)		 4nge PRESEQUENCE
PROTEASE,
MITOCHONDRIAL
(Homo
sapiens) 		3 / 3 ILE D 885
ASP D 951
PHE D 947
 MLY  D 884 ( 4.0A)
None
MLY  D 946 ( 4.7A)
 0.59A 1uwjB-4ngeD:
1.8		 1uwjB-4ngeD:
15.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1V3Q_E_2DIE290_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE)		 3oix DIHYDROOROTATE
OXIDASE
PUTATIVE
DIHYDROOROTATE
DEHYDROGENASE
(Streptococcus
mutans) 		5 / 10 GLY A  47
VAL A 102
GLY A 103
MET A 104
ASN A  75
 MLY  A  45 ( 3.8A)
None
None
None
None
 1.13A 1v3qE-3oixA:
undetectable		 1v3qE-3oixA:
20.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1V8B_A_ADNA502_1
(ADENOSYLHOMOCYSTEINA
SE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 12 ASP A  48
THR A  44
GLY A 249
MET A 186
PHE A 176
 None
None
MLY  A 248 ( 2.4A)
None
MLY  A 181 ( 4.5A)
 1.08A 1v8bA-2ftzA:
undetectable		 1v8bA-2ftzA:
21.71
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.
1V8B_B_ADNB1502_1
(ADENOSYLHOMOCYSTEINA
SE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 12 ASP A  48
THR A  44
GLY A 249
MET A 186
PHE A 176
 None
None
MLY  A 248 ( 2.4A)
None
MLY  A 181 ( 4.5A)
 1.11A 1v8bB-2ftzA:
undetectable		 1v8bB-2ftzA:
21.71
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.
1V8B_D_ADND3502_1
(ADENOSYLHOMOCYSTEINA
SE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 12 ASP A  48
THR A  44
GLY A 249
MET A 186
PHE A 176
 None
None
MLY  A 248 ( 2.4A)
None
MLY  A 181 ( 4.5A)
 1.13A 1v8bD-2ftzA:
undetectable		 1v8bD-2ftzA:
21.71
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.
1VID_A_SAMA301_0
(CATECHOL
O-METHYLTRANSFERASE)		 4gxr MALONYL COA
SYNTHETASE,
BENZOATE-COA LIGASE
CHIMERIC PROTEIN
(Rhodopseudomonas
palustris;
Paraburkholderia
xenovorans) 		5 / 12 ASN A 408
VAL A 409
GLU A 439
GLY A 438
HIS A 434
 None
MLY  A 470 ( 4.9A)
None
None
None
 1.48A 1vidA-4gxrA:
2.4		 1vidA-4gxrA:
19.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1WRK_A_TFPA204_1
(TROPONIN C, SLOW
SKELETAL AND CARDIAC
MUSCLES)		 5chx XRCC4-MYH7-1590-1657
(Homo
sapiens) 		5 / 9 PHE A  32
VAL A  22
LEU A  75
PHE A 111
LEU A  28
 None
MLY  A   4 ( 4.4A)
MLY  A   4 ( 4.2A)
None
None
 1.27A 1wrkA-5chxA:
undetectable
1wrkB-5chxA:
undetectable		 1wrkA-5chxA:
16.59
1wrkB-5chxA:
16.59
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.
1WRL_E_TFPE212_1
(TROPONIN C, SLOW
SKELETAL AND CARDIAC
MUSCLES)		 1iv8 MALTOOLIGOSYL
TREHALOSE SYNTHASE
(Sulfolobus
acidocaldarius) 		4 / 7 PHE A 116
LEU A 161
PHE A 118
SER A 110
 None
None
None
MLY  A 111 ( 3.1A)
 0.99A 1wrlE-1iv8A:
undetectable		 1wrlE-1iv8A:
9.24
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.
1XDS_A_SAMA5635_0
(PROTEIN RDMB)		 4dzg PLIG
(Aeromonas
hydrophila) 		5 / 12 GLY A  67
GLY A  68
LEU A 129
SER A  70
ASN A  73
 None
None
MLY  A  65 ( 4.5A)
CL  A 201 (-3.2A)
None
 1.20A 1xdsA-4dzgA:
2.3		 1xdsA-4dzgA:
17.74
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.
1Y7I_B_SALB503_1
(SALICYLIC
ACID-BINDING PROTEIN
2)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		5 / 10 ALA A 308
TYR A  24
PHE A 310
PHE A 129
HIS A 117
 None
MLY  A  25 (-3.6A)
MRD  A 328 (-4.5A)
MLY  A  27 ( 4.4A)
MRD  A 328 ( 3.9A)
 1.36A 1y7iB-3ln3A:
undetectable		 1y7iB-3ln3A:
22.06
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.
1YHL_A_RISA1400_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 11 LEU A  71
ASP A  74
ARG A  85
THR A 164
GLN A 198
 None
UNL  A 273 (-3.0A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.83A 1yhlA-2ftzA:
24.9		 1yhlA-2ftzA:
25.53
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.
1YHL_A_RISA1400_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 11 LEU A  71
ASP A  80
ARG A  85
THR A 164
GLN A 198
 None
MLY  A 223 ( 3.6A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.53A 1yhlA-2ftzA:
24.9		 1yhlA-2ftzA:
25.53
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.
1YI4_A_ADNA306_1
(PROTO-ONCOGENE
SERINE/THREONINE-PRO
TEIN KINASE PIM-1)		 3v62 UBIQUITIN-LIKE
PROTEIN SMT3
(Saccharomyces
cerevisiae) 		5 / 10 LEU A  81
ILE A  39
ASP A  87
LEU A  26
ILE A  24
 None
MLY  A  40 ( 3.6A)
None
MLY  A  27 ( 4.0A)
MLY  A  41 ( 4.2A)
 0.81A 1yi4A-3v62A:
undetectable		 1yi4A-3v62A:
19.32
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.
1YQ7_A_RISA901_1
(FARNESYL
PYROPHOSPHATE
SYNTHETASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 11 LEU A  71
ASP A  74
ARG A  85
THR A 164
GLN A 198
 None
UNL  A 273 (-3.0A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.89A 1yq7A-2ftzA:
24.2		 1yq7A-2ftzA:
25.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1YQ7_A_RISA901_1
(FARNESYL
PYROPHOSPHATE
SYNTHETASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 11 LEU A  71
ASP A  80
ARG A  85
THR A 164
GLN A 198
 None
MLY  A 223 ( 3.6A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.52A 1yq7A-2ftzA:
24.2		 1yq7A-2ftzA:
25.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1YV5_A_RISA901_1
(FARNESYL
PYROPHOSPHATE
SYNTHETASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 10 LEU A  71
ASP A  74
ARG A  85
THR A 164
GLN A 198
 None
UNL  A 273 (-3.0A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.80A 1yv5A-2ftzA:
24.4		 1yv5A-2ftzA:
25.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1YV5_A_RISA901_1
(FARNESYL
PYROPHOSPHATE
SYNTHETASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 10 LEU A  71
ASP A  80
ARG A  85
THR A 164
GLN A 198
 None
MLY  A 223 ( 3.6A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.50A 1yv5A-2ftzA:
24.4		 1yv5A-2ftzA:
25.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2A58_A_RBFA300_1
(6,7-DIMETHYL-8-RIBIT
YLLUMAZINE SYNTHASE)		 4gxr MALONYL COA
SYNTHETASE,
BENZOATE-COA LIGASE
CHIMERIC PROTEIN
(Paraburkholderia
xenovorans;
Rhodopseudomonas
palustris) 		5 / 11 GLY A 248
SER A 275
LEU A 280
ILE A 200
ALA A 202
 None
None
None
None
MLY  A 230 ( 3.9A)
 1.30A 2a58A-4gxrA:
2.9
2a58E-4gxrA:
3.7		 2a58A-4gxrA:
16.07
2a58E-4gxrA:
16.07
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.
2AVS_B_MK1B902_1
(POL POLYPROTEIN)		 4nk6 POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE
(Pseudomonas
syringae
group
genomosp.
3) 		5 / 12 VAL A 303
ILE A 316
GLY A 315
GLY A 292
ILE A 281
 MLY  A 304 ( 3.2A)
None
None
None
None
 0.86A 2avsA-4nk6A:
undetectable		 2avsA-4nk6A:
10.59
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.
2AVV_E_MK1E902_1
(POL POLYPROTEIN)		 4nk6 POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE
(Pseudomonas
syringae
group
genomosp.
3) 		5 / 12 VAL A 303
ILE A 316
GLY A 315
GLY A 292
ILE A 281
 MLY  A 304 ( 3.2A)
None
None
None
None
 0.89A 2avvD-4nk6A:
undetectable		 2avvD-4nk6A:
11.00
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.
2AZQ_A_PCFA954_0
(CATECHOL
1,2-DIOXYGENASE)		 4dws CHI2
(Yersinia
entomophaga) 		5 / 9 GLU A 458
ALA A 460
TYR A 463
LEU A 403
GLU A 467
 None
None
MLY  A 400 ( 4.9A)
MLY  A 400 ( 4.0A)
None
 1.45A 2azqA-4dwsA:
undetectable		 2azqA-4dwsA:
21.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2BFP_C_H4BC1290_1
(PTERIDINE REDUCTASE
1)		 3mnm ADP-RIBOSYLATION
FACTOR-BINDING
PROTEIN GGA2
(Saccharomyces
cerevisiae) 		4 / 8 SER A 521
LEU A 582
LEU A 516
LEU A 526
 None
None
None
MLY  A 525 ( 4.0A)
 1.00A 2bfpC-3mnmA:
undetectable		 2bfpC-3mnmA:
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.
2BTE_A_LEUA1894_0
(AMINOACYL-TRNA
SYNTHETASE)		 3gs9 PROTEIN GP18
(Listeria
monocytogenes) 		4 / 8 TYR A 266
ASP A 265
SER A 230
TYR A 228
 None
None
None
MLY  A 260 ( 3.9A)
 1.34A 2bteA-3gs9A:
undetectable		 2bteA-3gs9A:
16.63
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.
2BXE_B_1FLB2002_1
(SERUM ALBUMIN)		 4iqn PUTATIVE CYTOPLASMIC
PROTEIN
(Salmonella
enterica) 		5 / 11 ARG C 140
LEU C   5
SER C 162
LEU C 163
VAL C 164
 MLY  C  53 ( 3.9A)
None
None
None
None
 1.06A 2bxeB-4iqnC:
undetectable		 2bxeB-4iqnC:
16.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2BXG_A_IBPA2002_1
(SERUM ALBUMIN)		 4iqn PUTATIVE CYTOPLASMIC
PROTEIN
(Salmonella
enterica) 		4 / 8 ALA C  54
SER C 162
LEU C 163
VAL C 164
 MLY  C  53 ( 3.6A)
None
None
None
 0.68A 2bxgA-4iqnC:
undetectable		 2bxgA-4iqnC:
16.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2CD2_A_FOLA307_0
(DIHYDROFOLATE
REDUCTASE)		 4fkm SIMILAR TO FERRIC
HYDROXAMATE RECEPTOR
1
(Staphylococcus
aureus) 		5 / 12 ALA A 264
THR A 256
PRO A 251
LEU A 190
ILE A 233
 MLY  A 263 ( 3.6A)
None
None
MLY  A 189 ( 4.5A)
MLY  A 229 ( 4.7A)
 1.03A 2cd2A-4fkmA:
undetectable		 2cd2A-4fkmA:
22.18
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.
2CD2_A_FOLA307_0
(DIHYDROFOLATE
REDUCTASE)		 5uvr PILO PROTEIN
(Pseudomonas
aeruginosa) 		5 / 12 ILE A 148
LEU A 167
THR A 197
PRO A 110
ILE A 146
 None
None
MLY  A 196 ( 3.7A)
None
None
 1.03A 2cd2A-5uvrA:
undetectable		 2cd2A-5uvrA:
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.
2CIZ_A_ACTA1320_0
(CHLOROPEROXIDASE)		 3c0f UNCHARACTERIZED
PROTEIN AF_1514
(Archaeoglobus
fulgidus) 		4 / 6 ALA B  20
PHE B  79
ILE B  72
VAL B   9
 None
None
MLY  B  71 ( 4.0A)
MLY  B   8 ( 3.2A)
 0.89A 2cizA-3c0fB:
undetectable		 2cizA-3c0fB:
11.81
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.
2CIZ_A_ACTA1320_0
(CHLOROPEROXIDASE)		 5czw MYROILYSIN
(Myroides
profundi) 		4 / 6 ALA A  73
ILE A  54
VAL A  56
PHE A  86
 MLY  A  70 ( 3.8A)
None
None
MLY  A  70 ( 4.0A)
 0.94A 2cizA-5czwA:
undetectable		 2cizA-5czwA:
22.33
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.
2D06_A_ESTA304_1
(SULFOTRANSFERASE 1A1)		 4nge PRESEQUENCE
PROTEASE,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 10 PHE D  92
PRO D 170
HIS D 254
PHE D 169
ALA D 284
 None
None
None
MLY  D 287 ( 4.5A)
None
 1.36A 2d06A-4ngeD:
undetectable		 2d06A-4ngeD:
15.63
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.
2D06_B_ESTB305_1
(SULFOTRANSFERASE 1A1)		 4nge PRESEQUENCE
PROTEASE,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 10 PHE D  92
PRO D 170
HIS D 254
PHE D 169
ALA D 284
 None
None
None
MLY  D 287 ( 4.5A)
None
 1.36A 2d06B-4ngeD:
undetectable		 2d06B-4ngeD:
15.63
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.
2DG4_A_RAPA501_1
(FK506-BINDING
PROTEIN 1A)		 3lti DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA
(Escherichia
coli) 		5 / 11 TYR A 291
GLU A 240
ILE A 285
ILE A 269
PHE A 253
 MLY  A 295 ( 4.5A)
None
None
None
None
 1.24A 2dg4A-3ltiA:
undetectable		 2dg4A-3ltiA:
16.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2DRC_B_MTXB161_1
(DIHYDROFOLATE
REDUCTASE)		 2f4i HYPOTHETICAL PROTEIN
TM0957
(Thermotoga
maritima) 		5 / 12 ALA A 137
ILE A 204
LEU A 123
ILE A  96
THR A 138
 None
MLY  A 201 ( 4.6A)
None
None
None
 1.04A 2drcB-2f4iA:
undetectable		 2drcB-2f4iA:
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.
2DTT_D_H4BD1006_1
(HYPOTHETICAL PROTEIN
PH0634)		 5czw MYROILYSIN
(Myroides
profundi) 		5 / 10 HIS A 152
HIS A 146
THR A 139
GLU A 135
GLU A 143
 ZN  A 301 ( 3.1A)
ZN  A 301 ( 3.3A)
None
MLY  A  26 ( 4.2A)
ZN  A 301 ( 4.2A)
 1.19A 2dttD-5czwA:
undetectable
2dttF-5czwA:
undetectable		 2dttD-5czwA:
16.25
2dttF-5czwA:
16.25
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.
2F78_A_BEZA1003_0
(HTH-TYPE
TRANSCRIPTIONAL
REGULATOR BENM)		 4nge PRESEQUENCE
PROTEASE,
MITOCHONDRIAL
(Homo
sapiens) 		4 / 7 VAL D 489
LEU D 352
PHE D 484
THR D 345
 MLY  D 488 ( 3.3A)
None
MLY  D 488 ( 4.8A)
None
 1.07A 2f78A-4ngeD:
undetectable		 2f78A-4ngeD:
12.79
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.
2F8C_F_ZOLF9001_1
(FARNESYL DIPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 11 LEU A  71
ASP A  74
ARG A  85
THR A 164
GLN A 198
 None
UNL  A 273 (-3.0A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.82A 2f8cF-2ftzA:
25.2		 2f8cF-2ftzA:
25.84
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.
2F8C_F_ZOLF9001_1
(FARNESYL DIPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 11 LEU A  71
ASP A  80
ARG A  85
THR A 164
GLN A 198
 None
MLY  A 223 ( 3.6A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.54A 2f8cF-2ftzA:
25.2		 2f8cF-2ftzA:
25.84
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.
2F8Z_F_ZOLF5001_1
(FARNESYL DIPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 10 LEU A  71
ASP A  74
ARG A  85
THR A 164
GLN A 198
 None
UNL  A 273 (-3.0A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.83A 2f8zF-2ftzA:
25.3		 2f8zF-2ftzA:
25.84
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.
2F8Z_F_ZOLF5001_1
(FARNESYL DIPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 10 LEU A  71
ASP A  80
ARG A  85
THR A 164
GLN A 198
 None
MLY  A 223 ( 3.6A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.53A 2f8zF-2ftzA:
25.3		 2f8zF-2ftzA:
25.84
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.
2F94_F_BFQF9001_1
(FARNESYL DIPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 12 LEU A  71
ASP A  74
ARG A  85
THR A 164
GLN A 198
 None
UNL  A 273 (-3.0A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.81A 2f94F-2ftzA:
25.2		 2f94F-2ftzA:
25.84
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.
2F94_F_BFQF9001_1
(FARNESYL DIPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 12 LEU A  71
ASP A  80
ARG A  85
THR A 164
GLN A 198
 None
MLY  A 223 ( 3.6A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.42A 2f94F-2ftzA:
25.2		 2f94F-2ftzA:
25.84
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.
2F9K_F_ZOLF9001_1
(FARNESYL DIPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 10 LEU A  71
ASP A  74
ARG A  85
THR A 164
GLN A 198
 None
UNL  A 273 (-3.0A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.87A 2f9kF-2ftzA:
25.0		 2f9kF-2ftzA:
25.84
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.
2F9K_F_ZOLF9001_1
(FARNESYL DIPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 10 LEU A  71
ASP A  80
ARG A  85
THR A 164
GLN A 198
 None
MLY  A 223 ( 3.6A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.59A 2f9kF-2ftzA:
25.0		 2f9kF-2ftzA:
25.84
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.
2FCN_B_DVAB35_0
(UBIQUITIN)		 4qe0 HYPOTHETICAL PROTEIN
(Bacteroides
uniformis) 		4 / 6 LEU A 179
GLU A 174
ILE A 173
PRO A 172
 None
SO4  A 308 (-3.0A)
MLY  A 171 ( 4.3A)
MLY  A 171 ( 2.6A)
 1.11A 2fcnA-4qe0A:
undetectable
2fcnB-4qe0A:
undetectable		 2fcnA-4qe0A:
17.39
2fcnB-4qe0A:
17.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2FT9_A_CHDA130_0
(FATTY ACID-BINDING
PROTEIN 2, LIVER)		 3aag GENERAL
GLYCOSYLATION
PATHWAY PROTEIN
(Campylobacter
jejuni) 		5 / 12 PHE A 709
PHE A 659
ILE A 637
ILE A 640
PHE A 687
 None
None
None
MLY  A 641 ( 3.5A)
MLY  A 707 ( 4.4A)
 1.28A 2ft9A-3aagA:
undetectable		 2ft9A-3aagA:
18.90
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.
2FUM_D_MIXD3539_2
(PROBABLE
SERINE/THREONINE-PRO
TEIN KINASE PKNB)		 2etv IRON(III) ABC
TRANSPORTER,
PERIPLASMIC
IRON-BINDING
PROTEIN, PUTATIVE
(Thermotoga
maritima) 		3 / 3 VAL A 223
VAL A 241
ASP A 260
 None
MLY  A 238 (-3.8A)
EDO  A  13 (-2.9A)
 0.65A 2fumD-2etvA:
undetectable		 2fumD-2etvA:
26.01
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.
2G72_A_SAMA2001_0
(PHENYLETHANOLAMINE
N-METHYLTRANSFERASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 12 LEU A 178
VAL A  63
ALA A 169
CYH A 171
VAL A  42
 MLY  A 179 ( 4.3A)
None
MLY  A 187 ( 3.2A)
None
None
 1.45A 2g72A-2ftzA:
undetectable		 2g72A-2ftzA:
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.
2HC4_A_VDXA525_1
(VITAMIN D RECEPTOR)		 1xl3 PROTEIN TYPE A
SECRETION CONTROL
PROTEIN
(Yersinia
pestis) 		5 / 12 VAL A 271
SER A 270
VAL C  16
LEU C  70
LEU C  48
 None
None
None
MLY  C  49 ( 4.7A)
MLY  C  49 ( 3.8A)
 1.22A 2hc4A-1xl3A:
0.0		 2hc4A-1xl3A:
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.
2HRC_A_CHDA701_0
(FERROCHELATASE)		 5for PHOSPHOINOSITIDE
3-KINASE ADAPTER
PROTEIN 1
(Homo
sapiens) 		5 / 12 LEU A  81
LEU A  85
HIS A  42
LEU A  10
VAL A  64
 MLY  A  78 ( 4.3A)
None
None
None
None
 1.20A 2hrcA-5forA:
undetectable		 2hrcA-5forA:
16.85
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.
2J2P_B_SC2B1290_1
(FICOLIN-2)		 4gxr MALONYL COA
SYNTHETASE,
BENZOATE-COA LIGASE
CHIMERIC PROTEIN
(Paraburkholderia
xenovorans;
Rhodopseudomonas
palustris) 		4 / 8 LEU A 239
LEU A 228
ASP A 232
ASP A 234
 MLY  A 235 ( 3.6A)
MLY  A 230 ( 4.4A)
MLY  A 235 ( 3.5A)
None
 0.96A 2j2pA-4gxrA:
undetectable
2j2pB-4gxrA:
undetectable		 2j2pA-4gxrA:
17.23
2j2pB-4gxrA:
17.23
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.
2J5M_A_ACTA1321_0
(CHLOROPEROXIDASE)		 2g9n EUKARYOTIC
INITIATION FACTOR
4A-I
(Homo
sapiens) 		4 / 6 LEU A 211
PHE A 200
ILE A 196
ALA A 184
 None
None
MLY  A 193 ( 4.1A)
None
 1.06A 2j5mA-2g9nA:
undetectable		 2j5mA-2g9nA:
21.17
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.
2J5M_A_ACTA1321_0
(CHLOROPEROXIDASE)		 4fkm SIMILAR TO FERRIC
HYDROXAMATE RECEPTOR
1
(Staphylococcus
aureus) 		4 / 6 LEU A  81
ILE A  68
VAL A  71
ALA A  58
 MLY  A  82 ( 4.3A)
None
MLY  A  90 ( 4.8A)
None
 1.02A 2j5mA-4fkmA:
undetectable		 2j5mA-4fkmA:
25.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2J9D_J_ACTJ1116_0
(HYPOTHETICAL
NITROGEN REGULATORY
PII-LIKE PROTEIN
MJ0059)		 3oix PUTATIVE
DIHYDROOROTATE
DEHYDROGENASE
DIHYDROOROTATE
OXIDASE
(Streptococcus
mutans) 		4 / 8 GLU A 287
ILE A 284
GLU A 276
ILE A 280
 MLY  A 251 ( 4.7A)
MLY  A 251 ( 4.8A)
None
None
 0.90A 2j9dJ-3oixA:
undetectable
2j9dK-3oixA:
undetectable
2j9dL-3oixA:
undetectable		 2j9dJ-3oixA:
16.72
2j9dK-3oixA:
16.72
2j9dL-3oixA:
16.72
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.
2JAP_A_J01A1249_1
(CLAVALDEHYDE
DEHYDROGENASE)		 3sbu HYPOTHETICAL
NTF2-LIKE PROTEIN
(Bacteroides
fragilis) 		5 / 12 LEU A 116
ILE A  68
VAL A 137
TYR A 114
TYR A 239
 None
None
None
MLY  A 255 ( 4.0A)
GOL  A 289 (-4.8A)
 1.27A 2japA-3sbuA:
undetectable		 2japA-3sbuA:
19.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2JAP_C_J01C1249_1
(CLAVALDEHYDE
DEHYDROGENASE)		 3sbu HYPOTHETICAL
NTF2-LIKE PROTEIN
(Bacteroides
fragilis) 		5 / 12 LEU A 116
ILE A  68
VAL A 137
TYR A 114
TYR A 239
 None
None
None
MLY  A 255 ( 4.0A)
GOL  A 289 (-4.8A)
 1.26A 2japC-3sbuA:
undetectable		 2japC-3sbuA:
19.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2JAP_D_J01D1249_1
(CLAVALDEHYDE
DEHYDROGENASE)		 3sbu HYPOTHETICAL
NTF2-LIKE PROTEIN
(Bacteroides
fragilis) 		5 / 12 LEU A 116
ILE A  68
VAL A 137
TYR A 114
TYR A 239
 None
None
None
MLY  A 255 ( 4.0A)
GOL  A 289 (-4.8A)
 1.24A 2japD-3sbuA:
undetectable		 2japD-3sbuA:
19.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2JN3_A_JN3A131_1
(FATTY ACID-BINDING
PROTEIN, LIVER)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		5 / 12 VAL A 214
ILE A 115
THR A  83
VAL A 187
LEU A  10
 None
None
None
MLY  A 185 ( 4.6A)
MLY  A   9 ( 4.1A)
 1.25A 2jn3A-3ln3A:
undetectable		 2jn3A-3ln3A:
18.85
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.
2O1O_A_RISA400_1
(PUTATIVE FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 9 LEU A  71
ASP A  74
ARG A  85
THR A 164
GLN A 198
 None
UNL  A 273 (-3.0A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.97A 2o1oA-2ftzA:
23.4		 2o1oA-2ftzA:
25.86
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.
2O1O_A_RISA400_1
(PUTATIVE FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 9 LEU A  71
ASP A  80
ARG A  85
THR A 164
GLN A 198
 None
MLY  A 223 ( 3.6A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.65A 2o1oA-2ftzA:
23.4		 2o1oA-2ftzA:
25.86
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.
2O1O_B_RISB400_1
(PUTATIVE FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 10 LEU A  71
ASP A  74
ARG A  85
THR A 164
GLN A 198
 None
UNL  A 273 (-3.0A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.97A 2o1oB-2ftzA:
24.0		 2o1oB-2ftzA:
25.86
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.
2O1O_B_RISB400_1
(PUTATIVE FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 10 LEU A  71
ASP A  80
ARG A  85
THR A 164
GLN A 198
 None
MLY  A 223 ( 3.6A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.69A 2o1oB-2ftzA:
24.0		 2o1oB-2ftzA:
25.86
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.
2O4K_A_DR7A301_1
(PROTEASE)		 5z5c CYSTEINE SYNTHASE
(Fusobacterium
nucleatum) 		5 / 12 ARG A 104
ALA A 113
ILE A  69
GLY A  85
ILE A  94
 MLY  A 303 ( 4.0A)
MLY  A 114 ( 3.1A)
None
None
MLY  A 114 ( 4.5A)
 1.12A 2o4kA-5z5cA:
undetectable		 2o4kA-5z5cA:
20.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2O4P_A_TPVA300_2
(PROTEASE)		 2f4i HYPOTHETICAL PROTEIN
TM0957
(Thermotoga
maritima) 		5 / 9 LEU A 125
GLY A 180
ILE A 213
VAL A 112
ILE A 110
 None
None
None
MLY  A 113 ( 2.9A)
None
 0.97A 2o4pB-2f4iA:
undetectable		 2o4pB-2f4iA:
17.41
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.
2OIQ_A_STIA1001_2
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE SRC)		 3egl DEGV FAMILY PROTEIN
(Corynebacterium
glutamicum) 		4 / 5 LEU A 229
VAL A  17
LEU A  13
ARG A 112
 None
None
None
MLY  A 115 ( 4.4A)
 1.05A 2oiqA-3eglA:
undetectable		 2oiqA-3eglA:
19.34
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.
2OTH_A_IMNA301_1
(PHOSPHOLIPASE A2
VRV-PL-VIIIA)		 4fkm SIMILAR TO FERRIC
HYDROXAMATE RECEPTOR
1
(Staphylococcus
aureus) 		3 / 3 ASP A 282
TYR A 284
LYS A  83
 None
MLY  A  84 ( 3.9A)
MLY  A  84 ( 1.3A)
 1.19A 2othA-4fkmA:
undetectable		 2othA-4fkmA:
15.29
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.
2PH9_A_GNTA301_1
(SOLUBLE
ACETYLCHOLINE
RECEPTOR)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		4 / 7 GLN A  56
TYR A  55
TYR A 114
ILE A 115
 MLY  A 105 ( 3.6A)
NAD  A 327 ( 4.7A)
None
None
 1.15A 2ph9A-3ln3A:
undetectable
2ph9B-3ln3A:
undetectable		 2ph9A-3ln3A:
21.47
2ph9B-3ln3A:
21.47
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.
2PO5_B_CHDB503_0
(FERROCHELATASE,
MITOCHONDRIAL)		 1lln ANTIVIRAL PROTEIN 3
(Phytolacca
americana) 		3 / 3 LEU A 226
PRO A 227
LEU A 230
 None
None
MLY  A 231 ( 4.0A)
 0.51A 2po5B-1llnA:
undetectable		 2po5B-1llnA:
20.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2PO5_B_CHDB503_0
(FERROCHELATASE,
MITOCHONDRIAL)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		3 / 3 LEU A  40
PRO A  39
LEU A  43
 MLY  A   3 ( 4.6A)
None
None
 0.51A 2po5B-2ftzA:
undetectable		 2po5B-2ftzA:
20.37
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.
2PO7_A_CHDA501_0
(FERROCHELATASE,
MITOCHONDRIAL)		 5for PHOSPHOINOSITIDE
3-KINASE ADAPTER
PROTEIN 1
(Homo
sapiens) 		5 / 12 LEU A  81
LEU A  85
HIS A  42
LEU A  10
VAL A  64
 MLY  A  78 ( 4.3A)
None
None
None
None
 1.16A 2po7A-5forA:
3.2		 2po7A-5forA:
18.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2PO7_B_CHDB501_0
(FERROCHELATASE,
MITOCHONDRIAL)		 5for PHOSPHOINOSITIDE
3-KINASE ADAPTER
PROTEIN 1
(Homo
sapiens) 		5 / 12 LEU A  81
LEU A  85
HIS A  42
LEU A  10
VAL A  64
 MLY  A  78 ( 4.3A)
None
None
None
None
 1.20A 2po7B-5forA:
3.5		 2po7B-5forA:
18.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2PO7_B_CHDB503_0
(FERROCHELATASE,
MITOCHONDRIAL)		 1lln ANTIVIRAL PROTEIN 3
(Phytolacca
americana) 		3 / 3 LEU A 226
PRO A 227
LEU A 230
 None
None
MLY  A 231 ( 4.0A)
 0.51A 2po7B-1llnA:
undetectable		 2po7B-1llnA:
20.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2PO7_B_CHDB503_0
(FERROCHELATASE,
MITOCHONDRIAL)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		3 / 3 LEU A  40
PRO A  39
LEU A  43
 MLY  A   3 ( 4.6A)
None
None
 0.53A 2po7B-2ftzA:
undetectable		 2po7B-2ftzA:
20.37
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.
2Q58_A_ZOLA1_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 10 LEU A  71
ASP A  74
ARG A  85
THR A 164
GLN A 198
 None
UNL  A 273 (-3.0A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 1.13A 2q58A-2ftzA:
23.6		 2q58A-2ftzA:
25.86
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.
2Q58_A_ZOLA1_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 10 LEU A  71
ASP A  80
ARG A  85
THR A 164
GLN A 198
 None
MLY  A 223 ( 3.6A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.88A 2q58A-2ftzA:
23.6		 2q58A-2ftzA:
25.86
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.
2Q72_A_IXXA801_1
(TRANSPORTER)		 3lti DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA
(Escherichia
coli) 		5 / 11 LEU A 210
ILE A 425
PHE A 385
ALA A 206
LEU A 184
 None
MLY  A 422 ( 4.1A)
None
None
None
 1.11A 2q72A-3ltiA:
undetectable		 2q72A-3ltiA:
18.43
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.
2Q72_A_IXXA801_1
(TRANSPORTER)		 3lti DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA
(Escherichia
coli) 		5 / 11 LEU A 213
LEU A 210
ILE A 425
ALA A 206
LEU A 184
 MLY  A 422 ( 4.1A)
None
MLY  A 422 ( 4.1A)
None
None
 1.08A 2q72A-3ltiA:
undetectable		 2q72A-3ltiA:
18.43
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.
2QB4_A_DSMA801_1
(TRANSPORTER)		 3lti DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA
(Escherichia
coli) 		5 / 12 LEU A 210
ILE A 425
PHE A 385
ALA A 206
LEU A 184
 None
MLY  A 422 ( 4.1A)
None
None
None
 1.09A 2qb4A-3ltiA:
undetectable		 2qb4A-3ltiA:
18.43
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.
2QB4_A_DSMA801_1
(TRANSPORTER)		 3lti DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA
(Escherichia
coli) 		5 / 12 LEU A 213
LEU A 210
ILE A 425
ALA A 206
LEU A 184
 MLY  A 422 ( 4.1A)
None
MLY  A 422 ( 4.1A)
None
None
 1.06A 2qb4A-3ltiA:
undetectable		 2qb4A-3ltiA:
18.43
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.
2QBM_A_CAMA517_0
(CYTOCHROME P450-CAM)		 2vd9 ALANINE RACEMASE
(Bacillus
anthracis) 		4 / 8 PHE A 320
VAL A 334
THR A 335
ILE A 311
 None
MLY  A 333 ( 3.1A)
None
None
 0.97A 2qbmA-2vd9A:
undetectable		 2qbmA-2vd9A:
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.
2QD3_A_CHDA501_0
(FERROCHELATASE)		 3kv0 HET-C2
(Podospora
anserina) 		5 / 11 MET A  67
LEU A 197
ILE A  88
THR A  49
VAL A  26
 None
MLY  A 198 ( 4.3A)
None
MLY  A  64 ( 4.3A)
None
 1.19A 2qd3A-3kv0A:
undetectable		 2qd3A-3kv0A:
18.89
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.
2QD4_A_CHDA801_0
(FERROCHELATASE)		 5for PHOSPHOINOSITIDE
3-KINASE ADAPTER
PROTEIN 1
(Homo
sapiens) 		5 / 12 LEU A  81
LEU A  85
HIS A  42
LEU A  10
VAL A  64
 MLY  A  78 ( 4.3A)
None
None
None
None
 1.13A 2qd4A-5forA:
3.2		 2qd4A-5forA:
16.85
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.
2QD4_B_CHDB928_0
(FERROCHELATASE)		 5for PHOSPHOINOSITIDE
3-KINASE ADAPTER
PROTEIN 1
(Homo
sapiens) 		5 / 12 LEU A  81
LEU A  85
HIS A  42
LEU A  10
VAL A  64
 MLY  A  78 ( 4.3A)
None
None
None
None
 1.16A 2qd4B-5forA:
3.6		 2qd4B-5forA:
16.85
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.
2QD5_B_CHDB1104_0
(FERROCHELATASE)		 1lln ANTIVIRAL PROTEIN 3
(Phytolacca
americana) 		3 / 3 LEU A 226
PRO A 227
LEU A 230
 None
None
MLY  A 231 ( 4.0A)
 0.32A 2qd5B-1llnA:
undetectable		 2qd5B-1llnA:
21.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QJU_A_DSMA801_1
(TRANSPORTER)		 3lti DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA
(Escherichia
coli) 		5 / 11 LEU A 210
ILE A 425
PHE A 385
ALA A 206
LEU A 184
 None
MLY  A 422 ( 4.1A)
None
None
None
 1.13A 2qjuA-3ltiA:
undetectable		 2qjuA-3ltiA:
18.52
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.
2QJU_A_DSMA801_1
(TRANSPORTER)		 3lti DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA
(Escherichia
coli) 		5 / 11 LEU A 213
LEU A 210
ILE A 425
ALA A 206
LEU A 184
 MLY  A 422 ( 4.1A)
None
MLY  A 422 ( 4.1A)
None
None
 1.06A 2qjuA-3ltiA:
undetectable		 2qjuA-3ltiA:
18.52
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.
2QK8_A_MTXA200_1
(DIHYDROFOLATE
REDUCTASE)		 4h3w HYPOTHETICAL PROTEIN
(Parabacteroides
distasonis) 		5 / 12 LEU A 221
VAL A 219
ILE A 185
LEU A 182
PRO A 166
 None
None
MLY  A 181 ( 4.4A)
MLY  A 181 ( 4.7A)
None
 1.12A 2qk8A-4h3wA:
undetectable		 2qk8A-4h3wA:
19.33
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.
2QQT_A_AINA596_1
(LACTOPEROXIDASE)		 4nk6 POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE
(Pseudomonas
syringae
group
genomosp.
3) 		4 / 6 ARG A 186
GLU A 213
GLN A 189
PRO A 229
 None
MLY  A 191 ( 4.8A)
None
None
 1.32A 2qqtA-4nk6A:
undetectable		 2qqtA-4nk6A:
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.
2QQT_A_AINA596_1
(LACTOPEROXIDASE)		 4ozy POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE
(Pseudomonas
syringae
group
genomosp.
3) 		4 / 6 ARG A 186
GLU A 213
GLN A 189
PRO A 229
 None
MLY  A 191 ( 4.8A)
None
None
 1.26A 2qqtA-4ozyA:
undetectable		 2qqtA-4ozyA:
21.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QWX_A_ML1A233_1
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])		 5evi BETA-LACTAMASE/D-ALA
NINE
CARBOXYPEPTIDASE
(Pseudomonas
syringae
group
genomosp.
3) 		4 / 8 PHE B  39
ILE B 231
GLY B  35
ILE B 238
 EDO  B 401 ( 4.6A)
None
MLY  B  36 ( 2.4A)
None
 0.95A 2qwxA-5eviB:
undetectable
2qwxB-5eviB:
undetectable		 2qwxA-5eviB:
21.20
2qwxB-5eviB:
21.20
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.
2R5P_B_MK1B902_1
(PROTEASE)		 4nk6 POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE
(Pseudomonas
syringae
group
genomosp.
3) 		5 / 12 VAL A 303
ILE A 316
GLY A 315
GLY A 292
ILE A 281
 MLY  A 304 ( 3.2A)
None
None
None
None
 0.95A 2r5pA-4nk6A:
undetectable		 2r5pA-4nk6A:
11.81
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.
2R5P_D_MK1D902_1
(PROTEASE)		 4nk6 POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE
(Pseudomonas
syringae
group
genomosp.
3) 		5 / 12 VAL A 303
ILE A 316
GLY A 315
GLY A 292
ILE A 281
 MLY  A 304 ( 3.2A)
None
None
None
None
 0.94A 2r5pC-4nk6A:
undetectable		 2r5pC-4nk6A:
11.81
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.
2V0G_A_LEUA1887_0
(AMINOACYL-TRNA
SYNTHETASE)		 3gs9 PROTEIN GP18
(Listeria
monocytogenes) 		4 / 8 TYR A 266
ASP A 265
SER A 230
TYR A 228
 None
None
None
MLY  A 260 ( 3.9A)
 1.29A 2v0gA-3gs9A:
undetectable		 2v0gA-3gs9A:
16.63
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.
2V0M_D_KLND1498_1
(CYTOCHROME P450 3A4)		 3egl DEGV FAMILY PROTEIN
(Corynebacterium
glutamicum) 		5 / 11 LEU A 221
ILE A 168
PHE A 189
ALA A 188
GLU A 145
 None
None
None
MLY  A 187 ( 3.7A)
None
 1.20A 2v0mD-3eglA:
undetectable		 2v0mD-3eglA:
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.
2V95_A_HCYA1375_1
(CORTICOSTEROID-BINDI
NG GLOBULIN)		 5thm ESTERASE-6
(Drosophila
melanogaster) 		5 / 12 ALA A 418
VAL A 313
GLN A 308
PHE A 306
LYS A 414
 None
None
MLY  A 413 ( 3.5A)
None
MLY  A 413 ( 3.1A)
 1.27A 2v95A-5thmA:
undetectable		 2v95A-5thmA:
20.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2VCV_A_ASDA1224_1
(GLUTATHIONE
S-TRANSFERASE A3)		 5thm ESTERASE-6
(Drosophila
melanogaster) 		4 / 7 PHE A 279
ALA A 264
LEU A 261
PHE A  42
 None
None
MLY  A 256 ( 4.9A)
None
 0.92A 2vcvA-5thmA:
undetectable		 2vcvA-5thmA:
21.32
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.
2VCV_F_ASDF1224_1
(GLUTATHIONE
S-TRANSFERASE A3)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		4 / 8 LEU A 134
ALA A  69
ALA A 111
PHE A 127
 MLY  A 133 (-4.0A)
None
None
None
 0.84A 2vcvF-2ftzA:
undetectable		 2vcvF-2ftzA:
23.78
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.
2VCV_G_ASDG1224_1
(GLUTATHIONE
S-TRANSFERASE A3)		 5thm ESTERASE-6
(Drosophila
melanogaster) 		4 / 7 PHE A 279
ALA A 264
LEU A 261
PHE A  42
 None
None
MLY  A 256 ( 4.9A)
None
 0.91A 2vcvG-5thmA:
undetectable		 2vcvG-5thmA:
21.32
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.
2VCV_L_ASDL1224_1
(GLUTATHIONE
S-TRANSFERASE A3)		 5thm ESTERASE-6
(Drosophila
melanogaster) 		4 / 7 PHE A 279
ALA A 264
LEU A 261
PHE A  42
 None
None
MLY  A 256 ( 4.9A)
None
 0.93A 2vcvL-5thmA:
undetectable		 2vcvL-5thmA:
21.32
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.
2VDB_A_NPSA1591_1
(SERUM ALBUMIN)		 4dws CHI2
(Yersinia
entomophaga) 		4 / 8 ILE A 435
PHE A 548
LEU A 491
GLY A 553
 None
None
None
MLY  A 552 ( 2.4A)
 0.96A 2vdbA-4dwsA:
undetectable		 2vdbA-4dwsA:
20.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2W8Y_A_486A1000_1
(PROGESTERONE
RECEPTOR)		 2g9n EUKARYOTIC
INITIATION FACTOR
4A-I
(Homo
sapiens) 		5 / 12 LEU A 181
GLN A  93
PHE A 200
LEU A 203
VAL A 120
 None
None
None
MLY  A 202 ( 4.2A)
None
 1.44A 2w8yA-2g9nA:
undetectable		 2w8yA-2g9nA:
21.61
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.
2W98_A_P1ZA1352_1
(PROSTAGLANDIN
REDUCTASE 2)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		4 / 7 TYR A 259
LEU A 299
ASN A 300
LYS A 302
 None
None
MLY  A 301 ( 3.4A)
MLY  A 301 ( 2.8A)
 1.45A 2w98A-3ln3A:
1.3
2w98B-3ln3A:
undetectable		 2w98A-3ln3A:
23.18
2w98B-3ln3A:
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.
2X2N_D_X2ND1479_1
(LANOSTEROL
14-ALPHA-DEMETHYLASE)		 2q7x UPF0052 PROTEIN
SP_1565
(Streptococcus
pneumoniae) 		5 / 12 ILE A 218
ALA A 110
THR A 107
LEU A  58
MET A  65
 None
None
None
None
MLY  A 123 ( 4.5A)
 1.14A 2x2nD-2q7xA:
undetectable		 2x2nD-2q7xA:
22.52
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.
2X45_A_HSMA1161_1
(ALLERGEN ARG R 1)		 2etv IRON(III) ABC
TRANSPORTER,
PERIPLASMIC
IRON-BINDING
PROTEIN, PUTATIVE
(Thermotoga
maritima) 		4 / 5 TYR A 212
VAL A 194
ASP A 250
SER A 207
 None
None
None
MLY  A 232 ( 4.6A)
 1.28A 2x45A-2etvA:
undetectable		 2x45A-2etvA:
16.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2X45_C_HSMC1161_1
(ALLERGEN ARG R 1)		 2etv IRON(III) ABC
TRANSPORTER,
PERIPLASMIC
IRON-BINDING
PROTEIN, PUTATIVE
(Thermotoga
maritima) 		4 / 5 TYR A 212
VAL A 194
ASP A 250
SER A 207
 None
None
None
MLY  A 232 ( 4.6A)
 1.26A 2x45C-2etvA:
undetectable		 2x45C-2etvA:
16.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2X7H_A_PFNA1374_1
(ZINC-BINDING ALCOHOL
DEHYDROGENASE
DOMAIN-CONTAINING
PROTEIN 2)		 4qe0 HYPOTHETICAL PROTEIN
(Bacteroides
uniformis) 		4 / 6 PRO A 190
LYS A 121
GLU A 147
TYR A 149
 MLY  A 189 ( 2.6A)
MLY  A 120 ( 2.9A)
None
None
 1.38A 2x7hA-4qe0A:
undetectable		 2x7hA-4qe0A:
19.45
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.
2XDC_A_DVAA8_0
(GRAMICIDIN A)		 4nk6 POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE
(Pseudomonas
syringae
group
genomosp.
3) 		3 / 3 VAL A 303
TRP A 240
TRP A 280
 MLY  A 304 ( 3.2A)
MLY  A  89 ( 3.7A)
MLY  A  89 ( 4.8A)
 1.39A 2xdcA-4nk6A:
undetectable
2xdcB-4nk6A:
undetectable		 2xdcA-4nk6A:
3.34
2xdcB-4nk6A:
3.34
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.
2XDC_B_DVAB8_0
(GRAMICIDIN A)		 4nk6 POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE
(Pseudomonas
syringae
group
genomosp.
3) 		3 / 3 TRP A 280
VAL A 303
TRP A 240
 MLY  A  89 ( 4.8A)
MLY  A 304 ( 3.2A)
MLY  A  89 ( 3.7A)
 1.40A 2xdcA-4nk6A:
undetectable
2xdcB-4nk6A:
undetectable		 2xdcA-4nk6A:
3.34
2xdcB-4nk6A:
3.34
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.
2XDC_C_DVAC8_0
(GRAMICIDIN A)		 4nk6 POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE
(Pseudomonas
syringae
group
genomosp.
3) 		3 / 3 VAL A 303
TRP A 240
TRP A 280
 MLY  A 304 ( 3.2A)
MLY  A  89 ( 3.7A)
MLY  A  89 ( 4.8A)
 1.01A 2xdcC-4nk6A:
undetectable
2xdcD-4nk6A:
undetectable		 2xdcC-4nk6A:
3.34
2xdcD-4nk6A:
3.34
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.
2XN5_A_FUNA1356_1
(THYROXINE-BINDING
GLOBULIN)		 4h3w HYPOTHETICAL PROTEIN
(Parabacteroides
distasonis) 		5 / 11 LEU A 215
LEU A 123
SER A 137
LEU A 136
LEU A 155
 MLY  A 124 ( 4.7A)
MLY  A 124 ( 4.0A)
None
None
None
 1.03A 2xn5A-4h3wA:
undetectable		 2xn5A-4h3wA:
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.
2XN5_A_FUNA1356_2
(THYROXINE-BINDING
GLOBULIN)		 4a5p PROTEIN MXIA
(Shigella
flexneri) 		3 / 3 LEU A 658
ARG A 657
ILE A 659
 None
None
MLY  A 656 ( 4.3A)
 0.66A 2xn5B-4a5pA:
undetectable		 2xn5B-4a5pA:
7.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Y5M_A_DVAA8_0
(VAL-GRAMICIDIN A)		 4nk6 POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE
(Pseudomonas
syringae
group
genomosp.
3) 		3 / 3 VAL A 303
TRP A 240
TRP A 280
 MLY  A 304 ( 3.2A)
MLY  A  89 ( 3.7A)
MLY  A  89 ( 4.8A)
 1.39A 2y5mA-4nk6A:
undetectable
2y5mB-4nk6A:
undetectable		 2y5mA-4nk6A:
3.34
2y5mB-4nk6A:
3.34
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.
2Y69_C_CHDC1265_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 5czw MYROILYSIN
(Myroides
profundi) 		4 / 5 PHE A  84
PHE A  86
LEU A  58
PHE A  98
 None
MLY  A  70 ( 4.0A)
None
None
 1.25A 2y69C-5czwA:
undetectable
2y69J-5czwA:
undetectable		 2y69C-5czwA:
21.15
2y69J-5czwA:
13.48
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.
2Y69_C_CHDC1265_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 5czw MYROILYSIN
(Myroides
profundi) 		4 / 5 PHE A 127
PHE A  98
LEU A  58
PHE A  86
 None
None
None
MLY  A  70 ( 4.0A)
 1.00A 2y69C-5czwA:
undetectable
2y69J-5czwA:
undetectable		 2y69C-5czwA:
21.15
2y69J-5czwA:
13.48
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.
2Y69_P_CHDP1265_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 5czw MYROILYSIN
(Myroides
profundi) 		4 / 5 PHE A  84
PHE A  86
LEU A  58
PHE A  98
 None
MLY  A  70 ( 4.0A)
None
None
 1.22A 2y69P-5czwA:
undetectable
2y69W-5czwA:
undetectable		 2y69P-5czwA:
21.15
2y69W-5czwA:
13.48
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.
2Y6N_A_DVAA8_0
(VAL-GRAMICIDIN A)		 4nk6 POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE
(Pseudomonas
syringae
group
genomosp.
3) 		3 / 3 VAL A 303
TRP A 240
TRP A 280
 MLY  A 304 ( 3.2A)
MLY  A  89 ( 3.7A)
MLY  A  89 ( 4.8A)
 1.38A 2y6nA-4nk6A:
undetectable
2y6nB-4nk6A:
undetectable		 2y6nA-4nk6A:
3.34
2y6nB-4nk6A:
3.34
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.
2Y6N_B_DVAB8_0
(VAL-GRAMICIDIN A)		 4nk6 POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE
(Pseudomonas
syringae
group
genomosp.
3) 		3 / 3 TRP A 280
VAL A 303
TRP A 240
 MLY  A  89 ( 4.8A)
MLY  A 304 ( 3.2A)
MLY  A  89 ( 3.7A)
 1.38A 2y6nA-4nk6A:
undetectable
2y6nB-4nk6A:
undetectable		 2y6nA-4nk6A:
3.34
2y6nB-4nk6A:
3.34
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.
2Y7W_C_SALC1300_1
(LYSR-TYPE REGULATORY
PROTEIN)		 2f4i HYPOTHETICAL PROTEIN
TM0957
(Thermotoga
maritima) 		4 / 7 THR A 138
ILE A 140
GLY A 139
PHE A 152
 None
MLY  A  51 ( 4.9A)
None
MLY  A 142 ( 4.3A)
 0.84A 2y7wC-2f4iA:
undetectable		 2y7wC-2f4iA:
21.32
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.
2YA7_C_ZMRC1776_2
(NEURAMINIDASE A)		 3aag GENERAL
GLYCOSYLATION
PATHWAY PROTEIN
(Campylobacter
jejuni) 		4 / 6 ARG A 450
ASP A 452
ILE A 560
GLU A 510
 MLY  A 445 ( 3.3A)
None
None
MLY  A 471 ( 3.0A)
 1.39A 2ya7C-3aagA:
undetectable		 2ya7C-3aagA:
20.08
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2YGN_A_PCFA1179_0
(WNT INHIBITORY
FACTOR 1)		 2ygn WNT INHIBITORY
FACTOR 1
(Homo
sapiens) 		12 / 12 LEU A  36
ILE A  40
LEU A  48
ILE A  55
MET A  63
ARG A  76
MET A  77
ILE A  80
MET A  87
PHE A  89
VAL A 152
VAL A 154
 PCF  A1179 ( 4.0A)
None
PCF  A1179 (-4.1A)
PCF  A1179 ( 4.5A)
PCF  A1179 ( 4.1A)
MLY  A  72 (-4.5A)
PCF  A1179 (-4.0A)
None
PCF  A1179 (-3.6A)
PCF  A1179 ( 3.8A)
PCF  A1179 (-4.4A)
PCF  A1179 ( 4.7A)
 0.00A 2ygnA-2ygnA:
29.7		 2ygnA-2ygnA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2YGP_A_PCFA1213_0
(WNT INHIBITORY
FACTOR 1)		 2ygn WNT INHIBITORY
FACTOR 1
(Homo
sapiens) 		12 / 12 LEU A  38
ILE A  40
LEU A  48
ILE A  57
MET A  87
TRP A  91
PHE A 138
PHE A 150
VAL A 152
VAL A 154
PRO A 168
PHE A 173
 PCF  A1179 ( 4.0A)
None
PCF  A1179 (-4.1A)
PCF  A1179 ( 4.7A)
PCF  A1179 (-3.6A)
None
None
None
PCF  A1179 (-4.4A)
PCF  A1179 ( 4.7A)
MLY  A 166 ( 3.9A)
PCF  A1179 (-3.8A)
 0.16A 2ygpA-2ygnA:
28.2		 2ygpA-2ygnA:
82.45
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2YGP_A_PCFA1213_0
(WNT INHIBITORY
FACTOR 1)		 2ygn WNT INHIBITORY
FACTOR 1
(Homo
sapiens) 		6 / 12 LEU A  38
ILE A  55
LEU A  48
ILE A  57
PRO A 168
PHE A 173
 PCF  A1179 ( 4.0A)
PCF  A1179 ( 4.5A)
PCF  A1179 (-4.1A)
PCF  A1179 ( 4.7A)
MLY  A 166 ( 3.9A)
PCF  A1179 (-3.8A)
 1.35A 2ygpA-2ygnA:
28.2		 2ygpA-2ygnA:
82.45
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2YGP_A_PCFA1213_0
(WNT INHIBITORY
FACTOR 1)		 2ygo WNT INHIBITORY
FACTOR 1
(Homo
sapiens) 		12 / 12 LEU A  38
ILE A  40
LEU A  48
ILE A  57
MET A  87
TRP A  91
PHE A 138
PHE A 150
VAL A 152
VAL A 154
PRO A 168
PHE A 173
 PCF  A1213 ( 3.9A)
None
PCF  A1213 (-4.3A)
PCF  A1213 ( 4.8A)
PCF  A1213 ( 3.8A)
None
None
None
PCF  A1213 ( 4.7A)
PCF  A1213 ( 4.7A)
MLY  A 166 ( 4.0A)
PCF  A1213 (-3.8A)
 0.13A 2ygpA-2ygoA:
29.0		 2ygpA-2ygoA:
99.47
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2YGP_A_PCFA1213_0
(WNT INHIBITORY
FACTOR 1)		 2ygo WNT INHIBITORY
FACTOR 1
(Homo
sapiens) 		6 / 12 LEU A  38
ILE A  55
LEU A  48
ILE A  57
PRO A 168
PHE A 173
 PCF  A1213 ( 3.9A)
PCF  A1213 (-4.0A)
PCF  A1213 (-4.3A)
PCF  A1213 ( 4.8A)
MLY  A 166 ( 4.0A)
PCF  A1213 (-3.8A)
 1.36A 2ygpA-2ygoA:
29.0		 2ygpA-2ygoA:
99.47
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2YGP_A_PCFA1213_1
(WNT INHIBITORY
FACTOR 1)		 2ygn WNT INHIBITORY
FACTOR 1
(Homo
sapiens) 		5 / 9 ILE A  55
PHE A  66
ARG A  76
ILE A  80
PHE A  89
 PCF  A1179 ( 4.5A)
PCF  A1179 (-3.8A)
MLY  A  72 (-4.5A)
None
PCF  A1179 ( 3.8A)
 1.39A 2ygpA-2ygnA:
28.2		 2ygpA-2ygnA:
82.45
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.
2YGP_A_PCFA1213_1
(WNT INHIBITORY
FACTOR 1)		 4nge PRESEQUENCE
PROTEASE,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 9 ILE D 687
PRO D 766
ILE D 768
PHE D 668
VAL D 585
 None
MLY  D 764 ( 4.5A)
MLY  D 769 ( 3.8A)
None
None
 1.23A 2ygpA-4ngeD:
undetectable		 2ygpA-4ngeD:
10.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ZIF_B_SAMB298_1
(PUTATIVE
MODIFICATION
METHYLASE)		 1lln ANTIVIRAL PROTEIN 3
(Phytolacca
americana) 		3 / 3 ASP A 249
THR A  10
GLU A 180
 None
None
MLY  A 177 ( 3.3A)
 0.68A 2zifB-1llnA:
undetectable		 2zifB-1llnA:
21.81
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.
2ZJ0_D_2FAD500_1
(ADENOSYLHOMOCYSTEINA
SE)		 4f6e SUPEROXIDE DISMUTASE
[MN], MITOCHONDRIAL
(Saccharomyces
cerevisiae) 		5 / 12 HIS A  81
ASP A 168
HIS A 172
GLY A  76
PHE A 135
 MN  A 301 (-3.4A)
MN  A 301 (-2.6A)
MN  A 301 (-3.4A)
MLY  A  72 ( 3.5A)
None
 1.08A 2zj0D-4f6eA:
undetectable		 2zj0D-4f6eA:
19.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ZZN_A_SAMA401_0
(UNCHARACTERIZED
PROTEIN MJ0883)		 4nk6 POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE
(Pseudomonas
syringae
group
genomosp.
3) 		5 / 12 TYR A 291
PHE A 293
GLY A 315
VAL A 303
PHE A 301
 None
None
None
MLY  A 304 ( 3.2A)
None
 1.20A 2zznA-4nk6A:
undetectable		 2zznA-4nk6A:
23.34
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.
3ABM_C_CHDC271_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 5czw MYROILYSIN
(Myroides
profundi) 		4 / 5 PHE A  84
PHE A  86
LEU A  58
PHE A  98
 None
MLY  A  70 ( 4.0A)
None
None
 1.28A 3abmC-5czwA:
undetectable
3abmJ-5czwA:
undetectable		 3abmC-5czwA:
21.15
3abmJ-5czwA:
18.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ABM_C_CHDC271_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 5czw MYROILYSIN
(Myroides
profundi) 		4 / 5 PHE A 127
PHE A  98
LEU A  58
PHE A  86
 None
None
None
MLY  A  70 ( 4.0A)
 1.02A 3abmC-5czwA:
undetectable
3abmJ-5czwA:
undetectable		 3abmC-5czwA:
21.15
3abmJ-5czwA:
18.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ABM_P_CHDP1271_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 5czw MYROILYSIN
(Myroides
profundi) 		4 / 5 PHE A  84
PHE A  86
LEU A  58
PHE A  98
 None
MLY  A  70 ( 4.0A)
None
None
 1.21A 3abmP-5czwA:
undetectable
3abmW-5czwA:
undetectable		 3abmP-5czwA:
21.15
3abmW-5czwA:
18.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ABM_P_CHDP1271_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 5czw MYROILYSIN
(Myroides
profundi) 		4 / 5 PHE A 127
PHE A  98
LEU A  58
PHE A  86
 None
None
None
MLY  A  70 ( 4.0A)
 0.97A 3abmP-5czwA:
undetectable
3abmW-5czwA:
undetectable		 3abmP-5czwA:
21.15
3abmW-5czwA:
18.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AF3_A_PAUA314_0
(PANTOTHENATE KINASE)		 3kv0 HET-C2
(Podospora
anserina) 		4 / 6 PHE A 135
MET A 159
PHE A  60
PHE A  52
 None
None
None
MLY  A  64 ( 4.5A)
 1.32A 3af3A-3kv0A:
undetectable		 3af3A-3kv0A:
21.47
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.
3AG3_C_CHDC271_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 5czw MYROILYSIN
(Myroides
profundi) 		4 / 5 PHE A  84
PHE A  86
LEU A  58
PHE A  98
 None
MLY  A  70 ( 4.0A)
None
None
 1.22A 3ag3C-5czwA:
undetectable
3ag3J-5czwA:
undetectable		 3ag3C-5czwA:
21.15
3ag3J-5czwA:
18.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AG3_C_CHDC271_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 5czw MYROILYSIN
(Myroides
profundi) 		4 / 5 PHE A 127
PHE A  98
LEU A  58
PHE A  86
 None
None
None
MLY  A  70 ( 4.0A)
 1.09A 3ag3C-5czwA:
undetectable
3ag3J-5czwA:
undetectable		 3ag3C-5czwA:
21.15
3ag3J-5czwA:
18.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AOC_C_ERYC3402_1
(ACRIFLAVINE
RESISTANCE PROTEIN B)		 4nge PRESEQUENCE
PROTEASE,
MITOCHONDRIAL
(Homo
sapiens) 		3 / 3 THR D 872
SER D 882
LYS D 885
 None
None
MLY  D 884 ( 3.1A)
 1.17A 3aocC-4ngeD:
5.2		 3aocC-4ngeD:
21.85
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.
3BJW_B_SVRB512_1
(PHOSPHOLIPASE A2)		 4xl1 DELTA-LIKE PROTEIN
(Rattus
norvegicus) 		4 / 5 VAL B 173
VAL B 174
THR B 110
ARG B 172
 None
None
None
MLY  B 153 ( 3.5A)
 1.12A 3bjwA-4xl1B:
undetectable		 3bjwA-4xl1B:
21.46
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3BUR_B_TESB340_1
(3-OXO-5-BETA-STEROID
4-DEHYDROGENASE)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		5 / 10 TYR A  24
TRP A  86
THR A 221
TRP A 227
VAL A 228
 MLY  A  25 (-3.6A)
None
NAD  A 327 (-4.1A)
MRD  A 328 (-4.0A)
None
 0.79A 3burB-3ln3A:
49.3		 3burB-3ln3A:
51.53
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.
3BWM_A_SAMA301_0
(CATECHOL
O-METHYLTRANSFERASE)		 3aag GENERAL
GLYCOSYLATION
PATHWAY PROTEIN
(Campylobacter
jejuni) 		5 / 12 ASN A 691
TYR A 645
ASN A 638
SER A 664
GLN A 670
 None
MLY  A 646 ( 4.1A)
None
None
None
 1.28A 3bwmA-3aagA:
undetectable		 3bwmA-3aagA:
18.89
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.
3CS9_C_NILC600_2
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE ABL1)		 5chx XRCC4-MYH7-1590-1657
(Homo
sapiens) 		5 / 9 LEU A 108
VAL A  22
ILE A   8
VAL A  33
PHE A 111
 MLY  A  99 ( 4.5A)
MLY  A   4 ( 4.4A)
None
None
None
 0.97A 3cs9C-5chxA:
undetectable		 3cs9C-5chxA:
21.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3DCJ_A_THHA401_0
(PROBABLE
5'-PHOSPHORIBOSYLGLY
CINAMIDE
FORMYLTRANSFERASE
PURN)		 2etv IRON(III) ABC
TRANSPORTER,
PERIPLASMIC
IRON-BINDING
PROTEIN, PUTATIVE
(Thermotoga
maritima) 		5 / 12 SER A 270
ILE A 205
LEU A 348
VAL A 274
PRO A 236
 None
None
None
MLY  A 275 ( 3.0A)
EDO  A  13 (-4.5A)
 1.26A 3dcjA-2etvA:
3.1
3dcjB-2etvA:
3.1		 3dcjA-2etvA:
22.90
3dcjB-2etvA:
22.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3DRC_B_MTXB361_1
(DIHYDROFOLATE
REDUCTASE)		 2f4i HYPOTHETICAL PROTEIN
TM0957
(Thermotoga
maritima) 		5 / 12 ALA A 137
ILE A 204
LEU A 123
ILE A  96
THR A 138
 None
MLY  A 201 ( 4.6A)
None
None
None
 1.02A 3drcB-2f4iA:
undetectable		 3drcB-2f4iA:
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.
3E9R_A_ACTA700_0
(PURINE-NUCLEOSIDE
PHOSPHORYLASE)		 3oix PUTATIVE
DIHYDROOROTATE
DEHYDROGENASE
DIHYDROOROTATE
OXIDASE
(Streptococcus
mutans) 		4 / 6 GLY A  47
GLY A 103
MET A 104
ASN A  75
 MLY  A  45 ( 3.8A)
None
None
None
 1.00A 3e9rA-3oixA:
undetectable		 3e9rA-3oixA:
23.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3E9R_C_ACTC700_0
(PURINE-NUCLEOSIDE
PHOSPHORYLASE)		 3oix PUTATIVE
DIHYDROOROTATE
DEHYDROGENASE
DIHYDROOROTATE
OXIDASE
(Streptococcus
mutans) 		4 / 6 GLY A  47
GLY A 103
MET A 104
ASN A  75
 MLY  A  45 ( 3.8A)
None
None
None
 1.00A 3e9rC-3oixA:
undetectable		 3e9rC-3oixA:
23.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ELU_A_SAMA4633_0
(METHYLTRANSFERASE)		 2etv IRON(III) ABC
TRANSPORTER,
PERIPLASMIC
IRON-BINDING
PROTEIN, PUTATIVE
(Thermotoga
maritima) 		5 / 12 GLY A  91
GLY A  45
GLY A  93
THR A 115
LEU A 136
 None
None
MLY  A  97 ( 4.2A)
None
None
 1.09A 3eluA-2etvA:
undetectable		 3eluA-2etvA:
24.62
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.
3ELU_A_SAMA4633_0
(METHYLTRANSFERASE)		 3sbu HYPOTHETICAL
NTF2-LIKE PROTEIN
(Bacteroides
fragilis) 		5 / 12 GLY A 258
GLY A 256
VAL A 137
PHE A 152
ILE A  68
 None
MLY  A 255 ( 2.4A)
None
None
None
 1.00A 3eluA-3sbuA:
undetectable		 3eluA-3sbuA:
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.
3ERD_A_DESA600_1
(ESTROGEN RECEPTOR
ALPHA)		 2i6g PUTATIVE
METHYLTRANSFERASE
(Salmonella
enterica) 		5 / 12 LEU A  23
ALA A  25
LEU A 100
LEU A 131
LEU A  48
 None
MLY  A 167 ( 4.2A)
None
None
None
 1.20A 3erdA-2i6gA:
undetectable		 3erdA-2i6gA:
20.51
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.
3ETE_A_H3PA552_1
(GLUTAMATE
DEHYDROGENASE)		 4gxr MALONYL COA
SYNTHETASE,
BENZOATE-COA LIGASE
CHIMERIC PROTEIN
(Paraburkholderia
xenovorans;
Rhodopseudomonas
palustris) 		4 / 6 ILE A 274
TYR A 313
MET A 270
HIS A 201
 None
None
None
MLY  A  62 ( 3.6A)
 1.15A 3eteA-4gxrA:
4.4
3eteE-4gxrA:
4.5		 3eteA-4gxrA:
22.98
3eteE-4gxrA:
22.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ETE_C_H3PC554_1
(GLUTAMATE
DEHYDROGENASE)		 4gxr MALONYL COA
SYNTHETASE,
BENZOATE-COA LIGASE
CHIMERIC PROTEIN
(Paraburkholderia
xenovorans;
Rhodopseudomonas
palustris) 		4 / 5 ILE A 274
TYR A 313
MET A 270
HIS A 201
 None
None
None
MLY  A  62 ( 3.6A)
 1.16A 3eteB-4gxrA:
4.6
3eteC-4gxrA:
5.0		 3eteB-4gxrA:
22.98
3eteC-4gxrA:
22.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ETE_F_H3PF552_1
(GLUTAMATE
DEHYDROGENASE)		 4gxr MALONYL COA
SYNTHETASE,
BENZOATE-COA LIGASE
CHIMERIC PROTEIN
(Paraburkholderia
xenovorans;
Rhodopseudomonas
palustris) 		4 / 7 MET A 270
HIS A 201
ILE A 274
TYR A 313
 None
MLY  A  62 ( 3.6A)
None
None
 1.14A 3eteD-4gxrA:
5.0
3eteF-4gxrA:
4.4		 3eteD-4gxrA:
22.98
3eteF-4gxrA:
22.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3EZ3_D_ZOLD397_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE, PUTATIVE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 10 LEU A  71
ASP A  74
ARG A  85
THR A 164
GLN A 198
 None
UNL  A 273 (-3.0A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.87A 3ez3D-2ftzA:
23.7		 3ez3D-2ftzA:
25.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3EZ3_D_ZOLD397_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE, PUTATIVE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 10 LEU A  71
ASP A  80
ARG A  85
THR A 164
GLN A 198
 None
MLY  A 223 ( 3.6A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.54A 3ez3D-2ftzA:
23.7		 3ez3D-2ftzA:
25.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3F8W_A_ADNA300_1
(PURINE-NUCLEOSIDE
PHOSPHORYLASE)		 3oix DIHYDROOROTATE
OXIDASE
PUTATIVE
DIHYDROOROTATE
DEHYDROGENASE
(Streptococcus
mutans) 		5 / 12 GLY A  47
VAL A 102
GLY A 103
MET A 104
ASN A  75
 MLY  A  45 ( 3.8A)
None
None
None
None
 0.98A 3f8wA-3oixA:
undetectable		 3f8wA-3oixA:
23.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3F8W_B_ADNB301_1
(PURINE-NUCLEOSIDE
PHOSPHORYLASE)		 3oix DIHYDROOROTATE
OXIDASE
PUTATIVE
DIHYDROOROTATE
DEHYDROGENASE
(Streptococcus
mutans) 		5 / 12 GLY A  47
VAL A 102
GLY A 103
MET A 104
ASN A  75
 MLY  A  45 ( 3.8A)
None
None
None
None
 0.99A 3f8wB-3oixA:
undetectable		 3f8wB-3oixA:
23.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3F8W_C_ADNC302_1
(PURINE-NUCLEOSIDE
PHOSPHORYLASE)		 3oix DIHYDROOROTATE
OXIDASE
PUTATIVE
DIHYDROOROTATE
DEHYDROGENASE
(Streptococcus
mutans) 		5 / 12 GLY A  47
VAL A 102
GLY A 103
MET A 104
ASN A  75
 MLY  A  45 ( 3.8A)
None
None
None
None
 0.99A 3f8wC-3oixA:
undetectable		 3f8wC-3oixA:
23.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3G1U_D_ADND438_1
(ADENOSYLHOMOCYSTEINA
SE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 12 ASP A  48
LEU A 259
GLY A 249
MET A 186
PHE A 176
 None
MLY  A 263 ( 4.6A)
MLY  A 248 ( 2.4A)
None
MLY  A 181 ( 4.5A)
 1.23A 3g1uD-2ftzA:
undetectable		 3g1uD-2ftzA:
20.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3GCL_A_AINA609_1
(LACTOPEROXIDASE)		 4nk6 POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE
(Pseudomonas
syringae
group
genomosp.
3) 		4 / 6 ARG A 186
GLU A 213
GLN A 189
PRO A 229
 None
MLY  A 191 ( 4.8A)
None
None
 1.30A 3gclA-4nk6A:
undetectable		 3gclA-4nk6A:
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.
3GCL_A_AINA609_1
(LACTOPEROXIDASE)		 4ozy POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE
(Pseudomonas
syringae
group
genomosp.
3) 		4 / 6 ARG A 186
GLU A 213
GLN A 189
PRO A 229
 None
MLY  A 191 ( 4.8A)
None
None
 1.23A 3gclA-4ozyA:
undetectable		 3gclA-4ozyA:
21.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3GWV_A_RFXA801_1
(TRANSPORTER)		 3lti DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA
(Escherichia
coli) 		5 / 12 LEU A 213
LEU A 210
ILE A 425
ALA A 206
LEU A 184
 MLY  A 422 ( 4.1A)
None
MLY  A 422 ( 4.1A)
None
None
 1.05A 3gwvA-3ltiA:
undetectable		 3gwvA-3ltiA:
18.38
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.
3H5G_C_LEIC16_0
(COIL SER L16D-PEN)		 3u21 NUCLEAR FACTOR
RELATED TO
KAPPA-B-BINDING
PROTEIN
(Homo
sapiens) 		4 / 6 LEU A 461
GLN A 392
LEU A 460
GLU A 450
 None
MLY  A 459 ( 3.8A)
MLY  A 459 ( 4.2A)
MLY  A 452 ( 3.4A)
 1.06A 3h5gB-3u21A:
undetectable
3h5gC-3u21A:
undetectable		 3h5gB-3u21A:
14.17
3h5gC-3u21A:
14.17
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.
3HBB_C_TMQC613_1
(DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 2f4i HYPOTHETICAL PROTEIN
TM0957
(Thermotoga
maritima) 		5 / 11 ALA A 137
ILE A 204
LEU A 123
ILE A  96
THR A 138
 None
MLY  A 201 ( 4.6A)
None
None
None
 1.06A 3hbbC-2f4iA:
undetectable		 3hbbC-2f4iA:
17.05
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.
3HCR_A_CHDA4_0
(FERROCHELATASE,
MITOCHONDRIAL)		 1lln ANTIVIRAL PROTEIN 3
(Phytolacca
americana) 		3 / 3 LEU A 226
PRO A 227
LEU A 230
 None
None
MLY  A 231 ( 4.0A)
 0.47A 3hcrA-1llnA:
0.0		 3hcrA-1llnA:
21.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3HM1_A_J3ZA2_1
(ESTROGEN RECEPTOR)		 2i6g PUTATIVE
METHYLTRANSFERASE
(Salmonella
enterica) 		5 / 12 LEU A  23
ALA A  25
LEU A 100
LEU A 131
LEU A  48
 None
MLY  A 167 ( 4.2A)
None
None
None
 1.16A 3hm1A-2i6gA:
undetectable		 3hm1A-2i6gA:
20.37
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.
3IJD_B_C2FB314_1
(UNCHARACTERIZED
PROTEIN)		 4gxr MALONYL COA
SYNTHETASE,
BENZOATE-COA LIGASE
CHIMERIC PROTEIN
(Rhodopseudomonas
palustris;
Paraburkholderia
xenovorans) 		3 / 3 THR A 380
LYS A 492
GLU A 304
 None
MLY  A 491 ( 3.0A)
MG  A 602 ( 4.2A)
 1.00A 3ijdB-4gxrA:
undetectable		 3ijdB-4gxrA:
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.
3IJX_H_HCZH800_1
(GLUTAMATE RECEPTOR 2)		 5z5c CYSTEINE SYNTHASE
(Fusobacterium
nucleatum) 		4 / 5 LYS A 205
PRO A 207
SER A 217
LEU A 283
 MLY  A 204 ( 3.3A)
None
None
None
 1.38A 3ijxH-5z5cA:
undetectable		 3ijxH-5z5cA:
19.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ILU_H_HFZH800_1
(GLUTAMATE RECEPTOR 2)		 5z5c CYSTEINE SYNTHASE
(Fusobacterium
nucleatum) 		4 / 5 LYS A 205
PRO A 207
SER A 217
LEU A 283
 MLY  A 204 ( 3.3A)
None
None
None
 1.31A 3iluH-5z5cA:
undetectable		 3iluH-5z5cA:
19.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JQA_A_DX4A270_0
(PTERIDINE REDUCTASE
1)		 1xkp PUTATIVE
MEMBRANE-BOUND YOP
TARGETING PROTEIN
YOPN
(Yersinia
pestis) 		4 / 6 ARG A 186
ASP A 242
TYR A 202
PRO A 182
 None
None
None
MLY  A  93 ( 4.8A)
 1.29A 3jqaA-1xkpA:
undetectable		 3jqaA-1xkpA:
22.68
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.
3JQA_B_DX4B270_0
(PTERIDINE REDUCTASE
1)		 1xkp PUTATIVE
MEMBRANE-BOUND YOP
TARGETING PROTEIN
YOPN
(Yersinia
pestis) 		4 / 6 ARG A 186
ASP A 242
TYR A 202
PRO A 182
 None
None
None
MLY  A  93 ( 4.8A)
 1.33A 3jqaB-1xkpA:
undetectable		 3jqaB-1xkpA:
22.68
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.
3JQA_C_DX4C270_0
(PTERIDINE REDUCTASE
1)		 1xkp PUTATIVE
MEMBRANE-BOUND YOP
TARGETING PROTEIN
YOPN
(Yersinia
pestis) 		4 / 6 ARG A 186
ASP A 242
TYR A 202
PRO A 182
 None
None
None
MLY  A  93 ( 4.8A)
 1.28A 3jqaC-1xkpA:
undetectable		 3jqaC-1xkpA:
22.68
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.
3JQA_D_DX4D270_0
(PTERIDINE REDUCTASE
1)		 1xkp PUTATIVE
MEMBRANE-BOUND YOP
TARGETING PROTEIN
YOPN
(Yersinia
pestis) 		4 / 6 ARG A 186
ASP A 242
TYR A 202
PRO A 182
 None
None
None
MLY  A  93 ( 4.8A)
 1.29A 3jqaD-1xkpA:
undetectable		 3jqaD-1xkpA:
22.68
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.
3JW3_A_TOPA208_1
(DIHYDROFOLATE
REDUCTASE)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		5 / 10 ALA A  41
LEU A  79
VAL A  49
LEU A 108
ILE A  61
 None
MLY  A  75 ( 4.2A)
None
None
None
 1.15A 3jw3A-3ln3A:
undetectable		 3jw3A-3ln3A:
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.
3JWQ_A_VIAA901_1
(CGMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE
CATALYTIC DOMAIN,
CONE CGMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE
SUBUNIT ALPHA
CHIMERA)		 3mc3 DSRE/DSRF-LIKE
FAMILY PROTEIN
(Sulfolobus
solfataricus) 		5 / 9 LEU A  35
VAL A 109
LEU A 114
PHE A  52
VAL A  21
 None
MLY  A  62 ( 4.2A)
None
None
None
 1.22A 3jwqA-3mc3A:
undetectable		 3jwqA-3mc3A:
16.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3K13_A_THHA642_0
(5-METHYLTETRAHYDROFO
LATE-HOMOCYSTEINE
METHYLTRANSFERASE)		 3iuz PUTATIVE GLYOXALASE
SUPERFAMILY PROTEIN
(Cupriavidus
pinatubonensis) 		5 / 12 GLY A  98
GLY A 232
ASN A 233
PHE A 102
ILE A 228
 MLY  A  88 ( 3.8A)
None
None
None
None
 1.25A 3k13A-3iuzA:
undetectable		 3k13A-3iuzA:
23.58
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.
3K37_A_BCZA468_1
(NEURAMINIDASE)		 5mhf MANNOSYL-OLIGOSACCHA
RIDE GLUCOSIDASE
(Mus
musculus) 		3 / 3 ASP A 140
ARG A 133
ARG A 817
 None
MLY  A 131 ( 4.1A)
None
 0.94A 3k37A-5mhfA:
undetectable		 3k37A-5mhfA:
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.
3KDM_H_TESH226_1
(IMMUNOGLOBULIN HEAVY
CHAIN
IMMUNOGLOBULIN LIGHT
CHAIN)		 1xkp PUTATIVE
MEMBRANE-BOUND YOP
TARGETING PROTEIN
YOPN
(Yersinia
pestis) 		5 / 9 SER A 133
ALA A 178
TYR A  90
TYR A 202
PRO A 182
 None
None
None
None
MLY  A  93 ( 4.8A)
 1.21A 3kdmH-1xkpA:
undetectable
3kdmL-1xkpA:
undetectable		 3kdmH-1xkpA:
22.43
3kdmL-1xkpA:
24.15
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.
3KIV_A_ACAA100_1
(APOLIPOPROTEIN)		 5thm ESTERASE-6
(Drosophila
melanogaster) 		4 / 7 ARG A 228
ASP A 149
ASP A 151
PHE A 232
 None
None
MLY  A 250 ( 4.4A)
None
 0.95A 3kivA-5thmA:
undetectable		 3kivA-5thmA:
9.15
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.
3KO0_D_TFPD201_1
(PROTEIN S100-A4)		 3oix DIHYDROOROTATE
OXIDASE
PUTATIVE
DIHYDROOROTATE
DEHYDROGENASE
(Streptococcus
mutans) 		4 / 8 GLY A 248
CYH A  25
PHE A  42
PHE A 281
 FMN  A 400 (-3.3A)
MLY  A  45 ( 3.2A)
None
None
 1.00A 3ko0D-3oixA:
undetectable
3ko0E-3oixA:
undetectable		 3ko0D-3oixA:
12.75
3ko0E-3oixA:
12.75
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.
3KO0_J_TFPJ201_1
(PROTEIN S100-A4)		 3oix DIHYDROOROTATE
OXIDASE
PUTATIVE
DIHYDROOROTATE
DEHYDROGENASE
(Streptococcus
mutans) 		4 / 8 PHE A 281
GLY A 248
CYH A  25
PHE A  42
 None
FMN  A 400 (-3.3A)
MLY  A  45 ( 3.2A)
None
 1.08A 3ko0B-3oixA:
undetectable
3ko0J-3oixA:
undetectable		 3ko0B-3oixA:
12.75
3ko0J-3oixA:
12.75
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.
3KO0_S_TFPS201_1
(PROTEIN S100-A4)		 3oix DIHYDROOROTATE
OXIDASE
PUTATIVE
DIHYDROOROTATE
DEHYDROGENASE
(Streptococcus
mutans) 		4 / 7 PHE A 281
GLY A 248
CYH A  25
PHE A  42
 None
FMN  A 400 (-3.3A)
MLY  A  45 ( 3.2A)
None
 1.08A 3ko0K-3oixA:
undetectable
3ko0S-3oixA:
undetectable		 3ko0K-3oixA:
12.75
3ko0S-3oixA:
12.75
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.
3KO0_T_TFPT201_1
(PROTEIN S100-A4)		 3oix DIHYDROOROTATE
OXIDASE
PUTATIVE
DIHYDROOROTATE
DEHYDROGENASE
(Streptococcus
mutans) 		4 / 7 PHE A 281
GLY A 248
CYH A  25
PHE A  42
 None
FMN  A 400 (-3.3A)
MLY  A  45 ( 3.2A)
None
 0.98A 3ko0R-3oixA:
undetectable
3ko0T-3oixA:
undetectable		 3ko0R-3oixA:
12.75
3ko0T-3oixA:
12.75
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.
3KP2_A_PNNA5001_0
(TRANSCRIPTIONAL
REGULATOR TCAR)		 3sbu HYPOTHETICAL
NTF2-LIKE PROTEIN
(Bacteroides
fragilis) 		4 / 8 ASN A 236
THR A 115
LEU A 254
ASN A 243
 None
PEG  A 293 ( 4.4A)
MLY  A 255 ( 4.5A)
GOL  A 285 (-3.2A)
 1.10A 3kp2A-3sbuA:
undetectable
3kp2B-3sbuA:
undetectable		 3kp2A-3sbuA:
19.10
3kp2B-3sbuA:
19.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KP6_B_SALB3003_1
(TRANSCRIPTIONAL
REGULATOR TCAR)		 2o3f PUTATIVE HTH-TYPE
TRANSCRIPTIONAL
REGULATOR YBBH
(Bacillus
subtilis) 		4 / 6 VAL A  72
ARG A  71
LEU A  68
LEU A  60
 MLY  A  69 ( 4.0A)
None
MLY  A  69 ( 3.6A)
None
 0.80A 3kp6A-2o3fA:
1.4
3kp6B-2o3fA:
1.8		 3kp6A-2o3fA:
23.65
3kp6B-2o3fA:
23.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KP6_B_SALB3004_1
(TRANSCRIPTIONAL
REGULATOR TCAR)		 4nge PRESEQUENCE
PROTEASE,
MITOCHONDRIAL
(Homo
sapiens) 		4 / 5 ILE D 803
PHE D 799
ASP D 798
GLU D 797
 None
None
MLY  D 794 ( 3.0A)
None
 1.10A 3kp6A-4ngeD:
1.6
3kp6B-4ngeD:
1.3		 3kp6A-4ngeD:
9.61
3kp6B-4ngeD:
9.61
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.
3KPD_C_SAMC1000_1
(UNCHARACTERIZED
PROTEIN MJ0100)		 4h3w HYPOTHETICAL PROTEIN
(Parabacteroides
distasonis) 		5 / 12 VAL A 274
ILE A 275
ILE A 285
VAL A 283
PRO A 282
 None
None
None
MLY  A 310 ( 4.7A)
None
 0.75A 3kpdC-4h3wA:
undetectable		 3kpdC-4h3wA:
18.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3L8L_B_DVAB6_0
(GRAMICIDIN D)		 4epc N-ACETYLMURAMOYL-L-A
LANINE AMIDASE
(Staphylococcus
epidermidis) 		3 / 3 TRP A 839
ALA A 804
VAL A 795
 MLY  A 819 ( 4.9A)
None
None
 0.99A 3l8lA-4epcA:
undetectable
3l8lB-4epcA:
undetectable		 3l8lA-4epcA:
3.86
3l8lB-4epcA:
3.86
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.
3LCV_B_SAMB301_0
(SISOMICIN-GENTAMICIN
RESISTANCE METHYLASE
SGM)		 3hsa PLECKSTRIN HOMOLOGY
DOMAIN
(Shewanella
amazonensis) 		5 / 12 THR A 118
ALA A  36
ASP A  15
LEU A  19
LEU A  51
 MLY  A 117 ( 4.3A)
GOL  A 127 ( 4.2A)
GOL  A 128 (-3.4A)
MLY  A  18 ( 4.6A)
None
 1.36A 3lcvB-3hsaA:
undetectable		 3lcvB-3hsaA:
16.18
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.
3ME6_B_CGEB501_1
(CYTOCHROME P450 2B4)		 4fkm SIMILAR TO FERRIC
HYDROXAMATE RECEPTOR
1
(Staphylococcus
aureus) 		4 / 8 PHE A 208
PHE A 288
VAL A 271
VAL A 273
 None
None
MLY  A 272 ( 3.1A)
MLY  A 272 ( 2.8A)
 0.90A 3me6B-4fkmA:
undetectable		 3me6B-4fkmA:
19.70
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.
3N45_F_ZOLF354_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 11 LEU A  71
ASP A  74
ARG A  85
THR A 164
GLN A 198
 None
UNL  A 273 (-3.0A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.87A 3n45F-2ftzA:
25.0		 3n45F-2ftzA:
25.84
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.
3N45_F_ZOLF354_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 11 LEU A  71
ASP A  80
ARG A  85
THR A 164
GLN A 198
 None
MLY  A 223 ( 3.6A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.61A 3n45F-2ftzA:
25.0		 3n45F-2ftzA:
25.84
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.
3N46_F_ZOLF354_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 10 LEU A  71
ASP A  74
ARG A  85
THR A 164
GLN A 198
 None
UNL  A 273 (-3.0A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.87A 3n46F-2ftzA:
24.9		 3n46F-2ftzA:
25.84
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.
3N46_F_ZOLF354_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 10 LEU A  71
ASP A  80
ARG A  85
THR A 164
GLN A 198
 None
MLY  A 223 ( 3.6A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.60A 3n46F-2ftzA:
24.9		 3n46F-2ftzA:
25.84
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.
3N58_C_ADNC500_1
(ADENOSYLHOMOCYSTEINA
SE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 12 ASP A  48
THR A  44
GLY A 249
MET A 186
PHE A 176
 None
None
MLY  A 248 ( 2.4A)
None
MLY  A 181 ( 4.5A)
 1.14A 3n58C-2ftzA:
undetectable		 3n58C-2ftzA:
22.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NRR_B_D16B520_1
(DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 4nk6 POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE
(Pseudomonas
syringae
group
genomosp.
3) 		5 / 12 HIS A 339
LEU A 391
ARG A 413
ILE A 381
LEU A 399
 MLY  A 338 ( 4.2A)
None
None
None
None
 1.07A 3nrrB-4nk6A:
undetectable		 3nrrB-4nk6A:
22.50
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.
3NU4_B_478B401_1
(PROTEASE)		 4nge PRESEQUENCE
PROTEASE,
MITOCHONDRIAL
(Homo
sapiens) 		6 / 9 ALA D 955
ASP D 951
ILE D 952
ILE D 565
VAL D 996
ILE D 885
 None
None
None
None
None
MLY  D 884 ( 4.0A)
 1.31A 3nu4A-4ngeD:
undetectable		 3nu4A-4ngeD:
8.52
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.
3NV6_A_CAMA422_0
(CYTOCHROME P450)		 1xl3 SECRETION CONTROL
PROTEIN
(Yersinia
pestis) 		3 / 3 GLY A 208
ILE A 257
VAL A 258
 None
MLY  A 254 ( 4.0A)
MLY  A 254 ( 4.1A)
 0.41A 3nv6A-1xl3A:
undetectable		 3nv6A-1xl3A:
19.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NXU_B_RITB600_1
(CYTOCHROME P450 3A4)		 3aag GENERAL
GLYCOSYLATION
PATHWAY PROTEIN
(Campylobacter
jejuni) 		5 / 12 PHE A 550
MET A 529
LEU A 542
PHE A 541
ALA A 490
 MLY  A 551 ( 4.1A)
None
None
None
None
 1.00A 3nxuB-3aagA:
undetectable		 3nxuB-3aagA:
21.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3OU6_C_SAMC300_0
(SAM-DEPENDENT
METHYLTRANSFERASE)		 5thm ESTERASE-6
(Drosophila
melanogaster) 		5 / 12 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 3ou6C-5thmA:
undetectable		 3ou6C-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.
3OU7_C_SAMC300_0
(SAM-DEPENDENT
METHYLTRANSFERASE)		 5thm ESTERASE-6
(Drosophila
melanogaster) 		5 / 12 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.
3OZV_B_ECNB411_1
(FLAVOHEMOGLOBIN)		 2g9n EUKARYOTIC
INITIATION FACTOR
4A-I
(Homo
sapiens) 		5 / 9 ILE A 199
ILE A 196
TYR A 197
ALA A 184
LEU A 181
 None
MLY  A 193 ( 4.1A)
MLY  A 193 ( 3.9A)
None
None
 1.09A 3ozvB-2g9nA:
undetectable		 3ozvB-2g9nA:
20.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3OZW_A_KKKA413_1
(FLAVOHEMOGLOBIN)		 4h3w HYPOTHETICAL PROTEIN
(Parabacteroides
distasonis) 		4 / 8 ILE A  80
ALA A 211
LEU A 212
LEU A 197
 MLY  A  81 ( 3.8A)
MLY  A 128 ( 3.9A)
None
None
 0.77A 3ozwA-4h3wA:
undetectable		 3ozwA-4h3wA:
22.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3PCQ_B_PQNB842_1
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A2)		 3e3x BIPA
(Vibrio
parahaemolyticus) 		5 / 11 MET A  33
PHE A  35
SER A 107
ILE A 309
LEU A 104
 None
None
MLY  A 314 ( 4.8A)
None
None
 1.12A 3pcqB-3e3xA:
undetectable		 3pcqB-3e3xA:
18.21
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.
3PO7_A_ZONA601_1
(AMINE OXIDASE
[FLAVIN-CONTAINING]
B)		 3zcj CAGL
(Helicobacter
pylori) 		4 / 8 LEU A  82
TYR A 163
PHE A  86
TYR A  34
 MLY  A  83 ( 4.2A)
None
None
None
 1.34A 3po7A-3zcjA:
undetectable		 3po7A-3zcjA:
16.83
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.
3PP7_B_SVRB499_1
(PYRUVATE KINASE)		 5thm ESTERASE-6
(Drosophila
melanogaster) 		5 / 10 PRO A  62
ASN A 119
HIS A 105
GLY A 114
ALA A 115
 MLY  A  60 ( 4.3A)
None
None
None
None
 1.49A 3pp7B-5thmA:
undetectable		 3pp7B-5thmA:
21.53
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.
3PYY_A_STIA3_2
(V-ABL ABELSON MURINE
LEUKEMIA VIRAL
ONCOGENE HOMOLOG 1
ISOFORM B VARIANT)		 4a5p PROTEIN MXIA
(Shigella
flexneri) 		4 / 6 TYR A 671
VAL A 644
ILE A 579
ARG A 657
 None
MLY  A 590 ( 4.3A)
None
None
 1.01A 3pyyA-4a5pA:
undetectable		 3pyyA-4a5pA:
23.00
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.
3Q1E_D_T44D328_1
(5-HYDROXYISOURATE
HYDROLASE)		 5for PHOSPHOINOSITIDE
3-KINASE ADAPTER
PROTEIN 1
(Homo
sapiens) 		5 / 9 LEU A  82
LEU A  85
LEU A  68
HIS A  77
LEU A  72
 MLY  A  78 ( 4.6A)
None
None
None
None
 1.38A 3q1eB-5forA:
undetectable
3q1eD-5forA:
undetectable		 3q1eB-5forA:
21.05
3q1eD-5forA:
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.
3QEO_B_LLTB261_1
(DEOXYCYTIDINE KINASE)		 2o3f PUTATIVE HTH-TYPE
TRANSCRIPTIONAL
REGULATOR YBBH
(Bacillus
subtilis) 		4 / 7 VAL A  72
LEU A   6
PHE A  65
LEU A  56
 MLY  A  69 ( 4.0A)
None
MLY  A  69 (-3.9A)
None
 0.99A 3qeoB-2o3fA:
undetectable		 3qeoB-2o3fA:
15.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3QJ7_A_SPMA264_1
(THYMIDYLATE SYNTHASE)		 1iv8 MALTOOLIGOSYL
TREHALOSE SYNTHASE
(Sulfolobus
acidocaldarius) 		4 / 8 ALA A  75
LEU A  34
ASP A 223
ASP A 221
 None
None
None
MLY  A 250 ( 4.3A)
 0.98A 3qj7A-1iv8A:
0.0
3qj7D-1iv8A:
0.0		 3qj7A-1iv8A:
16.76
3qj7D-1iv8A:
16.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3R24_A_SAMA302_1
(2'-O-METHYL
TRANSFERASE)		 2g9n EUKARYOTIC
INITIATION FACTOR
4A-I
(Homo
sapiens) 		3 / 3 TYR A  48
ASP A  32
ASP A  35
 None
MLY  A  54 ( 3.5A)
None
 0.66A 3r24A-2g9nA:
3.4		 3r24A-2g9nA:
21.45
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3R43_A_ID8A332_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C3)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		6 / 12 TYR A  24
TYR A  55
TRP A  86
HIS A 117
ASN A 167
TYR A 216
 MLY  A  25 (-3.6A)
NAD  A 327 ( 4.7A)
None
MRD  A 328 ( 3.9A)
NAD  A 327 (-3.3A)
NAD  A 327 (-3.4A)
 0.35A 3r43A-3ln3A:
49.0		 3r43A-3ln3A:
64.71
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3R6I_A_JMSA332_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C3)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		6 / 12 TYR A  24
TYR A  55
TRP A  86
HIS A 117
ASN A 167
TYR A 216
 MLY  A  25 (-3.6A)
NAD  A 327 ( 4.7A)
None
MRD  A 328 ( 3.9A)
NAD  A 327 (-3.3A)
NAD  A 327 (-3.4A)
 0.34A 3r6iA-3ln3A:
47.5		 3r6iA-3ln3A:
64.71
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3R7M_A_SUZA332_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C3)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		5 / 10 TYR A  24
TYR A  55
TRP A  86
HIS A 117
ASN A 167
 MLY  A  25 (-3.6A)
NAD  A 327 ( 4.7A)
None
MRD  A 328 ( 3.9A)
NAD  A 327 (-3.3A)
 0.33A 3r7mA-3ln3A:
47.6		 3r7mA-3ln3A:
64.71
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.
3R9S_A_BEZA264_0
(CARNITINYL-COA
DEHYDRATASE)		 2vd9 ALANINE RACEMASE
(Bacillus
anthracis) 		4 / 6 ALA A  53
ILE A  80
LEU A  64
ALA A  44
 MLY  A  54 ( 3.0A)
None
None
None
 0.89A 3r9sA-2vd9A:
undetectable		 3r9sA-2vd9A:
22.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3R9S_C_BEZC264_0
(CARNITINYL-COA
DEHYDRATASE)		 2vd9 ALANINE RACEMASE
(Bacillus
anthracis) 		4 / 6 ALA A  53
ILE A  80
LEU A  64
ALA A  44
 MLY  A  54 ( 3.0A)
None
None
None
 0.85A 3r9sC-2vd9A:
undetectable		 3r9sC-2vd9A:
22.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3R9V_B_DXCB1_0
(INVASIN IPAD)		 3e3x BIPA
(Vibrio
parahaemolyticus) 		4 / 7 ILE A  55
LEU A 104
SER A 107
VAL A  31
 None
None
MLY  A 314 ( 4.8A)
None
 0.90A 3r9vA-3e3xA:
undetectable
3r9vB-3e3xA:
undetectable		 3r9vA-3e3xA:
25.14
3r9vB-3e3xA:
25.14
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.
3RGF_A_BAXA465_2
(CYCLIN-DEPENDENT
KINASE 8)		 3gs9 PROTEIN GP18
(Listeria
monocytogenes) 		4 / 7 LEU A  18
VAL A  61
VAL A  42
ASP A  56
 None
None
MLY  A  41 ( 3.0A)
None
 0.93A 3rgfA-3gs9A:
undetectable		 3rgfA-3gs9A:
19.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3RV5_D_DXCD92_0
(TROPONIN C, SLOW
SKELETAL AND CARDIAC
MUSCLES)		 4nk6 POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE
(Pseudomonas
syringae
group
genomosp.
3) 		4 / 5 VAL A 196
GLU A 276
LYS A 111
PHE A 112
 None
None
MLY  A 110 ( 2.9A)
None
 1.33A 3rv5C-4nk6A:
undetectable
3rv5D-4nk6A:
undetectable		 3rv5C-4nk6A:
11.34
3rv5D-4nk6A:
11.34
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.
3S8P_A_SAMA500_1
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SUV420H1)		 2o3f PUTATIVE HTH-TYPE
TRANSCRIPTIONAL
REGULATOR YBBH
(Bacillus
subtilis) 		3 / 3 HIS A  32
SER A  37
GLU A  36
 SO4  A 203 (-3.8A)
MLY  A  33 ( 2.7A)
MLY  A  33 ( 4.3A)
 0.93A 3s8pA-2o3fA:
undetectable		 3s8pA-2o3fA:
14.86
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.
3SI7_A_ACTA5_0
(CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR)		 2g9n EUKARYOTIC
INITIATION FACTOR
4A-I
(Homo
sapiens) 		3 / 3 LYS A  83
SER A  56
GLN A  59
 MLY  A  82 ( 3.0A)
None
None
 0.93A 3si7A-2g9nA:
3.9		 3si7A-2g9nA:
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.
3SMT_A_ACTA500_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SETD3)		 5mhf MANNOSYL-OLIGOSACCHA
RIDE GLUCOSIDASE
(Mus
musculus) 		3 / 3 PHE A 149
SER A 393
GLN A 389
 MLY  A 366 ( 4.8A)
None
None
 0.83A 3smtA-5mhfA:
undetectable		 3smtA-5mhfA:
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.
3SP9_B_IL2B901_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR DELTA)		 4gxr MALONYL COA
SYNTHETASE,
BENZOATE-COA LIGASE
CHIMERIC PROTEIN
(Paraburkholderia
xenovorans;
Rhodopseudomonas
palustris) 		5 / 12 LEU A 447
VAL A 445
PHE A 444
LEU A 459
VAL A 458
 MLY  A 448 ( 4.0A)
None
None
None
None
 1.27A 3sp9B-4gxrA:
undetectable		 3sp9B-4gxrA:
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.
3T3Q_D_9PLD501_1
(CYTOCHROME P450 2A6)		 5czw MYROILYSIN
(Myroides
profundi) 		5 / 10 PHE A 124
PHE A 127
PHE A  98
ALA A  73
ILE A  94
 None
None
None
MLY  A  70 ( 3.8A)
None
 1.45A 3t3qD-5czwA:
undetectable		 3t3qD-5czwA:
19.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3TEH_B_DAHB786_1
(PHENYLALANYL-TRNA
SYNTHETASE BETA
CHAIN)		 3hfh TRANSCRIPTION
ELONGATION REGULATOR
1
(Homo
sapiens) 		4 / 7 LEU A 671
GLU A 717
ALA A 677
PHE A 678
 MLY  A 667 ( 4.4A)
MLY  A 721 ( 4.2A)
None
None
 0.96A 3tehB-3hfhA:
undetectable		 3tehB-3hfhA:
13.01
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.
3TQ9_A_MTXA2001_1
(DIHYDROFOLATE
REDUCTASE)		 2f4i HYPOTHETICAL PROTEIN
TM0957
(Thermotoga
maritima) 		5 / 12 ALA A 137
ILE A 204
LEU A 123
ILE A  96
THR A 138
 None
MLY  A 201 ( 4.6A)
None
None
None
 1.01A 3tq9A-2f4iA:
undetectable		 3tq9A-2f4iA:
22.49
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.
3TQB_A_FOLA2001_0
(DIHYDROFOLATE
REDUCTASE)		 2f4i HYPOTHETICAL PROTEIN
TM0957
(Thermotoga
maritima) 		5 / 11 ALA A 137
ILE A 204
LEU A 123
ILE A  96
THR A 138
 None
MLY  A 201 ( 4.6A)
None
None
None
 1.01A 3tqbA-2f4iA:
undetectable		 3tqbA-2f4iA:
22.49
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.
3TYE_B_YTZB902_1
(DIHYDROPTEROATE
SYNTHASE)		 3v62 UBIQUITIN-LIKE
PROTEIN SMT3
(Saccharomyces
cerevisiae) 		3 / 3 PHE A  37
LYS A  28
SER A  33
 None
MLY  A  27 ( 3.3A)
None
 1.38A 3tyeB-3v62A:
undetectable		 3tyeB-3v62A:
17.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3U9F_E_CLME221_1
(CHLORAMPHENICOL
ACETYLTRANSFERASE)		 4hp4 EAG-LIKE K[+]
CHANNEL
(Drosophila
melanogaster) 		3 / 3 PHE A 110
CYH A 108
HIS A 129
 None
MLY  A 130 ( 3.9A)
None
 1.04A 3u9fF-4hp4A:
undetectable		 3u9fF-4hp4A:
18.31
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.
3U9F_I_CLMI221_0
(CHLORAMPHENICOL
ACETYLTRANSFERASE)		 4hp4 EAG-LIKE K[+]
CHANNEL
(Drosophila
melanogaster) 		3 / 3 PHE A 110
CYH A 108
HIS A 129
 None
MLY  A 130 ( 3.9A)
None
 0.92A 3u9fG-4hp4A:
undetectable		 3u9fG-4hp4A:
18.31
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.
3U9F_K_CLMK221_1
(CHLORAMPHENICOL
ACETYLTRANSFERASE)		 4hp4 EAG-LIKE K[+]
CHANNEL
(Drosophila
melanogaster) 		3 / 3 PHE A 110
CYH A 108
HIS A 129
 None
MLY  A 130 ( 3.9A)
None
 1.04A 3u9fL-4hp4A:
undetectable		 3u9fL-4hp4A:
18.31
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.
3U9F_R_CLMR221_1
(CHLORAMPHENICOL
ACETYLTRANSFERASE)		 4hp4 EAG-LIKE K[+]
CHANNEL
(Drosophila
melanogaster) 		3 / 3 PHE A 110
CYH A 108
HIS A 129
 None
MLY  A 130 ( 3.9A)
None
 0.93A 3u9fS-4hp4A:
undetectable		 3u9fS-4hp4A:
18.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3UG8_A_IMNA2001_2
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C3)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		3 / 3 TYR A  24
GLU A 192
TYR A 305
 MLY  A  25 (-3.6A)
None
None
 0.61A 3ug8A-3ln3A:
47.6		 3ug8A-3ln3A:
64.71
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3UGR_A_IMNA2001_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C3)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		5 / 12 TYR A  24
TRP A  86
HIS A 117
TYR A 216
PHE A 310
 MLY  A  25 (-3.6A)
None
MRD  A 328 ( 3.9A)
NAD  A 327 (-3.4A)
MRD  A 328 (-4.5A)
 0.99A 3ugrA-3ln3A:
47.5		 3ugrA-3ln3A:
64.71
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.
3UGR_A_IMNA2001_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C3)		 4a5p PROTEIN MXIA
(Shigella
flexneri) 		5 / 12 TYR A 483
LEU A 486
SER A 477
PHE A 428
PHE A 367
 None
None
MLY  A 476 ( 4.9A)
None
None
 1.49A 3ugrA-4a5pA:
undetectable		 3ugrA-4a5pA:
23.24
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.
3UQ6_B_ADNB401_2
(ADENOSINE KINASE,
PUTATIVE)		 3oix DIHYDROOROTATE
OXIDASE
PUTATIVE
DIHYDROOROTATE
DEHYDROGENASE
(Streptococcus
mutans) 		4 / 5 LEU A 101
GLY A  47
MET A 115
ASN A  79
 None
MLY  A  45 ( 3.8A)
None
None
 1.31A 3uq6B-3oixA:
undetectable		 3uq6B-3oixA:
24.55
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.
3UT5_B_LOCB502_1
(TUBULIN BETA CHAIN)		 3aag GENERAL
GLYCOSYLATION
PATHWAY PROTEIN
(Campylobacter
jejuni) 		5 / 12 LEU A 491
ALA A 682
LEU A 562
LYS A 695
ILE A 560
 None
MLY  A 493 ( 3.6A)
None
MLY  A 694 ( 3.3A)
None
 1.12A 3ut5B-3aagA:
undetectable		 3ut5B-3aagA:
22.20
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.
3UT5_D_LOCD502_1
(TUBULIN BETA CHAIN)		 3aag GENERAL
GLYCOSYLATION
PATHWAY PROTEIN
(Campylobacter
jejuni) 		5 / 12 LEU A 491
ALA A 682
LEU A 562
LYS A 695
ILE A 560
 None
MLY  A 493 ( 3.6A)
None
MLY  A 694 ( 3.3A)
None
 1.13A 3ut5D-3aagA:
undetectable		 3ut5D-3aagA:
22.20
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.
3VM4_A_IZPA1_1
(FATTY ACID
ALPHA-HYDROXYLASE)		 3hfh TRANSCRIPTION
ELONGATION REGULATOR
1
(Homo
sapiens) 		4 / 5 LEU A 802
ARG A 826
PRO A 825
ALA A 829
 None
None
MLY  A 828 ( 4.4A)
MLY  A 828 ( 3.7A)
 1.49A 3vm4A-3hfhA:
undetectable		 3vm4A-3hfhA:
17.19
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.
3VYW_D_SAMD401_1
(MNMC2)		 3zcj CAGL
(Helicobacter
pylori) 		4 / 5 ASP A 212
ASP A  97
ASN A 206
GLU A 209
 MLY  A 149 ( 4.1A)
PEG  A1232 (-3.0A)
PEG  A1232 ( 4.9A)
None
 1.37A 3vywD-3zcjA:
undetectable		 3vywD-3zcjA:
23.90
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.
3W1W_B_CHDB503_0
(FERROCHELATASE,
MITOCHONDRIAL)		 1lln ANTIVIRAL PROTEIN 3
(Phytolacca
americana) 		3 / 3 LEU A 226
PRO A 227
LEU A 230
 None
None
MLY  A 231 ( 4.0A)
 0.36A 3w1wB-1llnA:
undetectable		 3w1wB-1llnA:
20.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3W68_A_VIVA301_0
(ALPHA-TOCOPHEROL
TRANSFER PROTEIN)		 5cj4 XRCC4-MYH7-(1562-162
2) CHIMERA PROTEIN
(Homo
sapiens) 		5 / 12 TYR A  66
PHE A  97
ILE A  34
VAL A  22
LEU A  20
 None
None
None
MLY  A   4 ( 4.2A)
None
 1.16A 3w68A-5cj4A:
undetectable		 3w68A-5cj4A:
21.90
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.
3ZJQ_A_NCAA300_0
(PROTOGLOBIN)		 4h3w HYPOTHETICAL PROTEIN
(Parabacteroides
distasonis) 		4 / 7 VAL A 283
VAL A 246
PHE A 241
ILE A 317
 MLY  A 310 ( 4.7A)
MLY  A 312 ( 4.2A)
None
None
 0.92A 3zjqA-4h3wA:
undetectable		 3zjqA-4h3wA:
20.18
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.
3ZJQ_B_NCAB300_0
(PROTOGLOBIN)		 4h3w HYPOTHETICAL PROTEIN
(Parabacteroides
distasonis) 		4 / 7 VAL A 283
VAL A 246
PHE A 241
ILE A 317
 MLY  A 310 ( 4.7A)
MLY  A 312 ( 4.2A)
None
None
 0.92A 3zjqB-4h3wA:
undetectable		 3zjqB-4h3wA:
20.18
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.
3ZQ8_A_DVAA8_0
(VAL-GRAMICIDIN A)		 4nk6 POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE
(Pseudomonas
syringae
group
genomosp.
3) 		3 / 3 VAL A 303
TRP A 240
TRP A 280
 MLY  A 304 ( 3.2A)
MLY  A  89 ( 3.7A)
MLY  A  89 ( 4.8A)
 1.05A 3zq8A-4nk6A:
undetectable
3zq8B-4nk6A:
undetectable		 3zq8A-4nk6A:
3.34
3zq8B-4nk6A:
3.34
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.
4A99_D_MIYD391_1
(TETX2 PROTEIN)		 3mnm ADP-RIBOSYLATION
FACTOR-BINDING
PROTEIN GGA2
(Saccharomyces
cerevisiae) 		5 / 11 GLN A 544
PHE A 501
ASN A 532
SER A 499
ASN A 476
 None
None
None
MLY  A 498 ( 4.1A)
None
 1.46A 4a99D-3mnmA:
undetectable		 4a99D-3mnmA:
16.41
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.
4AZT_A_SAMA1472_0
(METHYLTRANSFERASE
WBDD)		 2etv IRON(III) ABC
TRANSPORTER,
PERIPLASMIC
IRON-BINDING
PROTEIN, PUTATIVE
(Thermotoga
maritima) 		5 / 12 ALA A  48
ILE A 159
LEU A  27
VAL A 134
ILE A  34
 None
MLY  A 158 (-4.3A)
None
None
None
 1.13A 4aztA-2etvA:
undetectable		 4aztA-2etvA:
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.
4B3Q_A_NVPA999_1
(REVERSE
TRANSCRIPTASE/RIBONU
CLEASE H)		 3kv0 HET-C2
(Podospora
anserina) 		4 / 7 LEU A 172
TYR A 186
LEU A 121
TYR A 169
 MLY  A 171 ( 4.1A)
None
None
None
 0.98A 4b3qA-3kv0A:
undetectable		 4b3qA-3kv0A:
17.47
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.
4C9N_A_CAMA1419_0
(CYTOCHROME P450)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		4 / 8 THR A  51
LEU A 108
LEU A 106
GLY A  62
 None
None
MLY  A 105 ( 4.3A)
MLY  A 105 ( 4.1A)
 0.79A 4c9nA-3ln3A:
undetectable		 4c9nA-3ln3A:
20.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CD2_A_FOLA207_0
(DIHYDROFOLATE
REDUCTASE)		 1lln ANTIVIRAL PROTEIN 3
(Phytolacca
americana) 		5 / 12 ILE A 144
ALA A 160
ILE A 165
PHE A 162
LEU A  52
 MLY  A 143 ( 3.9A)
None
None
None
MLY  A  53 ( 4.3A)
 1.25A 4cd2A-1llnA:
undetectable		 4cd2A-1llnA:
22.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4D33_A_ACTA860_0
(NITRIC OXIDE
SYNTHASE,
ENDOTHELIAL)		 3nym UNCHARACTERIZED
PROTEIN
(Neisseria
meningitidis) 		4 / 5 GLY A  15
ILE A  12
TRP A  40
VAL A  27
 None
MLY  A   8 ( 3.9A)
MLY  A  39 ( 4.1A)
None
 1.27A 4d33A-3nymA:
undetectable		 4d33A-3nymA:
13.69
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.
4D33_B_ACTB860_0
(NITRIC OXIDE
SYNTHASE,
ENDOTHELIAL)		 3nym UNCHARACTERIZED
PROTEIN
(Neisseria
meningitidis) 		4 / 5 GLY A  15
ILE A  12
TRP A  40
VAL A  27
 None
MLY  A   8 ( 3.9A)
MLY  A  39 ( 4.1A)
None
 1.26A 4d33B-3nymA:
undetectable		 4d33B-3nymA:
13.69
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.
4DFR_B_MTXB162_1
(DIHYDROFOLATE
REDUCTASE)		 2f4i HYPOTHETICAL PROTEIN
TM0957
(Thermotoga
maritima) 		5 / 12 ALA A 137
ILE A 204
LEU A 123
ILE A  96
THR A 138
 None
MLY  A 201 ( 4.6A)
None
None
None
 1.01A 4dfrB-2f4iA:
undetectable		 4dfrB-2f4iA:
19.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4DTA_B_ADNB401_1
(APH(2'')-ID)		 4jdu AEROTOLERANCE-RELATE
D MEMBRANE PROTEIN
(Bacteroides
fragilis) 		4 / 8 SER A 110
ILE A  98
LEU A  96
ILE A 160
 None
None
None
MLY  A 116 ( 4.2A)
 0.82A 4dtaB-4jduA:
undetectable		 4dtaB-4jduA:
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.
4DU2_A_LDPA501_1
(CYTOCHROME P450 BM3
VARIANT B7)		 2f4i HYPOTHETICAL PROTEIN
TM0957
(Thermotoga
maritima) 		4 / 7 ALA A 141
PHE A 146
ALA A 156
LEU A  48
 MLY  A 142 ( 3.1A)
MLY  A 142 ( 4.3A)
None
None
 0.85A 4du2A-2f4iA:
undetectable		 4du2A-2f4iA:
19.09
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.
4EJG_A_NCTA501_1
(CYTOCHROME P450 2A13)		 3pss QNR
(Aeromonas
hydrophila) 		4 / 7 PHE A  22
PHE A  42
PHE A   7
LEU A  37
 None
None
MLY  A   5 ( 4.4A)
None
 1.04A 4ejgA-3pssA:
undetectable		 4ejgA-3pssA:
18.20
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.
4EJG_B_NCTB501_1
(CYTOCHROME P450 2A13)		 3sbu HYPOTHETICAL
NTF2-LIKE PROTEIN
(Bacteroides
fragilis) 		5 / 8 PHE A 267
PHE A 177
PHE A 184
ALA A 185
LEU A 254
 None
None
None
None
MLY  A 255 ( 4.5A)
 0.79A 4ejgB-3sbuA:
undetectable		 4ejgB-3sbuA:
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.
4EJG_C_NCTC501_1
(CYTOCHROME P450 2A13)		 3sbu HYPOTHETICAL
NTF2-LIKE PROTEIN
(Bacteroides
fragilis) 		4 / 7 PHE A 267
PHE A 177
ALA A 185
LEU A 254
 None
None
None
MLY  A 255 ( 4.5A)
 0.79A 4ejgC-3sbuA:
undetectable		 4ejgC-3sbuA:
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.
4EJG_C_NCTC501_1
(CYTOCHROME P450 2A13)		 5chx XRCC4-MYH7-1590-1657
(Homo
sapiens) 		4 / 7 PHE A  95
PHE A 111
ALA A  73
LEU A  28
 None
None
MLY  A  72 ( 3.6A)
None
 0.75A 4ejgC-5chxA:
undetectable		 4ejgC-5chxA:
20.13
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.
4EJG_D_NCTD501_1
(CYTOCHROME P450 2A13)		 3sbu HYPOTHETICAL
NTF2-LIKE PROTEIN
(Bacteroides
fragilis) 		4 / 6 PHE A 267
PHE A 177
ALA A 185
LEU A 254
 None
None
None
MLY  A 255 ( 4.5A)
 0.76A 4ejgD-3sbuA:
undetectable		 4ejgD-3sbuA:
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.
4EM2_A_SALA503_1
(UNCHARACTERIZED
HTH-TYPE
TRANSCRIPTIONAL
REGULATOR SAR2349)		 3ufi HYPOTHETICAL PROTEIN
BACOVA_04980
(Bacteroides
ovatus) 		4 / 6 LYS A  37
ILE A 111
VAL A  71
LEU A 121
 MLY  A  36 (-3.0A)
None
None
None
 1.08A 4em2A-3ufiA:
undetectable		 4em2A-3ufiA:
22.26
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.
4F4D_A_CHDA504_0
(FERROCHELATASE,
MITOCHONDRIAL)		 3kv0 HET-C2
(Podospora
anserina) 		5 / 12 MET A  67
LEU A 197
ILE A  88
THR A  49
VAL A  26
 None
MLY  A 198 ( 4.3A)
None
MLY  A  64 ( 4.3A)
None
 1.18A 4f4dA-3kv0A:
undetectable		 4f4dA-3kv0A:
19.56
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.
4F4D_B_CHDB505_0
(FERROCHELATASE,
MITOCHONDRIAL)		 3egl DEGV FAMILY PROTEIN
(Corynebacterium
glutamicum) 		5 / 12 LEU A 221
LEU A 192
LEU A 195
ILE A 209
VAL A 205
 None
MLY  A 191 ( 4.5A)
MLY  A 191 ( 3.7A)
None
None
 1.25A 4f4dB-3eglA:
2.5		 4f4dB-3eglA:
19.41
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.
4F4D_B_CHDB505_0
(FERROCHELATASE,
MITOCHONDRIAL)		 3kv0 HET-C2
(Podospora
anserina) 		5 / 12 MET A  67
LEU A 197
ILE A  88
THR A  49
VAL A  26
 None
MLY  A 198 ( 4.3A)
None
MLY  A  64 ( 4.3A)
None
 1.19A 4f4dB-3kv0A:
undetectable		 4f4dB-3kv0A:
19.56
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.
4F8Y_B_VK3B202_1
(NADPH QUINONE
OXIDOREDUCTASE)		 4p98 EXTRACELLULAR
SOLUTE-BINDING
PROTEIN
(Conexibacter
woesei) 		4 / 6 TRP A 136
ASN A  50
TYR A 138
LEU A 261
 None
BR  A 418 (-3.6A)
None
MLY  A 260 ( 4.1A)
 1.46A 4f8yA-4p98A:
5.8
4f8yB-4p98A:
5.5		 4f8yA-4p98A:
18.24
4f8yB-4p98A:
18.24
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.
4FU9_A_ACTA311_0
(UROKINASE-TYPE
PLASMINOGEN
ACTIVATOR)		 3ufi HYPOTHETICAL PROTEIN
BACOVA_04980
(Bacteroides
ovatus) 		3 / 3 GLN A 155
THR A 151
THR A 152
 MLY  A 184 ( 4.3A)
MLY  A 154 ( 4.3A)
CL  A 328 (-4.3A)
 0.75A 4fu9A-3ufiA:
undetectable		 4fu9A-3ufiA:
23.20
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.
4FUF_A_ACTA310_0
(UROKINASE-TYPE
PLASMINOGEN
ACTIVATOR)		 3ufi HYPOTHETICAL PROTEIN
BACOVA_04980
(Bacteroides
ovatus) 		3 / 3 GLN A 155
THR A 151
THR A 152
 MLY  A 184 ( 4.3A)
MLY  A 154 ( 4.3A)
CL  A 328 (-4.3A)
 0.75A 4fufA-3ufiA:
undetectable		 4fufA-3ufiA:
23.20
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.
4G1B_C_ECNC403_1
(FLAVOHEMOGLOBIN)		 4fkm SIMILAR TO FERRIC
HYDROXAMATE RECEPTOR
1
(Staphylococcus
aureus) 		5 / 9 PHE A 208
LEU A 297
VAL A 271
VAL A 203
LEU A 204
 None
MLY  A 296 ( 4.3A)
MLY  A 272 ( 3.1A)
None
None
 1.10A 4g1bC-4fkmA:
3.8		 4g1bC-4fkmA:
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.
4IAQ_A_2GMA2001_1
(CHIMERA PROTEIN OF
HUMAN
5-HYDROXYTRYPTAMINE
RECEPTOR 1B AND E.
COLI SOLUBLE
CYTOCHROME B562)		 4nge PRESEQUENCE
PROTEASE,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 12 LEU D 160
PHE D 168
PHE D 288
LEU D 145
THR D 167
 None
None
MLY  D 287 ( 4.0A)
None
None
 1.43A 4iaqA-4ngeD:
2.6		 4iaqA-4ngeD:
17.57
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.
4J4V_A_SVRA301_1
(NUCLEOCAPSID PROTEIN)		 1xkp PUTATIVE
MEMBRANE-BOUND YOP
TARGETING PROTEIN
YOPN
(Yersinia
pestis) 		5 / 11 GLY A 177
ALA A 167
VAL A 175
GLN A  86
PRO A 182
 None
None
None
None
MLY  A  93 ( 4.8A)
 1.40A 4j4vA-1xkpA:
0.0		 4j4vA-1xkpA:
22.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4JQ1_A_NPSA401_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C2)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		6 / 9 TYR A  24
TYR A  55
TRP A  86
HIS A 117
TRP A 227
LEU A 306
 MLY  A  25 (-3.6A)
NAD  A 327 ( 4.7A)
None
MRD  A 328 ( 3.9A)
MRD  A 328 (-4.0A)
MRD  A 328 ( 4.3A)
 0.62A 4jq1A-3ln3A:
50.5		 4jq1A-3ln3A:
66.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4JQ2_A_SUZA401_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C2)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		5 / 10 TYR A  24
TYR A  55
TRP A  86
HIS A 117
LEU A 306
 MLY  A  25 (-3.6A)
NAD  A 327 ( 4.7A)
None
MRD  A 328 ( 3.9A)
MRD  A 328 ( 4.3A)
 0.49A 4jq2A-3ln3A:
50.4		 4jq2A-3ln3A:
66.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4JQ4_A_IMNA401_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C2)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		6 / 10 TYR A  24
TYR A  55
HIS A 117
TYR A 216
GLU A 226
LEU A 306
 MLY  A  25 (-3.6A)
NAD  A 327 ( 4.7A)
MRD  A 328 ( 3.9A)
NAD  A 327 (-3.4A)
MLY  A  27 ( 3.3A)
MRD  A 328 ( 4.3A)
 0.98A 4jq4A-3ln3A:
50.3		 4jq4A-3ln3A:
66.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4JQ4_B_IMNB401_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C2)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		6 / 10 TYR A  24
TYR A  55
HIS A 117
ASN A 167
TYR A 216
LEU A 306
 MLY  A  25 (-3.6A)
NAD  A 327 ( 4.7A)
MRD  A 328 ( 3.9A)
NAD  A 327 (-3.3A)
NAD  A 327 (-3.4A)
MRD  A 328 ( 4.3A)
 0.45A 4jq4B-3ln3A:
49.6		 4jq4B-3ln3A:
66.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4JTQ_A_FLPA401_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C2)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		5 / 10 TYR A  24
TYR A  55
TRP A  86
HIS A 117
LEU A 306
 MLY  A  25 (-3.6A)
NAD  A 327 ( 4.7A)
None
MRD  A 328 ( 3.9A)
MRD  A 328 ( 4.3A)
 0.70A 4jtqA-3ln3A:
50.5		 4jtqA-3ln3A:
66.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4JTR_A_IBPA401_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C2)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		5 / 8 TYR A  24
TYR A  55
TRP A  86
HIS A 117
LEU A 306
 MLY  A  25 (-3.6A)
NAD  A 327 ( 4.7A)
None
MRD  A 328 ( 3.9A)
MRD  A 328 ( 4.3A)
 0.96A 4jtrA-3ln3A:
50.5		 4jtrA-3ln3A:
66.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4JTR_B_IZPB401_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C2)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		4 / 6 TYR A  24
TYR A  55
TRP A  86
HIS A 117
 MLY  A  25 (-3.6A)
NAD  A 327 ( 4.7A)
None
MRD  A 328 ( 3.9A)
 0.29A 4jtrB-3ln3A:
50.5		 4jtrB-3ln3A:
66.25
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.
4K50_A_ACTA505_0
(RNA POLYMERASE
3D-POL)		 3rwx HYPOTHETICAL
BACTERIAL OUTER
MEMBRANE PROTEIN
(Bacteroides
fragilis) 		3 / 3 CYH A 180
ASN A 160
LYS A 162
 MLY  A 181 ( 3.9A)
MLY  A 161 ( 3.9A)
MLY  A 161 (-2.8A)
 1.44A 4k50A-3rwxA:
undetectable		 4k50A-3rwxA:
19.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K8C_A_ADNA401_2
(SUGAR KINASE)		 5thm ESTERASE-6
(Drosophila
melanogaster) 		3 / 3 SER A  26
TYR A  24
PRO A  62
 None
None
MLY  A  60 ( 4.3A)
 0.81A 4k8cA-5thmA:
undetectable		 4k8cA-5thmA:
21.83
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.
4KAH_A_ADNA401_2
(PROBABLE SUGAR
KINASE PROTEIN)		 5thm ESTERASE-6
(Drosophila
melanogaster) 		3 / 3 SER A  26
TYR A  24
PRO A  62
 None
None
MLY  A  60 ( 4.3A)
 0.79A 4kahA-5thmA:
undetectable		 4kahA-5thmA:
21.83
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.
4KAH_B_ADNB502_2
(PROBABLE SUGAR
KINASE PROTEIN)		 5thm ESTERASE-6
(Drosophila
melanogaster) 		3 / 3 SER A  26
TYR A  24
PRO A  62
 None
None
MLY  A  60 ( 4.3A)
 0.79A 4kahB-5thmA:
undetectable		 4kahB-5thmA:
21.83
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.
4KAN_A_ADNA401_2
(PROBABLE SUGAR
KINASE PROTEIN)		 5thm ESTERASE-6
(Drosophila
melanogaster) 		3 / 3 SER A  26
TYR A  24
PRO A  62
 None
None
MLY  A  60 ( 4.3A)
 0.82A 4kanA-5thmA:
undetectable		 4kanA-5thmA:
21.83
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.
4KBE_A_ADNA401_2
(PROBABLE SUGAR
KINASE PROTEIN)		 5thm ESTERASE-6
(Drosophila
melanogaster) 		3 / 3 SER A  26
TYR A  24
PRO A  62
 None
None
MLY  A  60 ( 4.3A)
 0.78A 4kbeA-5thmA:
undetectable		 4kbeA-5thmA:
21.83
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.
4KJL_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 2f4i HYPOTHETICAL PROTEIN
TM0957
(Thermotoga
maritima) 		5 / 12 ALA A 137
ILE A 204
LEU A 123
ILE A  96
THR A 138
 None
MLY  A 201 ( 4.6A)
None
None
None
 1.04A 4kjlA-2f4iA:
undetectable		 4kjlA-2f4iA:
19.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KM0_B_CP6B201_1
(DIHYDROFOLATE
REDUCTASE)		 2vd9 ALANINE RACEMASE
(Bacillus
anthracis) 		5 / 12 ILE A  36
ALA A  56
ILE A  19
LEU A 246
ILE A  26
 None
None
None
MLY  A 245 ( 4.1A)
MLY  A  27 ( 3.7A)
 0.87A 4km0B-2vd9A:
undetectable		 4km0B-2vd9A:
18.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KOU_A_C04A207_1
(UNCHARACTERIZED
PROTEIN)		 3mc3 DSRE/DSRF-LIKE
FAMILY PROTEIN
(Sulfolobus
solfataricus) 		3 / 3 GLY A  87
GLU A  47
THR A  48
 MLY  A  84 ( 3.6A)
MLY  A  16 ( 3.4A)
None
 0.52A 4kouA-3mc3A:
undetectable		 4kouA-3mc3A:
21.08
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.
4KPD_A_RISA405_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 10 LEU A  71
ASP A  74
ARG A  85
THR A 164
GLN A 198
 None
UNL  A 273 (-3.0A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.85A 4kpdA-2ftzA:
25.3		 4kpdA-2ftzA:
25.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KPD_A_RISA405_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 10 LEU A  71
ASP A  80
ARG A  85
THR A 164
GLN A 198
 None
MLY  A 223 ( 3.6A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.52A 4kpdA-2ftzA:
25.3		 4kpdA-2ftzA:
25.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KPJ_A_210A901_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 9 LEU A  71
ASP A  74
ARG A  85
THR A 164
GLN A 198
 None
UNL  A 273 (-3.0A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.85A 4kpjA-2ftzA:
24.9		 4kpjA-2ftzA:
26.49
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.
4KPJ_A_210A901_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 9 LEU A  71
ASP A  80
ARG A  85
THR A 164
GLN A 198
 None
MLY  A 223 ( 3.6A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.54A 4kpjA-2ftzA:
24.9		 4kpjA-2ftzA:
26.49
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.
4KQ5_A_ZOLA404_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 10 LEU A  71
ASP A  74
ARG A  85
THR A 164
GLN A 198
 None
UNL  A 273 (-3.0A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.87A 4kq5A-2ftzA:
24.8		 4kq5A-2ftzA:
26.49
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.
4KQ5_A_ZOLA404_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 10 LEU A  71
ASP A  80
ARG A  85
THR A 164
GLN A 198
 None
MLY  A 223 ( 3.6A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.60A 4kq5A-2ftzA:
24.8		 4kq5A-2ftzA:
26.49
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.
4KQS_A_RISA405_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 10 LEU A  71
ASP A  74
ARG A  85
THR A 164
GLN A 198
 None
UNL  A 273 (-3.0A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.84A 4kqsA-2ftzA:
25.2		 4kqsA-2ftzA:
26.49
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.
4KQS_A_RISA405_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 10 LEU A  71
ASP A  80
ARG A  85
THR A 164
GLN A 198
 None
MLY  A 223 ( 3.6A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.52A 4kqsA-2ftzA:
25.2		 4kqsA-2ftzA:
26.49
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.
4KTT_C_SAMC404_1
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 4nge PRESEQUENCE
PROTEASE,
MITOCHONDRIAL
(Homo
sapiens) 		4 / 8 GLN D 949
ASP D 951
ILE D 952
ILE D 885
 None
None
None
MLY  D 884 ( 4.0A)
 0.87A 4kttD-4ngeD:
undetectable		 4kttD-4ngeD:
16.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4L64_A_C2FA802_0
(5-METHYLTETRAHYDROPT
EROYLTRIGLUTAMATE--H
OMOCYSTEINE
METHYLTRANSFERASE)		 4epc N-ACETYLMURAMOYL-L-A
LANINE AMIDASE
(Staphylococcus
epidermidis) 		4 / 7 LYS A 741
TRP A 763
TYR A 771
VAL A 752
 MLY  A 740 ( 3.4A)
None
None
None
 1.46A 4l64A-4epcA:
undetectable		 4l64A-4epcA:
19.12
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.
4LBG_A_ADNA401_2
(PROBABLE SUGAR
KINASE PROTEIN)		 5thm ESTERASE-6
(Drosophila
melanogaster) 		3 / 3 SER A  26
TYR A  24
PRO A  62
 None
None
MLY  A  60 ( 4.3A)
 0.83A 4lbgA-5thmA:
undetectable		 4lbgA-5thmA:
21.83
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.
4LBG_B_ADNB401_2
(PROBABLE SUGAR
KINASE PROTEIN)		 5thm ESTERASE-6
(Drosophila
melanogaster) 		3 / 3 SER A  26
TYR A  24
PRO A  62
 None
None
MLY  A  60 ( 4.3A)
 0.82A 4lbgB-5thmA:
undetectable		 4lbgB-5thmA:
21.83
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.
4LNX_A_T44A501_1
(THYROID HORMONE
RECEPTOR ALPHA)		 5czw MYROILYSIN
(Myroides
profundi) 		4 / 6 GLU A 153
GLN A 198
VAL A 240
THR A 239
 None
None
MLY  A  47 ( 4.7A)
None
 1.30A 4lnxA-5czwA:
undetectable		 4lnxA-5czwA:
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.
4M2X_A_TMQA202_1
(DIHYDROFOLATE
REDUCTASE)		 2vd9 ALANINE RACEMASE
(Bacillus
anthracis) 		5 / 12 ILE A  36
ALA A  56
ILE A  19
LEU A 246
ILE A  26
 None
None
None
MLY  A 245 ( 4.1A)
MLY  A  27 ( 3.7A)
 0.96A 4m2xA-2vd9A:
undetectable		 4m2xA-2vd9A:
17.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4M2X_A_TMQA202_2
(DIHYDROFOLATE
REDUCTASE)		 4nk6 POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE
(Pseudomonas
syringae
group
genomosp.
3) 		3 / 3 TRP A 234
GLN A 238
THR A 233
 None
MLY  A 200 ( 3.7A)
None
 0.77A 4m2xA-4nk6A:
undetectable		 4m2xA-4nk6A:
15.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4M2X_C_TMQC202_1
(DIHYDROFOLATE
REDUCTASE)		 2vd9 ALANINE RACEMASE
(Bacillus
anthracis) 		5 / 12 ILE A  36
ALA A  56
ILE A  19
LEU A 246
ILE A  26
 None
None
None
MLY  A 245 ( 4.1A)
MLY  A  27 ( 3.7A)
 0.96A 4m2xC-2vd9A:
undetectable		 4m2xC-2vd9A:
17.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4M2X_E_TMQE202_1
(DIHYDROFOLATE
REDUCTASE)		 2vd9 ALANINE RACEMASE
(Bacillus
anthracis) 		5 / 12 ILE A  36
ALA A  56
ILE A  19
LEU A 246
ILE A  26
 None
None
None
MLY  A 245 ( 4.1A)
MLY  A  27 ( 3.7A)
 0.96A 4m2xE-2vd9A:
undetectable		 4m2xE-2vd9A:
17.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4M48_A_21BA704_1
(TRANSPORTER)		 1lln ANTIVIRAL PROTEIN 3
(Phytolacca
americana) 		5 / 8 ASP A 196
VAL A 183
TYR A 193
GLY A 131
ALA A 173
 MLY  A 198 ( 3.8A)
MLY  A 184 ( 3.1A)
MLY  A 182 ( 3.3A)
None
None
 1.45A 4m48A-1llnA:
undetectable		 4m48A-1llnA:
17.58
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.
4MGH_A_ACTA1320_0
(PHOSPHORIBOSYLFORMYL
GLYCINAMIDINE
SYNTHASE)		 3hsa PLECKSTRIN HOMOLOGY
DOMAIN
(Shewanella
amazonensis) 		4 / 5 VAL A  45
LEU A  23
ILE A  54
LEU A  53
 None
None
None
MLY  A 104 ( 4.8A)
 0.87A 4mghA-3hsaA:
undetectable		 4mghA-3hsaA:
6.29
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.
4MI4_B_SPMB201_1
(SPERMIDINE
N1-ACETYLTRANSFERASE)		 4qe0 HYPOTHETICAL PROTEIN
(Bacteroides
uniformis) 		4 / 7 ASN A 140
GLU A 138
GLU A 161
ARG A 158
 None
MLY  A  68 ( 2.9A)
MLY  A 165 ( 4.4A)
GOL  A 301 ( 2.6A)
 1.06A 4mi4B-4qe0A:
undetectable
4mi4C-4qe0A:
undetectable		 4mi4B-4qe0A:
23.26
4mi4C-4qe0A:
23.26
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.
4MJ8_B_SPMB201_1
(SPERMIDINE
N1-ACETYLTRANSFERASE)		 4qe0 HYPOTHETICAL PROTEIN
(Bacteroides
uniformis) 		4 / 8 ASN A 140
GLU A 138
GLU A 161
ARG A 158
 None
MLY  A  68 ( 2.9A)
MLY  A 165 ( 4.4A)
GOL  A 301 ( 2.6A)
 1.05A 4mj8B-4qe0A:
undetectable
4mj8C-4qe0A:
undetectable		 4mj8B-4qe0A:
23.65
4mj8C-4qe0A:
23.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4MK4_A_CHDA503_0
(FERROCHELATASE,
MITOCHONDRIAL)		 3egl DEGV FAMILY PROTEIN
(Corynebacterium
glutamicum) 		5 / 10 LEU A 221
LEU A 192
LEU A 195
ILE A 209
VAL A 205
 None
MLY  A 191 ( 4.5A)
MLY  A 191 ( 3.7A)
None
None
 1.19A 4mk4A-3eglA:
undetectable		 4mk4A-3eglA:
19.57
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.
4MK4_A_CHDA503_0
(FERROCHELATASE,
MITOCHONDRIAL)		 4gxr MALONYL COA
SYNTHETASE,
BENZOATE-COA LIGASE
CHIMERIC PROTEIN
(Rhodopseudomonas
palustris;
Paraburkholderia
xenovorans) 		5 / 10 LEU A 256
LEU A 280
ARG A 255
LYS A 231
HIS A 209
 None
None
GOL  A 606 (-3.7A)
MLY  A 230 (-3.1A)
CO3  A 608 (-3.7A)
 1.19A 4mk4A-4gxrA:
4.2		 4mk4A-4gxrA:
23.26
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.
4MK4_A_CHDA503_0
(FERROCHELATASE,
MITOCHONDRIAL)		 4gxr MALONYL COA
SYNTHETASE,
BENZOATE-COA LIGASE
CHIMERIC PROTEIN
(Rhodopseudomonas
palustris;
Paraburkholderia
xenovorans) 		5 / 10 LEU A 256
LEU A 280
LYS A 231
ILE A 236
HIS A 209
 None
None
MLY  A 230 (-3.1A)
MLY  A 235 ( 4.3A)
CO3  A 608 (-3.7A)
 1.22A 4mk4A-4gxrA:
4.2		 4mk4A-4gxrA:
23.26
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.
4N9U_A_RISA404_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 10 LEU A  71
ASP A  74
ARG A  85
THR A 164
GLN A 198
 None
UNL  A 273 (-3.0A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.85A 4n9uA-2ftzA:
25.0		 4n9uA-2ftzA:
25.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4N9U_A_RISA404_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 10 LEU A  71
ASP A  80
ARG A  85
THR A 164
GLN A 198
 None
MLY  A 223 ( 3.6A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.58A 4n9uA-2ftzA:
25.0		 4n9uA-2ftzA:
25.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4NC3_A_ERMA1202_2
(CHIMERA PROTEIN OF
HUMAN
5-HYDROXYTRYPTAMINE
RECEPTOR 2B AND E.
COLI SOLUBLE
CYTOCHROME B562)		 5mhf MANNOSYL-OLIGOSACCHA
RIDE GLUCOSIDASE
(Mus
musculus) 		4 / 6 LEU A 719
ASN A 756
LEU A 784
GLU A 783
 None
None
None
MLY  A 779 ( 2.9A)
 1.23A 4nc3A-5mhfA:
2.8		 4nc3A-5mhfA:
13.85
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.
4NDN_C_SAMC405_1
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 4nge PRESEQUENCE
PROTEASE,
MITOCHONDRIAL
(Homo
sapiens) 		4 / 8 GLN D 949
ASP D 951
ILE D 952
ILE D 885
 None
None
None
MLY  D 884 ( 4.0A)
 0.95A 4ndnD-4ngeD:
undetectable		 4ndnD-4ngeD:
16.18
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.
4NG6_A_RISA405_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 12 LEU A  71
ASP A  74
ARG A  85
THR A 164
GLN A 198
 None
UNL  A 273 (-3.0A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.86A 4ng6A-2ftzA:
24.6		 4ng6A-2ftzA:
25.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4NG6_A_RISA405_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 12 LEU A  71
ASP A  80
ARG A  85
THR A 164
GLN A 198
 None
MLY  A 223 ( 3.6A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.47A 4ng6A-2ftzA:
24.6		 4ng6A-2ftzA:
25.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4NKE_A_RISA404_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 10 LEU A  71
ASP A  74
ARG A  85
THR A 164
GLN A 198
 None
UNL  A 273 (-3.0A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.81A 4nkeA-2ftzA:
25.1		 4nkeA-2ftzA:
25.65
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.
4NKE_A_RISA404_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 10 LEU A  71
ASP A  80
ARG A  85
THR A 164
GLN A 198
 None
MLY  A 223 ( 3.6A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.50A 4nkeA-2ftzA:
25.1		 4nkeA-2ftzA:
25.65
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.
4NKF_A_210A404_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 9 LEU A  71
ASP A  74
ARG A  85
THR A 164
GLN A 198
 None
UNL  A 273 (-3.0A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.87A 4nkfA-2ftzA:
25.0		 4nkfA-2ftzA:
25.65
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.
4NKF_A_210A404_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 9 LEU A  71
ASP A  80
ARG A  85
THR A 164
GLN A 198
 None
MLY  A 223 ( 3.6A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.59A 4nkfA-2ftzA:
25.0		 4nkfA-2ftzA:
25.65
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.
4NUA_A_RISA901_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 10 LEU A  71
ASP A  74
ARG A  85
THR A 164
GLN A 198
 None
UNL  A 273 (-3.0A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.81A 4nuaA-2ftzA:
25.1		 4nuaA-2ftzA:
25.65
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.
4NUA_A_RISA901_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 10 LEU A  71
ASP A  80
ARG A  85
THR A 164
GLN A 198
 None
MLY  A 223 ( 3.6A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.51A 4nuaA-2ftzA:
25.1		 4nuaA-2ftzA:
25.65
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.
4O8F_A_BRLA501_2
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 4gxr MALONYL COA
SYNTHETASE,
BENZOATE-COA LIGASE
CHIMERIC PROTEIN
(Paraburkholderia
xenovorans;
Rhodopseudomonas
palustris) 		4 / 5 GLY A  78
ILE A 103
LEU A  69
LEU A 180
 None
MLY  A 102 ( 3.9A)
None
None
 0.85A 4o8fA-4gxrA:
undetectable		 4o8fA-4gxrA:
21.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4O8Z_A_BBIA402_1
(NAD-DEPENDENT
PROTEIN DEACETYLASE
SIRTUIN-3,
MITOCHONDRIAL)		 4nge PRESEQUENCE
PROTEASE,
MITOCHONDRIAL
(Homo
sapiens) 		4 / 5 PHE D 168
HIS D 254
PHE D 169
LEU D 172
 None
None
MLY  D 287 ( 4.5A)
None
 1.44A 4o8zA-4ngeD:
undetectable		 4o8zA-4ngeD:
16.86
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.
4OBW_A_SAMA602_0
(2-METHOXY-6-POLYPREN
YL-1,4-BENZOQUINOL
METHYLASE,
MITOCHONDRIAL)		 5evi BETA-LACTAMASE/D-ALA
NINE
CARBOXYPEPTIDASE
(Pseudomonas
syringae
group
genomosp.
3) 		5 / 12 ALA B 338
GLY B 321
SER B 316
GLY B  26
ASN B  22
 MLY  B 340 ( 4.0A)
MLY  B 340 ( 3.1A)
None
None
None
 1.08A 4obwA-5eviB:
undetectable		 4obwA-5eviB:
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.
4ODR_A_FK5A201_1
(PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
SLYD,
PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP1A CHIMERA)		 3lti DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA
(Escherichia
coli) 		6 / 12 ASP A 427
LEU A 223
LEU A 210
ILE A 209
LEU A 213
ILE A 176
 None
MLY  A 430 ( 4.4A)
None
None
MLY  A 422 ( 4.1A)
None
 1.38A 4odrA-3ltiA:
undetectable
4odrB-3ltiA:
undetectable		 4odrA-3ltiA:
16.04
4odrB-3ltiA:
16.04
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.
4OGU_A_210A405_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 9 LEU A  71
ASP A  74
ARG A  85
THR A 164
GLN A 198
 None
UNL  A 273 (-3.0A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.84A 4oguA-2ftzA:
24.7		 4oguA-2ftzA:
25.65
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.
4OGU_A_210A405_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 9 LEU A  71
ASP A  80
ARG A  85
THR A 164
GLN A 198
 None
MLY  A 223 ( 3.6A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.54A 4oguA-2ftzA:
24.7		 4oguA-2ftzA:
25.65
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.
4OKX_A_198A1002_2
(ANDROGEN RECEPTOR)		 3oix DIHYDROOROTATE
OXIDASE
PUTATIVE
DIHYDROOROTATE
DEHYDROGENASE
(Streptococcus
mutans) 		4 / 6 LEU A  17
MET A 292
LEU A 300
ILE A   8
 None
MLY  A 289 ( 4.5A)
None
None
 0.89A 4okxA-3oixA:
undetectable		 4okxA-3oixA:
18.29
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.
4OLF_A_HFGA802_0
(PROLINE--TRNA LIGASE)		 5czw MYROILYSIN
(Myroides
profundi) 		5 / 12 PHE A  86
PRO A  92
PHE A 144
SER A 106
GLY A 109
 MLY  A  70 ( 4.0A)
None
None
None
None
 1.21A 4olfA-5czwA:
undetectable		 4olfA-5czwA:
19.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4P0W_A_ZOLA501_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 11 LEU A  71
ASP A  74
ARG A  85
THR A 164
GLN A 198
 None
UNL  A 273 (-3.0A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.86A 4p0wA-2ftzA:
25.1		 4p0wA-2ftzA:
25.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4P0W_A_ZOLA501_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 11 LEU A  71
ASP A  80
ARG A  85
THR A 164
GLN A 198
 None
MLY  A 223 ( 3.6A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.59A 4p0wA-2ftzA:
25.1		 4p0wA-2ftzA:
25.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4PST_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 2f4i HYPOTHETICAL PROTEIN
TM0957
(Thermotoga
maritima) 		5 / 12 ALA A 137
ILE A 204
LEU A 123
ILE A  96
THR A 138
 None
MLY  A 201 ( 4.6A)
None
None
None
 0.99A 4pstA-2f4iA:
undetectable		 4pstA-2f4iA:
18.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4PTH_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 2f4i HYPOTHETICAL PROTEIN
TM0957
(Thermotoga
maritima) 		5 / 12 ALA A 137
ILE A 204
LEU A 123
ILE A  96
THR A 138
 None
MLY  A 201 ( 4.6A)
None
None
None
 0.97A 4pthA-2f4iA:
undetectable		 4pthA-2f4iA:
18.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4PTJ_A_FOLA201_1
(DIHYDROFOLATE
REDUCTASE)		 3rwx HYPOTHETICAL
BACTERIAL OUTER
MEMBRANE PROTEIN
(Bacteroides
fragilis) 		3 / 3 ASP A 176
LYS A 198
LEU A 196
 None
MLY  A 197 ( 3.6A)
MLY  A 197 ( 3.6A)
 1.01A 4ptjA-3rwxA:
undetectable		 4ptjA-3rwxA:
18.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4PWJ_A_30ZA201_1
(TRANSTHYRETIN)		 4gxr MALONYL COA
SYNTHETASE,
BENZOATE-COA LIGASE
CHIMERIC PROTEIN
(Paraburkholderia
xenovorans;
Rhodopseudomonas
palustris) 		4 / 6 LEU A 161
THR A  73
LEU A 175
SER A 176
 None
None
None
MLY  A 359 ( 4.2A)
 0.99A 4pwjA-4gxrA:
undetectable		 4pwjA-4gxrA:
14.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4Q5M_A_ROCA1101_3
(PROTEASE)		 4h3w HYPOTHETICAL PROTEIN
(Parabacteroides
distasonis) 		3 / 3 ASP A  90
ASP A 200
ASN A 206
 MLY  A  91 ( 4.2A)
MLY  A 202 ( 4.0A)
MLY  A 202 ( 3.4A)
 0.77A 4q5mA-4h3wA:
undetectable		 4q5mA-4h3wA:
18.58
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.
4QGI_A_ROCA101_2
(PROTEASE)		 4jdu AEROTOLERANCE-RELATE
D MEMBRANE PROTEIN
(Bacteroides
fragilis) 		5 / 11 LEU A 223
ALA A 115
ILE A 160
VAL A 194
ILE A 196
 None
MLY  A 116 ( 3.1A)
MLY  A 116 ( 4.2A)
None
None
 0.96A 4qgiB-4jduA:
undetectable		 4qgiB-4jduA:
21.71
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.
4QOG_A_ML1A302_1
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])		 5evi BETA-LACTAMASE/D-ALA
NINE
CARBOXYPEPTIDASE
(Pseudomonas
syringae
group
genomosp.
3) 		4 / 8 PHE B  39
ILE B 231
GLY B  35
ILE B 238
 EDO  B 401 ( 4.6A)
None
MLY  B  36 ( 2.4A)
None
 0.85A 4qogA-5eviB:
undetectable
4qogB-5eviB:
undetectable		 4qogA-5eviB:
21.20
4qogB-5eviB:
21.20
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.
4QT3_A_RAPA202_1
(FK506-BINDING
PROTEIN (FKBP)-TYPE
PEPTIDYL-PROPYL
ISOMERASE)		 3lti DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA
(Escherichia
coli) 		5 / 10 TYR A 291
GLU A 240
ILE A 285
ILE A 269
PHE A 253
 MLY  A 295 ( 4.5A)
None
None
None
None
 1.25A 4qt3A-3ltiA:
undetectable		 4qt3A-3ltiA:
17.23
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.
4QTU_B_SAMB301_1
(PUTATIVE
METHYLTRANSFERASE
BUD23)		 1xkp PUTATIVE
MEMBRANE-BOUND YOP
TARGETING PROTEIN
YOPN
(Yersinia
pestis) 		4 / 5 GLN A 135
SER A 133
ASP A 200
ASP A 218
 None
None
None
MLY  A 221 ( 4.6A)
 1.35A 4qtuB-1xkpA:
undetectable		 4qtuB-1xkpA:
22.49
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.
4QTU_B_SAMB301_1
(PUTATIVE
METHYLTRANSFERASE
BUD23)		 1xl3 SECRETION CONTROL
PROTEIN
(Yersinia
pestis) 		4 / 5 GLN A 135
SER A 133
ASP A 200
ASP A 218
 None
None
None
MLY  A 221 ( 3.6A)
 1.27A 4qtuB-1xl3A:
undetectable		 4qtuB-1xl3A:
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.
4QTU_D_SAMD301_1
(PUTATIVE
METHYLTRANSFERASE
BUD23)		 1xl3 SECRETION CONTROL
PROTEIN
(Yersinia
pestis) 		4 / 5 GLN A 135
SER A 133
ASP A 200
ASP A 218
 None
None
None
MLY  A 221 ( 3.6A)
 1.21A 4qtuD-1xl3A:
undetectable		 4qtuD-1xl3A:
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.
4QVQ_K_BO2K301_1
(PROTEASOME SUBUNIT
BETA TYPE-5
PROTEASOME SUBUNIT
BETA TYPE-6)		 5f38 ACETYL-COA
ACETYLTRANSFERASE
(Escherichia
coli) 		5 / 9 ALA B 387
THR B 297
ALA B 300
ILE B 380
GLY B 292
 None
None
None
MLY  B  86 ( 3.7A)
None
 1.12A 4qvqK-5f38B:
undetectable
4qvqL-5f38B:
undetectable		 4qvqK-5f38B:
20.89
4qvqL-5f38B:
19.70
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.
4QVQ_Y_BO2Y301_1
(PROTEASOME SUBUNIT
BETA TYPE-5
PROTEASOME SUBUNIT
BETA TYPE-6)		 5f38 ACETYL-COA
ACETYLTRANSFERASE
(Escherichia
coli) 		5 / 9 ALA B 387
THR B 297
ALA B 300
ILE B 380
GLY B 292
 None
None
None
MLY  B  86 ( 3.7A)
None
 1.12A 4qvqY-5f38B:
undetectable
4qvqZ-5f38B:
undetectable		 4qvqY-5f38B:
20.89
4qvqZ-5f38B:
19.70
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.
4QVV_K_BO2K301_1
(PROTEASOME SUBUNIT
BETA TYPE-5
PROTEASOME SUBUNIT
BETA TYPE-6)		 3oix DIHYDROOROTATE
OXIDASE
PUTATIVE
DIHYDROOROTATE
DEHYDROGENASE
(Streptococcus
mutans) 		4 / 8 THR A 247
GLY A 219
GLY A 220
ASP A 255
 FMN  A 400 (-4.0A)
FMN  A 400 (-3.7A)
FMN  A 400 (-3.4A)
MLY  A 251 ( 3.9A)
 0.76A 4qvvK-3oixA:
undetectable
4qvvL-3oixA:
undetectable		 4qvvK-3oixA:
22.04
4qvvL-3oixA:
23.86
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.
4QVV_Y_BO2Y301_1
(PROTEASOME SUBUNIT
BETA TYPE-5
PROTEASOME SUBUNIT
BETA TYPE-6)		 3oix DIHYDROOROTATE
OXIDASE
PUTATIVE
DIHYDROOROTATE
DEHYDROGENASE
(Streptococcus
mutans) 		4 / 8 THR A 247
GLY A 219
GLY A 220
ASP A 255
 FMN  A 400 (-4.0A)
FMN  A 400 (-3.7A)
FMN  A 400 (-3.4A)
MLY  A 251 ( 3.9A)
 0.77A 4qvvY-3oixA:
undetectable
4qvvZ-3oixA:
undetectable		 4qvvY-3oixA:
22.04
4qvvZ-3oixA:
23.86
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.
4QYN_A_RTLA201_0
(RETINOL-BINDING
PROTEIN 2)		 4dws CHI2
(Yersinia
entomophaga) 		5 / 12 ILE A 475
ALA A 460
THR A 439
VAL A 564
LEU A 477
 None
None
None
MLY  A 565 ( 3.2A)
None
 1.28A 4qynA-4dwsA:
undetectable		 4qynA-4dwsA:
12.09
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.
4QYN_B_RTLB201_0
(RETINOL-BINDING
PROTEIN 2)		 5evi BETA-LACTAMASE/D-ALA
NINE
CARBOXYPEPTIDASE
(Pseudomonas
syringae
group
genomosp.
3) 		5 / 12 ILE B 238
THR B  67
ARG B 255
LEU B  61
LEU B 230
 None
None
None
MLY  B 224 ( 4.9A)
None
 1.38A 4qynB-5eviB:
1.0		 4qynB-5eviB:
15.45
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.
4QZU_A_RTLA201_0
(RETINOL-BINDING
PROTEIN 2)		 2etv IRON(III) ABC
TRANSPORTER,
PERIPLASMIC
IRON-BINDING
PROTEIN, PUTATIVE
(Thermotoga
maritima) 		5 / 12 PHE A 113
ARG A 162
VAL A 170
LEU A  55
LEU A 136
 None
MLY  A  56 ( 3.9A)
None
MLY  A  56 ( 4.6A)
None
 1.36A 4qzuA-2etvA:
undetectable		 4qzuA-2etvA:
18.56
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.
4R21_B_STRB601_1
(CYTOCHROME P450
FAMILY 17
POLYPEPTIDE 2)		 5f38 ACETYL-COA
ACETYLTRANSFERASE
(Escherichia
coli) 		5 / 9 ALA B 112
ILE B 386
GLY B 355
ALA B 356
ILE B 259
 None
MLY  B  86 ( 4.8A)
CSX  B  88 ( 4.3A)
None
None
 1.04A 4r21B-5f38B:
undetectable		 4r21B-5f38B:
21.14
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.
4RXD_A_RISA1404_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 10 LEU A  71
ASP A  74
ARG A  85
THR A 164
GLN A 198
 None
UNL  A 273 (-3.0A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.81A 4rxdA-2ftzA:
23.7		 4rxdA-2ftzA:
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.
4RXD_A_RISA1404_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 10 LEU A  71
ASP A  80
ARG A  85
THR A 164
GLN A 198
 None
MLY  A 223 ( 3.6A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.51A 4rxdA-2ftzA:
23.7		 4rxdA-2ftzA:
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.
4RXD_B_RISB1504_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 10 LEU A  71
ASP A  74
ARG A  85
THR A 164
GLN A 198
 None
UNL  A 273 (-3.0A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.79A 4rxdB-2ftzA:
24.0		 4rxdB-2ftzA:
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.
4RXD_B_RISB1504_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 10 LEU A  71
ASP A  80
ARG A  85
THR A 164
GLN A 198
 None
MLY  A 223 ( 3.6A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.51A 4rxdB-2ftzA:
24.0		 4rxdB-2ftzA:
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.
4RXD_C_RISC1600_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 10 LEU A  71
ASP A  74
ARG A  85
THR A 164
GLN A 198
 None
UNL  A 273 (-3.0A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.80A 4rxdC-2ftzA:
24.1		 4rxdC-2ftzA:
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.
4RXD_C_RISC1600_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 10 LEU A  71
ASP A  80
ARG A  85
THR A 164
GLN A 198
 None
MLY  A 223 ( 3.6A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.51A 4rxdC-2ftzA:
24.1		 4rxdC-2ftzA:
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.
4UHX_A_LZUA3008_1
(ALDEHYDE OXIDASE)		 1vk1 CONSERVED
HYPOTHETICAL PROTEIN
(Pyrococcus
furiosus) 		4 / 8 ASP A 169
ARG A  35
PRO A 104
TRP A 102
 None
MLY  A 172 ( 3.6A)
None
MLY  A 221 ( 3.8A)
 0.95A 4uhxA-1vk1A:
undetectable		 4uhxA-1vk1A:
11.68
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.
4UHX_A_RTZA3009_1
(ALDEHYDE OXIDASE)		 1vk1 CONSERVED
HYPOTHETICAL PROTEIN
(Pyrococcus
furiosus) 		4 / 8 ASP A 169
ARG A  35
PRO A 104
TRP A 102
 None
MLY  A 172 ( 3.6A)
None
MLY  A 221 ( 3.8A)
 0.95A 4uhxA-1vk1A:
undetectable		 4uhxA-1vk1A:
11.68
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4UMJ_A_BFQA1297_1
(GERANYLTRANSTRANSFER
ASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		4 / 8 SER A  70
LEU A  71
ASP A  80
ARG A  85
 UNL  A 273 (-3.7A)
None
MLY  A 223 ( 3.6A)
UNL  A 274 (-4.1A)
 0.26A 4umjA-2ftzA:
29.0		 4umjA-2ftzA:
31.48
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4UMJ_B_BFQB1294_1
(GERANYLTRANSTRANSFER
ASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 9 SER A  70
LEU A  71
ASP A  74
ARG A  85
THR A 164
 UNL  A 273 (-3.7A)
None
UNL  A 273 (-3.0A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
 0.80A 4umjB-2ftzA:
29.2		 4umjB-2ftzA:
31.48
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4UMJ_B_BFQB1294_1
(GERANYLTRANSTRANSFER
ASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 9 SER A  70
LEU A  71
ASP A  80
ARG A  85
THR A 164
 UNL  A 273 (-3.7A)
None
MLY  A 223 ( 3.6A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
 0.27A 4umjB-2ftzA:
29.2		 4umjB-2ftzA:
31.48
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.
4UW0_A_SAMA1506_0
(WBDD)		 2etv IRON(III) ABC
TRANSPORTER,
PERIPLASMIC
IRON-BINDING
PROTEIN, PUTATIVE
(Thermotoga
maritima) 		5 / 12 ALA A  48
ILE A 159
LEU A  27
VAL A 134
ILE A  34
 None
MLY  A 158 (-4.3A)
None
None
None
 1.08A 4uw0A-2etvA:
undetectable		 4uw0A-2etvA:
20.83
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.
4V2Y_B_EF2B151_1
(CEREBLON ISOFORM 4)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		4 / 7 ASN A 127
PRO A 130
TRP A  86
TYR A  53
 None
MLY  A 123 ( 4.7A)
None
MLY  A 105 ( 3.5A)
 1.41A 4v2yB-3ln3A:
undetectable		 4v2yB-3ln3A:
17.52
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.
4V2Z_A_Y70A151_1
(CEREBLON ISOFORM 4)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		4 / 7 ASN A 127
PRO A 130
TRP A  86
TYR A  53
 None
MLY  A 123 ( 4.7A)
None
MLY  A 105 ( 3.5A)
 1.38A 4v2zA-3ln3A:
undetectable		 4v2zA-3ln3A:
17.52
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.
4V2Z_B_Y70B151_1
(CEREBLON ISOFORM 4)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		4 / 8 ASN A 127
PRO A 130
TRP A  86
TYR A  53
 None
MLY  A 123 ( 4.7A)
None
MLY  A 105 ( 3.5A)
 1.41A 4v2zB-3ln3A:
undetectable		 4v2zB-3ln3A:
17.52
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.
4V30_B_LVYB151_1
(CEREBLON ISOFORM 4)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		4 / 8 ASN A 127
PRO A 130
TRP A  86
TYR A  53
 None
MLY  A 123 ( 4.7A)
None
MLY  A 105 ( 3.5A)
 1.39A 4v30B-3ln3A:
undetectable		 4v30B-3ln3A:
17.52
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.
4V30_C_LVYC151_1
(CEREBLON ISOFORM 4)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		4 / 7 ASN A 127
PRO A 130
TRP A  86
TYR A  53
 None
MLY  A 123 ( 4.7A)
None
MLY  A 105 ( 3.5A)
 1.48A 4v30C-3ln3A:
0.0		 4v30C-3ln3A:
17.52
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.
4W5O_A_IPHA904_0
(PROTEIN ARGONAUTE-2)		 3e3x BIPA
(Vibrio
parahaemolyticus) 		4 / 7 ARG A 146
ILE A 143
PRO A 168
ILE A 204
 None
None
MLY  A 147 ( 4.7A)
MLY  A 147 ( 4.5A)
 1.07A 4w5oA-3e3xA:
undetectable		 4w5oA-3e3xA:
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.
4W5R_A_IPHA905_0
(PROTEIN ARGONAUTE-2)		 4h3w HYPOTHETICAL PROTEIN
(Parabacteroides
distasonis) 		4 / 6 ASP A 133
ALA A 199
LYS A 203
THR A 154
 None
None
MLY  A 202 ( 2.9A)
None
 1.46A 4w5rA-4h3wA:
undetectable		 4w5rA-4h3wA:
16.13
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.
4W5T_A_IPHA905_0
(PROTEIN ARGONAUTE-2)		 4h3w HYPOTHETICAL PROTEIN
(Parabacteroides
distasonis) 		4 / 6 ASP A 133
ALA A 199
LYS A 203
THR A 154
 None
None
MLY  A 202 ( 2.9A)
None
 1.49A 4w5tA-4h3wA:
undetectable		 4w5tA-4h3wA:
16.13
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.
4WG0_D_CHDD102_0
(NUCLEAR RECEPTOR
COACTIVATOR 2)		 4gxr MALONYL COA
SYNTHETASE,
BENZOATE-COA LIGASE
CHIMERIC PROTEIN
(Rhodopseudomonas
palustris;
Paraburkholderia
xenovorans) 		5 / 11 LEU A   9
LEU A 219
LEU A  71
LEU A  34
TYR A  31
 None
None
None
None
MLY  A  18 ( 4.7A)
 1.17A 4wg0D-4gxrA:
undetectable
4wg0E-4gxrA:
undetectable
4wg0F-4gxrA:
undetectable		 4wg0D-4gxrA:
2.49
4wg0E-4gxrA:
2.49
4wg0F-4gxrA:
2.49
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.
4WG0_F_CHDF103_0
(NUCLEAR RECEPTOR
COACTIVATOR 2)		 4gxr MALONYL COA
SYNTHETASE,
BENZOATE-COA LIGASE
CHIMERIC PROTEIN
(Rhodopseudomonas
palustris;
Paraburkholderia
xenovorans) 		5 / 11 LEU A   9
LEU A 219
LEU A  71
LEU A  34
TYR A  31
 None
None
None
None
MLY  A  18 ( 4.7A)
 1.19A 4wg0F-4gxrA:
undetectable
4wg0G-4gxrA:
undetectable
4wg0H-4gxrA:
undetectable		 4wg0F-4gxrA:
2.49
4wg0G-4gxrA:
2.49
4wg0H-4gxrA:
2.49
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.
4WG0_H_CHDH103_0
(NUCLEAR RECEPTOR
COACTIVATOR 2)		 4gxr MALONYL COA
SYNTHETASE,
BENZOATE-COA LIGASE
CHIMERIC PROTEIN
(Rhodopseudomonas
palustris;
Paraburkholderia
xenovorans) 		5 / 11 LEU A   9
LEU A 219
LEU A  71
LEU A  34
TYR A  31
 None
None
None
None
MLY  A  18 ( 4.7A)
 1.19A 4wg0H-4gxrA:
undetectable
4wg0I-4gxrA:
undetectable
4wg0J-4gxrA:
undetectable		 4wg0H-4gxrA:
2.49
4wg0I-4gxrA:
2.49
4wg0J-4gxrA:
2.49
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.
4WG0_J_CHDJ103_0
(NUCLEAR RECEPTOR
COACTIVATOR 2)		 4gxr MALONYL COA
SYNTHETASE,
BENZOATE-COA LIGASE
CHIMERIC PROTEIN
(Rhodopseudomonas
palustris;
Paraburkholderia
xenovorans) 		5 / 11 LEU A   9
LEU A 219
LEU A  71
LEU A  34
TYR A  31
 None
None
None
None
MLY  A  18 ( 4.7A)
 1.17A 4wg0J-4gxrA:
undetectable
4wg0K-4gxrA:
undetectable
4wg0L-4gxrA:
undetectable		 4wg0J-4gxrA:
2.49
4wg0K-4gxrA:
2.49
4wg0L-4gxrA:
2.49
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.
4WG0_K_CHDK103_0
(NUCLEAR RECEPTOR
COACTIVATOR 2)		 4gxr MALONYL COA
SYNTHETASE,
BENZOATE-COA LIGASE
CHIMERIC PROTEIN
(Rhodopseudomonas
palustris;
Paraburkholderia
xenovorans) 		5 / 11 LEU A  34
TYR A  31
LEU A  71
LEU A   9
LEU A 219
 None
MLY  A  18 ( 4.7A)
None
None
None
 1.19A 4wg0I-4gxrA:
undetectable
4wg0J-4gxrA:
undetectable
4wg0K-4gxrA:
undetectable		 4wg0I-4gxrA:
2.49
4wg0J-4gxrA:
2.49
4wg0K-4gxrA:
2.49
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.
4WQ4_A_ACTA403_0
(TRNA N6-ADENOSINE
THREONYLCARBAMOYLTRA
NSFERASE)		 1vk1 CONSERVED
HYPOTHETICAL PROTEIN
(Pyrococcus
furiosus) 		3 / 3 VAL A 113
LEU A 117
VAL A 164
 MLY  A 112 ( 3.4A)
None
None
 0.54A 4wq4A-1vk1A:
undetectable		 4wq4A-1vk1A:
21.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4WW7_A_ACTA303_0
(EKC/KEOPS COMPLEX
SUBUNIT BUD32)		 3kv0 HET-C2
(Podospora
anserina) 		4 / 4 LEU A  68
VAL A  71
GLU A  72
ARG A  75
 MLY  A  64 ( 3.5A)
None
MLY  A  76 ( 4.7A)
None
 1.32A 4ww7A-3kv0A:
undetectable		 4ww7A-3kv0A:
23.27
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.
4WW7_A_ACTA305_0
(EKC/KEOPS COMPLEX
SUBUNIT BUD32)		 5evi BETA-LACTAMASE/D-ALA
NINE
CARBOXYPEPTIDASE
(Pseudomonas
syringae
group
genomosp.
3) 		4 / 6 LEU B 350
GLU B 346
ASN B  22
ILE B  24
 MLY  B 349 ( 4.6A)
MLY  B 349 ( 4.5A)
None
MLY  B 340 ( 4.7A)
 0.94A 4ww7A-5eviB:
undetectable		 4ww7A-5eviB:
20.64
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.
4X1K_D_LOCD502_1
(TUBULIN ALPHA CHAIN
TUBULIN BETA CHAIN)		 4gxr MALONYL COA
SYNTHETASE,
BENZOATE-COA LIGASE
CHIMERIC PROTEIN
(Paraburkholderia
xenovorans;
Rhodopseudomonas
palustris) 		4 / 4 ASN A 484
SER A 277
ALA A 488
VAL A 489
 None
CO3  A 608 ( 2.3A)
None
MLY  A 491 ( 4.9A)
 1.32A 4x1kC-4gxrA:
undetectable		 4x1kC-4gxrA:
21.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4X1Y_B_LOCB502_1
(TUBULIN BETA CHAIN)		 3aag GENERAL
GLYCOSYLATION
PATHWAY PROTEIN
(Campylobacter
jejuni) 		5 / 12 LEU A 491
ALA A 682
LEU A 562
LYS A 695
ILE A 560
 None
MLY  A 493 ( 3.6A)
None
MLY  A 694 ( 3.3A)
None
 1.11A 4x1yB-3aagA:
undetectable		 4x1yB-3aagA:
22.07
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.
4X5G_B_FOLB201_0
(DIHYDROFOLATE
REDUCTASE)		 2f4i HYPOTHETICAL PROTEIN
TM0957
(Thermotoga
maritima) 		5 / 12 ALA A 137
ILE A 204
LEU A 123
ILE A  96
THR A 138
 None
MLY  A 201 ( 4.6A)
None
None
None
 1.01A 4x5gB-2f4iA:
undetectable		 4x5gB-2f4iA:
19.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4XE5_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)		 2g9n EUKARYOTIC
INITIATION FACTOR
4A-I
(Homo
sapiens) 		4 / 6 PRO A  55
ILE A  30
VAL A 236
THR A  85
 MLY  A  54 ( 2.6A)
None
MLY  A 237 ( 3.0A)
MLY  A  82 ( 3.9A)
 1.09A 4xe5A-2g9nA:
undetectable		 4xe5A-2g9nA:
11.60
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.
4XNX_A_41XA707_1
(TRANSPORTER)		 4fkm SIMILAR TO FERRIC
HYDROXAMATE RECEPTOR
1
(Staphylococcus
aureus) 		5 / 11 ALA A 275
VAL A 273
ASP A 274
GLY A 198
GLY A 276
 MLY  A 248 ( 3.9A)
MLY  A 272 ( 2.8A)
MLY  A  79 ( 3.8A)
None
None
 1.19A 4xnxA-4fkmA:
undetectable		 4xnxA-4fkmA:
19.84
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.
4XQG_A_AG2A505_1
(HOMOSPERMIDINE
SYNTHASE)		 4a5p PROTEIN MXIA
(Shigella
flexneri) 		4 / 8 ARG A 652
ARG A 657
VAL A 668
ASP A 660
 MLY  A 656 ( 4.7A)
None
MLY  A 656 ( 4.5A)
MLY  A 664 ( 3.1A)
 0.96A 4xqgA-4a5pA:
undetectable		 4xqgA-4a5pA:
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.
4XQG_B_AG2B505_1
(HOMOSPERMIDINE
SYNTHASE)		 4a5p PROTEIN MXIA
(Shigella
flexneri) 		4 / 8 ARG A 652
ARG A 657
VAL A 668
ASP A 660
 MLY  A 656 ( 4.7A)
None
MLY  A 656 ( 4.5A)
MLY  A 664 ( 3.1A)
 0.99A 4xqgB-4a5pA:
undetectable		 4xqgB-4a5pA:
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.
4XUE_A_SAMA303_0
(CATECHOL
O-METHYLTRANSFERASE)		 3aag GENERAL
GLYCOSYLATION
PATHWAY PROTEIN
(Campylobacter
jejuni) 		5 / 12 ASN A 691
TYR A 645
ASN A 638
SER A 664
GLN A 670
 None
MLY  A 646 ( 4.1A)
None
None
None
 1.27A 4xueA-3aagA:
1.5		 4xueA-3aagA:
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.
4Y1D_D_DVAD5_0
(CYCLIC HEXAPEPTIDE
CYC[NDPOPPKID]
INTEGRASE)		 3e3x BIPA
(Vibrio
parahaemolyticus) 		3 / 3 GLU A 103
LYS A  49
ASN A  38
 MLZ  A  45 ( 3.8A)
MLY  A  48 ( 3.3A)
None
 0.92A 4y1dA-3e3xA:
undetectable
4y1dD-3e3xA:
undetectable		 4y1dA-3e3xA:
20.67
4y1dD-3e3xA:
1.51
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.
4Y1D_D_DVAD5_0
(CYCLIC HEXAPEPTIDE
CYC[NDPOPPKID]
INTEGRASE)		 3sbu HYPOTHETICAL
NTF2-LIKE PROTEIN
(Bacteroides
fragilis) 		3 / 3 GLU A 138
LYS A 150
ASN A 238
 GOL  A 285 ( 4.3A)
MLY  A 149 ( 3.3A)
MLY  A 149 ( 4.2A)
 1.10A 4y1dA-3sbuA:
undetectable
4y1dD-3sbuA:
undetectable		 4y1dA-3sbuA:
18.11
4y1dD-3sbuA:
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.
4Y1D_D_DVAD5_0
(CYCLIC HEXAPEPTIDE
CYC[NDPOPPKID]
INTEGRASE)		 4gbs PUTATIVE LIPOPROTEIN
(Bacteroides
fragilis) 		3 / 3 GLU A  36
LYS A  40
ASN A 205
 None
MLY  A  39 ( 3.3A)
None
 1.10A 4y1dA-4gbsA:
undetectable
4y1dD-4gbsA:
undetectable		 4y1dA-4gbsA:
21.43
4y1dD-4gbsA:
50.00
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.
4YDQ_A_HFGA802_0
(PROLINE--TRNA LIGASE)		 5czw MYROILYSIN
(Myroides
profundi) 		5 / 12 LEU A   7
PHE A  86
PHE A 144
SER A 106
GLY A 109
 None
MLY  A  70 ( 4.0A)
None
None
None
 1.23A 4ydqA-5czwA:
undetectable		 4ydqA-5czwA:
18.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4YV5_A_SVRA205_1
(BASIC PHOSPHOLIPASE
A2 HOMOLOG 2)		 5z5c CYSTEINE SYNTHASE
(Fusobacterium
nucleatum) 		4 / 7 ASN A  11
LYS A   6
TYR A 159
LEU A 163
 MLY  A   7 ( 4.4A)
MLY  A   7 ( 1.3A)
None
None
 1.24A 4yv5A-5z5cA:
undetectable		 4yv5A-5z5cA:
19.38
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.
4YV5_B_SVRB207_2
(BASIC PHOSPHOLIPASE
A2 HOMOLOG 2)		 5z5c CYSTEINE SYNTHASE
(Fusobacterium
nucleatum) 		4 / 7 ASN A  11
LYS A   6
TYR A 159
LEU A 163
 MLY  A   7 ( 4.4A)
MLY  A   7 ( 1.3A)
None
None
 1.22A 4yv5B-5z5cA:
undetectable		 4yv5B-5z5cA:
19.38
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4YVP_A_GBMA402_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C1)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		5 / 11 TYR A  24
TYR A  55
HIS A 117
GLU A 226
LEU A 306
 MLY  A  25 (-3.6A)
NAD  A 327 ( 4.7A)
MRD  A 328 ( 3.9A)
MLY  A  27 ( 3.3A)
MRD  A 328 ( 4.3A)
 0.93A 4yvpA-3ln3A:
51.0		 4yvpA-3ln3A:
66.87
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4YVP_A_GBMA402_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C1)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		5 / 11 TYR A  24
TYR A  55
TRP A  86
HIS A 117
LEU A 306
 MLY  A  25 (-3.6A)
NAD  A 327 ( 4.7A)
None
MRD  A 328 ( 3.9A)
MRD  A 328 ( 4.3A)
 0.55A 4yvpA-3ln3A:
51.0		 4yvpA-3ln3A:
66.87
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4YVP_B_GBMB402_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C1)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		6 / 12 TYR A  24
TYR A  55
TRP A  86
HIS A 117
ASN A 167
LEU A 306
 MLY  A  25 (-3.6A)
NAD  A 327 ( 4.7A)
None
MRD  A 328 ( 3.9A)
NAD  A 327 (-3.3A)
MRD  A 328 ( 4.3A)
 0.46A 4yvpB-3ln3A:
51.1		 4yvpB-3ln3A:
66.87
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4YVV_A_GBMA402_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C3)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		6 / 9 TYR A  24
TYR A  55
TRP A  86
HIS A 117
ASN A 167
TYR A 216
 MLY  A  25 (-3.6A)
NAD  A 327 ( 4.7A)
None
MRD  A 328 ( 3.9A)
NAD  A 327 (-3.3A)
NAD  A 327 (-3.4A)
 0.38A 4yvvA-3ln3A:
49.7		 4yvvA-3ln3A:
64.71
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4YVV_B_GBMB402_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C3)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		5 / 9 TYR A  24
TYR A  55
TRP A  86
HIS A 117
ASN A 167
 MLY  A  25 (-3.6A)
NAD  A 327 ( 4.7A)
None
MRD  A 328 ( 3.9A)
NAD  A 327 (-3.3A)
 0.31A 4yvvB-3ln3A:
49.6		 4yvvB-3ln3A:
64.71
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4YVX_A_GMRA401_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C3)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		5 / 12 TYR A  24
TYR A  55
TRP A  86
HIS A 117
ASN A 167
 MLY  A  25 (-3.6A)
NAD  A 327 ( 4.7A)
None
MRD  A 328 ( 3.9A)
NAD  A 327 (-3.3A)
 0.42A 4yvxA-3ln3A:
49.4		 4yvxA-3ln3A:
64.71
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4YVX_B_GMRB401_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C3)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		5 / 12 TYR A  24
TYR A  55
TRP A  86
HIS A 117
ASN A 167
 MLY  A  25 (-3.6A)
NAD  A 327 ( 4.7A)
None
MRD  A 328 ( 3.9A)
NAD  A 327 (-3.3A)
 0.33A 4yvxB-3ln3A:
49.0		 4yvxB-3ln3A:
64.71
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.
4Z4C_A_IPHA906_0
(PROTEIN ARGONAUTE-2)		 4h3w HYPOTHETICAL PROTEIN
(Parabacteroides
distasonis) 		4 / 6 ASP A 133
ALA A 199
LYS A 203
THR A 154
 None
None
MLY  A 202 ( 2.9A)
None
 1.48A 4z4cA-4h3wA:
undetectable		 4z4cA-4h3wA:
16.13
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.
4Z4E_A_IPHA904_0
(PROTEIN ARGONAUTE-2)		 3e3x BIPA
(Vibrio
parahaemolyticus) 		4 / 7 ARG A 146
ILE A 143
PRO A 168
ILE A 204
 None
None
MLY  A 147 ( 4.7A)
MLY  A 147 ( 4.5A)
 1.04A 4z4eA-3e3xA:
undetectable		 4z4eA-3e3xA:
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.
4Z4G_A_IPHA902_0
(PROTEIN ARGONAUTE-2)		 3e3x BIPA
(Vibrio
parahaemolyticus) 		4 / 7 ARG A 146
ILE A 143
PRO A 168
ILE A 204
 None
None
MLY  A 147 ( 4.7A)
MLY  A 147 ( 4.5A)
 1.07A 4z4gA-3e3xA:
undetectable		 4z4gA-3e3xA:
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.
4ZBQ_A_ACTA605_0
(SERUM ALBUMIN)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		4 / 6 HIS A  67
GLY A  34
GLU A  64
ARG A  36
 UNL  A 274 (-3.9A)
MLY  A  35 ( 2.4A)
UNL  A 274 ( 4.5A)
None
 1.02A 4zbqA-2ftzA:
undetectable		 4zbqA-2ftzA:
19.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ZE1_A_X2NA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 3kv0 HET-C2
(Podospora
anserina) 		5 / 12 LEU A 121
PHE A 168
LEU A  16
THR A  49
MET A  51
 None
None
None
MLY  A  64 ( 4.3A)
None
 1.22A 4ze1A-3kv0A:
undetectable		 4ze1A-3kv0A:
19.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ZE2_A_1YNA602_2
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 5czw MYROILYSIN
(Myroides
profundi) 		4 / 5 ALA A 170
TYR A 169
HIS A 156
PHE A 189
 None
MLY  A 181 ( 3.9A)
None
None
 1.03A 4ze2A-5czwA:
undetectable		 4ze2A-5czwA:
18.52
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4ZFC_A_GCZA402_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C3)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		5 / 9 TYR A  24
TYR A  55
TRP A  86
HIS A 117
ASN A 167
 MLY  A  25 (-3.6A)
NAD  A 327 ( 4.7A)
None
MRD  A 328 ( 3.9A)
NAD  A 327 (-3.3A)
 0.38A 4zfcA-3ln3A:
49.7		 4zfcA-3ln3A:
64.71
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4ZFC_B_GCZB402_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C3)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		5 / 9 TYR A  24
TYR A  55
TRP A  86
HIS A 117
ASN A 167
 MLY  A  25 (-3.6A)
NAD  A 327 ( 4.7A)
None
MRD  A 328 ( 3.9A)
NAD  A 327 (-3.3A)
 0.33A 4zfcB-3ln3A:
49.8		 4zfcB-3ln3A:
64.71
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.
4ZN7_B_DESB600_1
(ESTROGEN RECEPTOR)		 2i6g PUTATIVE
METHYLTRANSFERASE
(Salmonella
enterica) 		5 / 11 LEU A  23
ALA A  25
LEU A 100
LEU A 131
LEU A  48
 None
MLY  A 167 ( 4.2A)
None
None
None
 1.18A 4zn7B-2i6gA:
undetectable		 4zn7B-2i6gA:
19.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5A1R_A_STRA600_1
(CYTOCHROME P450 3A4)		 4f54 UNCHARACTERIZED
PROTEIN
(Bacteroides
thetaiotaomicron) 		4 / 5 PHE A  42
ASP A  44
PHE A  45
VAL A 173
 None
MLY  A  43 ( 4.7A)
MLY  A 161 ( 4.9A)
None
 1.14A 5a1rA-4f54A:
undetectable		 5a1rA-4f54A:
17.05
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.
5AMI_A_EF2A151_1
(CEREBLON ISOFORM 4)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		4 / 7 ASN A 127
PRO A 130
TRP A  86
TYR A  53
 None
MLY  A 123 ( 4.7A)
None
MLY  A 105 ( 3.5A)
 1.35A 5amiA-3ln3A:
undetectable		 5amiA-3ln3A:
17.52
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.
5AMI_B_EF2B151_1
(CEREBLON ISOFORM 4)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		4 / 8 ASN A 127
PRO A 130
TRP A  86
TYR A  53
 None
MLY  A 123 ( 4.7A)
None
MLY  A 105 ( 3.5A)
 1.38A 5amiB-3ln3A:
undetectable		 5amiB-3ln3A:
17.52
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.
5AMJ_A_EF2A151_1
(CEREBLON ISOFORM 4)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		4 / 7 ASN A 127
PRO A 130
TRP A  86
TYR A  53
 None
MLY  A 123 ( 4.7A)
None
MLY  A 105 ( 3.5A)
 1.38A 5amjA-3ln3A:
undetectable		 5amjA-3ln3A:
17.52
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.
5AMJ_B_EF2B151_1
(CEREBLON ISOFORM 4)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		4 / 7 ASN A 127
PRO A 130
TRP A  86
TYR A  53
 None
MLY  A 123 ( 4.7A)
None
MLY  A 105 ( 3.5A)
 1.37A 5amjB-3ln3A:
undetectable		 5amjB-3ln3A:
17.52
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.
5B1A_W_CHDW101_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 5uvr PILO PROTEIN
(Pseudomonas
aeruginosa) 		4 / 6 ILE A 116
LEU A 121
PHE A 160
THR A 172
 None
None
None
MLY  A 196 ( 4.3A)
 1.06A 5b1aN-5uvrA:
undetectable
5b1aW-5uvrA:
undetectable		 5b1aN-5uvrA:
undetectable
5b1aW-5uvrA:
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.
5B8I_C_FK5C201_1
(SERINE/THREONINE-PRO
TEIN PHOSPHATASE
PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE)		 1iv8 MALTOOLIGOSYL
TREHALOSE SYNTHASE
(Sulfolobus
acidocaldarius) 		4 / 6 SER A 458
PRO A 461
PHE A 460
GLU A 463
 None
None
MLY  A 558 ( 4.4A)
MLY  A 558 ( 3.0A)
 1.19A 5b8iA-1iv8A:
0.1		 5b8iA-1iv8A:
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.
5B8I_C_FK5C201_2
(CALCINEURIN SUBUNIT
B, VARIANT
PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE)		 5thm ESTERASE-6
(Drosophila
melanogaster) 		4 / 4 LEU A 132
MET A 125
VAL A 124
ASN A 123
 None
MLY  A  91 ( 3.9A)
None
None
 1.15A 5b8iB-5thmA:
undetectable		 5b8iB-5thmA:
15.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5C6P_A_4YHA601_1
(PROTEIN C)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		4 / 6 ALA A  37
SER A  34
SER A  67
ASP A  43
 MLY  A  33 ( 3.4A)
MLY  A  31 ( 4.0A)
MLY  A  68 ( 3.1A)
MLY  A  68 ( 2.8A)
 1.20A 5c6pA-3ln3A:
undetectable		 5c6pA-3ln3A:
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.
5CG5_A_RISA400_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 12 LEU A  71
ASP A  74
ARG A  85
THR A 164
GLN A 198
 None
UNL  A 273 (-3.0A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.82A 5cg5A-2ftzA:
24.5		 5cg5A-2ftzA:
26.40
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.
5CG5_A_RISA400_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 12 LEU A  71
ASP A  80
ARG A  85
THR A 164
GLN A 198
 None
MLY  A 223 ( 3.6A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.50A 5cg5A-2ftzA:
24.5		 5cg5A-2ftzA:
26.40
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.
5CG6_A_RISA404_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 12 LEU A  71
ASP A  74
ARG A  85
THR A 164
GLN A 198
 None
UNL  A 273 (-3.0A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.83A 5cg6A-2ftzA:
25.2		 5cg6A-2ftzA:
26.40
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.
5CG6_A_RISA404_1
(FARNESYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 12 LEU A  71
ASP A  80
ARG A  85
THR A 164
GLN A 198
 None
MLY  A 223 ( 3.6A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.9A)
MLY  A 163 ( 3.8A)
 0.49A 5cg6A-2ftzA:
25.2		 5cg6A-2ftzA:
26.40
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.
5CSW_A_P06A801_2
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 2p4p HYPOTHETICAL PROTEIN
HD1797
([Haemophilus]
ducreyi) 		3 / 3 PHE A  62
ILE A  37
ASP A  73
 MLY  A  61 ( 4.5A)
None
None
 0.74A 5cswA-2p4pA:
undetectable		 5cswA-2p4pA:
14.60
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.
5CSW_B_P06B801_2
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 2p4p HYPOTHETICAL PROTEIN
HD1797
([Haemophilus]
ducreyi) 		3 / 3 PHE A  62
ILE A  37
ASP A  73
 MLY  A  61 ( 4.5A)
None
None
 0.69A 5cswB-2p4pA:
undetectable		 5cswB-2p4pA:
14.60
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.
5CSY_B_ACRB601_1
(4-ALPHA-GLUCANOTRANS
FERASE DPE1,
CHLOROPLASTIC/AMYLOP
LASTIC)		 1iv8 MALTOOLIGOSYL
TREHALOSE SYNTHASE
(Sulfolobus
acidocaldarius) 		5 / 12 ASP A 394
ASP A 228
GLU A 255
HIS A 442
ASP A 443
 MLY  A 390 ( 3.8A)
None
None
None
None
 0.84A 5csyB-1iv8A:
7.3		 5csyB-1iv8A:
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.
5ECL_D_ILED602_0
(JASMONIC ACID-AMIDO
SYNTHETASE JAR1)		 2vd9 ALANINE RACEMASE
(Bacillus
anthracis) 		4 / 6 ILE A 311
ALA A 283
VAL A 285
VAL A 309
 None
None
MLY  A 255 ( 3.9A)
MLY  A 307 ( 4.1A)
 0.85A 5eclD-2vd9A:
undetectable		 5eclD-2vd9A:
23.27
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.
5ECO_A_LEUA602_0
(JASMONIC ACID-AMIDO
SYNTHETASE JAR1)		 4dzg PLIG
(Aeromonas
hydrophila) 		4 / 6 THR A  26
THR A  53
VAL A  29
HIS A  51
 None
MLY  A 107 ( 4.0A)
None
None
 0.92A 5ecoA-4dzgA:
undetectable		 5ecoA-4dzgA:
11.74
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.
5ESG_A_1YNA701_2
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 5uvr PILO PROTEIN
(Pseudomonas
aeruginosa) 		4 / 4 LEU A 173
TYR A 141
PRO A 145
ILE A 146
 None
None
MLY  A 196 ( 4.4A)
None
 1.17A 5esgA-5uvrA:
undetectable		 5esgA-5uvrA:
11.37
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.
5ESH_A_1YNA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 2qjv UNCHARACTERIZED
IOLB-LIKE PROTEIN
(Salmonella
enterica) 		5 / 12 ALA A  94
LEU A  88
TYR A  84
ILE A  81
LEU A  58
 MLY  A  95 ( 3.3A)
None
None
None
None
 1.23A 5eshA-2qjvA:
undetectable		 5eshA-2qjvA:
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.
5F9Z_B_HFGB703_0
(AMINOACYL-TRNA
SYNTHETASE)		 3oix PUTATIVE
DIHYDROOROTATE
DEHYDROGENASE
DIHYDROOROTATE
OXIDASE
(Streptococcus
mutans) 		5 / 12 LEU A  73
SER A 100
GLU A 126
SER A  67
GLY A 220
 None
MLY  A  45 ( 4.6A)
None
FMN  A 400 ( 3.8A)
FMN  A 400 (-3.4A)
 1.34A 5f9zB-3oixA:
undetectable		 5f9zB-3oixA:
24.23
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.
5FPD_A_PZAA1385_0
(HEAT SHOCK-RELATED
70KDA PROTEIN 2)		 5chx XRCC4-MYH7-1590-1657
(Homo
sapiens) 		4 / 7 SER A  53
ALA A  56
GLY A  64
VAL A  67
 MLY  A  63 ( 3.7A)
MLY  A  63 ( 4.0A)
MLY  A  65 ( 2.4A)
MLY  A  63 ( 3.8A)
 0.66A 5fpdA-5chxA:
undetectable		 5fpdA-5chxA:
20.56
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.
5FSA_A_X2NA590_1
(CYP51 VARIANT1)		 1lln ANTIVIRAL PROTEIN 3
(Phytolacca
americana) 		5 / 12 ALA A 149
LEU A  61
ILE A   2
LEU A 137
PHE A  59
 None
None
None
MLY  A 134 ( 4.8A)
None
 1.21A 5fsaA-1llnA:
undetectable		 5fsaA-1llnA:
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.
5G5G_C_ACTC1740_0
(PUTATIVE XANTHINE
DEHYDROGENASE YAGS
FAD-BINDING SUBUNIT)		 3kv0 HET-C2
(Podospora
anserina) 		4 / 4 VAL A 179
GLU A 182
GLY A 173
LEU A 172
 MLY  A 178 ( 3.4A)
None
MLY  A 171 ( 4.6A)
MLY  A 171 ( 4.1A)
 1.31A 5g5gC-3kv0A:
undetectable		 5g5gC-3kv0A:
15.09
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.
5HES_A_032A401_2
(MITOGEN-ACTIVATED
PROTEIN KINASE
KINASE KINASE MLT)		 2p4p HYPOTHETICAL PROTEIN
HD1797
([Haemophilus]
ducreyi) 		4 / 6 PHE A  28
PHE A  54
VAL A  19
ASP A  58
 None
MLY  A  61 ( 3.7A)
CA  A 201 ( 4.2A)
MLY  A  59 ( 3.2A)
 1.17A 5hesA-2p4pA:
undetectable		 5hesA-2p4pA:
12.46
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.
5HIE_C_P06C801_2
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 4a5p PROTEIN MXIA
(Shigella
flexneri) 		4 / 7 ILE A 542
PHE A 643
ILE A 666
CYH A 580
 None
MLY  A 641 ( 4.5A)
None
None
 0.99A 5hieC-4a5pA:
undetectable		 5hieC-4a5pA:
22.70
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.
5HM8_A_ADNA501_1
(ADENOSYLHOMOCYSTEINA
SE)		 4f6e SUPEROXIDE DISMUTASE
[MN], MITOCHONDRIAL
(Saccharomyces
cerevisiae) 		5 / 12 HIS A  81
ASP A 168
HIS A 172
GLY A  76
PHE A 135
 MN  A 301 (-3.4A)
MN  A 301 (-2.6A)
MN  A 301 (-3.4A)
MLY  A  72 ( 3.5A)
None
 1.07A 5hm8A-4f6eA:
undetectable		 5hm8A-4f6eA:
19.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HM8_A_ADNA501_2
(ADENOSYLHOMOCYSTEINA
SE)		 5sv0 BIOPOLYMER TRANSPORT
PROTEIN EXBB
(Escherichia
coli) 		4 / 5 GLU B  99
GLU B  94
THR B 111
LEU B  68
 None
None
MLY  B 108 ( 4.5A)
None
 1.26A 5hm8A-5sv0B:
undetectable		 5hm8A-5sv0B:
20.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HM8_B_ADNB501_1
(ADENOSYLHOMOCYSTEINA
SE)		 4f6e SUPEROXIDE DISMUTASE
[MN], MITOCHONDRIAL
(Saccharomyces
cerevisiae) 		5 / 12 HIS A  81
ASP A 168
HIS A 172
GLY A  76
PHE A 135
 MN  A 301 (-3.4A)
MN  A 301 (-2.6A)
MN  A 301 (-3.4A)
MLY  A  72 ( 3.5A)
None
 1.07A 5hm8B-4f6eA:
undetectable		 5hm8B-4f6eA:
19.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HM8_C_ADNC501_1
(ADENOSYLHOMOCYSTEINA
SE)		 4f6e SUPEROXIDE DISMUTASE
[MN], MITOCHONDRIAL
(Saccharomyces
cerevisiae) 		5 / 12 HIS A  81
ASP A 168
HIS A 172
GLY A  76
PHE A 135
 MN  A 301 (-3.4A)
MN  A 301 (-2.6A)
MN  A 301 (-3.4A)
MLY  A  72 ( 3.5A)
None
 1.07A 5hm8C-4f6eA:
undetectable		 5hm8C-4f6eA:
19.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HM8_C_ADNC501_2
(ADENOSYLHOMOCYSTEINA
SE)		 5sv0 BIOPOLYMER TRANSPORT
PROTEIN EXBB
(Escherichia
coli) 		4 / 5 GLU B  99
GLU B  94
THR B 111
LEU B  68
 None
None
MLY  B 108 ( 4.5A)
None
 1.26A 5hm8C-5sv0B:
undetectable		 5hm8C-5sv0B:
20.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HM8_D_ADND501_1
(ADENOSYLHOMOCYSTEINA
SE)		 4f6e SUPEROXIDE DISMUTASE
[MN], MITOCHONDRIAL
(Saccharomyces
cerevisiae) 		5 / 12 HIS A  81
ASP A 168
HIS A 172
GLY A  76
PHE A 135
 MN  A 301 (-3.4A)
MN  A 301 (-2.6A)
MN  A 301 (-3.4A)
MLY  A  72 ( 3.5A)
None
 1.07A 5hm8D-4f6eA:
undetectable		 5hm8D-4f6eA:
19.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HM8_D_ADND501_2
(ADENOSYLHOMOCYSTEINA
SE)		 5sv0 BIOPOLYMER TRANSPORT
PROTEIN EXBB
(Escherichia
coli) 		4 / 5 GLU B  99
GLU B  94
THR B 111
LEU B  68
 None
None
MLY  B 108 ( 4.5A)
None
 1.26A 5hm8D-5sv0B:
undetectable		 5hm8D-5sv0B:
20.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HM8_E_ADNE501_1
(ADENOSYLHOMOCYSTEINA
SE)		 4f6e SUPEROXIDE DISMUTASE
[MN], MITOCHONDRIAL
(Saccharomyces
cerevisiae) 		5 / 12 HIS A  81
ASP A 168
HIS A 172
GLY A  76
PHE A 135
 MN  A 301 (-3.4A)
MN  A 301 (-2.6A)
MN  A 301 (-3.4A)
MLY  A  72 ( 3.5A)
None
 1.07A 5hm8E-4f6eA:
undetectable		 5hm8E-4f6eA:
19.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HM8_E_ADNE501_2
(ADENOSYLHOMOCYSTEINA
SE)		 5sv0 BIOPOLYMER TRANSPORT
PROTEIN EXBB
(Escherichia
coli) 		4 / 5 GLU B  99
GLU B  94
THR B 111
LEU B  68
 None
None
MLY  B 108 ( 4.5A)
None
 1.26A 5hm8E-5sv0B:
undetectable		 5hm8E-5sv0B:
20.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HM8_F_ADNF501_1
(ADENOSYLHOMOCYSTEINA
SE)		 4f6e SUPEROXIDE DISMUTASE
[MN], MITOCHONDRIAL
(Saccharomyces
cerevisiae) 		5 / 12 HIS A  81
ASP A 168
HIS A 172
GLY A  76
PHE A 135
 MN  A 301 (-3.4A)
MN  A 301 (-2.6A)
MN  A 301 (-3.4A)
MLY  A  72 ( 3.5A)
None
 1.07A 5hm8F-4f6eA:
undetectable		 5hm8F-4f6eA:
19.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HM8_F_ADNF501_2
(ADENOSYLHOMOCYSTEINA
SE)		 5sv0 BIOPOLYMER TRANSPORT
PROTEIN EXBB
(Escherichia
coli) 		4 / 5 GLU B  99
GLU B  94
THR B 111
LEU B  68
 None
None
MLY  B 108 ( 4.5A)
None
 1.26A 5hm8F-5sv0B:
undetectable		 5hm8F-5sv0B:
20.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HM8_G_ADNG501_1
(ADENOSYLHOMOCYSTEINA
SE)		 4f6e SUPEROXIDE DISMUTASE
[MN], MITOCHONDRIAL
(Saccharomyces
cerevisiae) 		5 / 12 HIS A  81
ASP A 168
HIS A 172
GLY A  76
PHE A 135
 MN  A 301 (-3.4A)
MN  A 301 (-2.6A)
MN  A 301 (-3.4A)
MLY  A  72 ( 3.5A)
None
 1.07A 5hm8G-4f6eA:
undetectable		 5hm8G-4f6eA:
19.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HM8_H_ADNH501_1
(ADENOSYLHOMOCYSTEINA
SE)		 4f6e SUPEROXIDE DISMUTASE
[MN], MITOCHONDRIAL
(Saccharomyces
cerevisiae) 		5 / 12 HIS A  81
ASP A 168
HIS A 172
GLY A  76
PHE A 135
 MN  A 301 (-3.4A)
MN  A 301 (-2.6A)
MN  A 301 (-3.4A)
MLY  A  72 ( 3.5A)
None
 1.07A 5hm8H-4f6eA:
undetectable		 5hm8H-4f6eA:
19.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HM8_H_ADNH501_2
(ADENOSYLHOMOCYSTEINA
SE)		 5sv0 BIOPOLYMER TRANSPORT
PROTEIN EXBB
(Escherichia
coli) 		4 / 5 GLU B  99
GLU B  94
THR B 111
LEU B  68
 None
None
MLY  B 108 ( 4.5A)
None
 1.26A 5hm8H-5sv0B:
undetectable		 5hm8H-5sv0B:
20.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HNW_B_TA1B902_1
(TUBULIN BETA-2B
CHAIN)		 3sbu HYPOTHETICAL
NTF2-LIKE PROTEIN
(Bacteroides
fragilis) 		5 / 12 ASP A 176
GLU A 175
LEU A 254
LEU A 229
LEU A 265
 None
GOL  A 288 (-3.2A)
MLY  A 255 ( 4.5A)
None
None
 1.13A 5hnwB-3sbuA:
undetectable		 5hnwB-3sbuA:
20.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HNX_B_TA1B902_1
(TUBULIN BETA-2B
CHAIN)		 5cj4 XRCC4-MYH7-(1562-162
2) CHIMERA PROTEIN
(Homo
sapiens) 		5 / 12 VAL A  22
LEU A  36
SER A   6
PHE A  86
ARG A  71
 MLY  A   4 ( 4.2A)
None
None
None
None
 1.35A 5hnxB-5cj4A:
undetectable		 5hnxB-5cj4A:
19.04
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.
5HNY_B_TA1B601_1
(TUBULIN BETA-2B
CHAIN)		 3sbu HYPOTHETICAL
NTF2-LIKE PROTEIN
(Bacteroides
fragilis) 		5 / 12 ASP A 176
GLU A 175
LEU A 254
LEU A 229
LEU A 265
 None
GOL  A 288 (-3.2A)
MLY  A 255 ( 4.5A)
None
None
 1.11A 5hnyB-3sbuA:
undetectable		 5hnyB-3sbuA:
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.
5HUA_A_FK5A201_1
(FK506-BINDING
PROTEIN 1)		 2p4p HYPOTHETICAL PROTEIN
HD1797
([Haemophilus]
ducreyi) 		5 / 11 TYR A  60
ASP A  58
ILE A  37
PHE A  28
PHE A  62
 MLY  A  59 ( 3.8A)
MLY  A  59 ( 3.2A)
None
None
MLY  A  61 ( 4.5A)
 1.13A 5huaA-2p4pA:
undetectable		 5huaA-2p4pA:
23.20
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.
5HW8_C_FK5C201_1
(FK506-BINDING
PROTEIN 1)		 2etv IRON(III) ABC
TRANSPORTER,
PERIPLASMIC
IRON-BINDING
PROTEIN, PUTATIVE
(Thermotoga
maritima) 		5 / 10 TYR A 268
ASP A 260
VAL A 279
ILE A 346
ILE A 234
 None
EDO  A  13 (-2.9A)
MLY  A 278 ( 3.1A)
MLY  A 345 ( 4.2A)
None
 1.18A 5hw8C-2etvA:
undetectable
5hw8H-2etvA:
undetectable		 5hw8C-2etvA:
20.06
5hw8H-2etvA:
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.
5HWC_A_FK5A201_1
(FK506-BINDING
PROTEIN 1A)		 2p4p HYPOTHETICAL PROTEIN
HD1797
([Haemophilus]
ducreyi) 		5 / 11 TYR A  60
ASP A  58
ILE A  37
PHE A  28
PHE A  62
 MLY  A  59 ( 3.8A)
MLY  A  59 ( 3.2A)
None
None
MLY  A  61 ( 4.5A)
 1.11A 5hwcA-2p4pA:
undetectable		 5hwcA-2p4pA:
17.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5IEP_A_VDYA201_2
(CDL2.3B)		 4iqn PUTATIVE CYTOPLASMIC
PROTEIN
(Salmonella
enterica) 		5 / 9 ILE C 135
PRO C  49
VAL C  12
LEU C   8
ILE C   9
 None
None
MLY  C  13 ( 3.1A)
None
None
 1.32A 5iepA-4iqnC:
undetectable		 5iepA-4iqnC:
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.
5IK1_A_CAMA502_0
(CAMPHOR
5-MONOOXYGENASE)		 3rwx HYPOTHETICAL
BACTERIAL OUTER
MEMBRANE PROTEIN
(Bacteroides
fragilis) 		4 / 5 PHE A 266
LEU A 165
GLY A 198
ILE A 247
 MLY  A 267 ( 4.6A)
None
MLY  A 197 ( 2.4A)
MLY  A 267 ( 4.4A)
 0.99A 5ik1A-3rwxA:
undetectable		 5ik1A-3rwxA:
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.
5IY5_P_CHDP307_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 3sbu HYPOTHETICAL
NTF2-LIKE PROTEIN
(Bacteroides
fragilis) 		4 / 5 LEU A 199
PHE A 201
LEU A 276
PHE A 184
 None
None
MLY  A 278 ( 4.9A)
None
 1.25A 5iy5P-3sbuA:
undetectable
5iy5W-3sbuA:
undetectable		 5iy5P-3sbuA:
21.48
5iy5W-3sbuA:
14.12
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.
5JGL_A_SAMA301_1
(UBIE/COQ5 FAMILY
METHYLTRANSFERASE,
PUTATIVE)		 3hsa PLECKSTRIN HOMOLOGY
DOMAIN
(Shewanella
amazonensis) 		3 / 3 GLY A 114
ASP A 111
ASN A  10
 MLY  A 117 ( 4.4A)
GOL  A 126 (-3.9A)
None
 0.46A 5jglA-3hsaA:
undetectable		 5jglA-3hsaA:
19.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5JLC_A_1YNA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 1lln ANTIVIRAL PROTEIN 3
(Phytolacca
americana) 		5 / 12 ALA A  62
GLY A 192
PHE A 162
THR A 171
MET A 169
 None
None
None
None
MLY  A 134 ( 4.8A)
 1.26A 5jlcA-1llnA:
undetectable		 5jlcA-1llnA:
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.
5JMN_C_FUAC1101_1
(MULTIDRUG EFFLUX
PUMP SUBUNIT ACRB)		 2vd9 ALANINE RACEMASE
(Bacillus
anthracis) 		3 / 3 VAL A 256
HIS A 323
VAL A 309
 MLY  A 255 ( 3.4A)
None
MLY  A 307 ( 4.1A)
 0.60A 5jmnC-2vd9A:
undetectable		 5jmnC-2vd9A:
16.86
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.
5K4P_A_SORA611_0
(PROBABLE
PHOSPHATIDYLETHANOLA
MINE TRANSFERASE
MCR-1)		 4gxr MALONYL COA
SYNTHETASE,
BENZOATE-COA LIGASE
CHIMERIC PROTEIN
(Rhodopseudomonas
palustris;
Paraburkholderia
xenovorans) 		4 / 6 GLY A 323
TYR A 391
GLY A 320
ASN A 311
 None
None
MLY  A 412 ( 4.6A)
None
 0.90A 5k4pA-4gxrA:
undetectable		 5k4pA-4gxrA:
22.66
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.
5K7U_A_SAMA601_0
(N6-ADENOSINE-METHYLT
RANSFERASE 70 KDA
SUBUNIT)		 2vd9 ALANINE RACEMASE
(Bacillus
anthracis) 		5 / 12 ILE A 337
PRO A 248
LEU A 232
GLU A  13
GLY A 338
 None
None
None
MLY  A 333 ( 3.7A)
None
 1.19A 5k7uA-2vd9A:
undetectable		 5k7uA-2vd9A:
20.87
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.
5KR2_A_ROCA101_1
(PROTEASE PR5-SQV)		 4nk6 POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE
(Pseudomonas
syringae
group
genomosp.
3) 		5 / 9 ALA A 287
ASP A 288
ILE A 312
GLY A 292
ILE A 316
 None
MLY  A 336 ( 4.8A)
MLY  A 336 ( 4.9A)
None
None
 1.29A 5kr2A-4nk6A:
undetectable		 5kr2A-4nk6A:
11.41
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.
5LSU_A_SAMA1304_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
NSD2)		 4f6e SUPEROXIDE DISMUTASE
[MN], MITOCHONDRIAL
(Saccharomyces
cerevisiae) 		5 / 12 GLY A 132
TRP A 170
TYR A 185
ASN A 122
THR A 121
 None
None
None
MLY  A 187 ( 4.3A)
None
 1.06A 5lsuA-4f6eA:
undetectable		 5lsuA-4f6eA:
22.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5LSU_B_SAMB1304_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
NSD2)		 4f6e SUPEROXIDE DISMUTASE
[MN], MITOCHONDRIAL
(Saccharomyces
cerevisiae) 		5 / 12 GLY A 132
TRP A 170
TYR A 185
ASN A 122
THR A 121
 None
None
None
MLY  A 187 ( 4.3A)
None
 1.03A 5lsuB-4f6eA:
undetectable		 5lsuB-4f6eA:
22.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5M66_A_ADNA502_1
(ADENOSYLHOMOCYSTEINA
SE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 12 ASP A  48
THR A  44
GLY A 249
MET A 186
PHE A 176
 None
None
MLY  A 248 ( 2.4A)
None
MLY  A 181 ( 4.5A)
 1.07A 5m66A-2ftzA:
undetectable		 5m66A-2ftzA:
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.
5M66_C_ADNC502_1
(ADENOSYLHOMOCYSTEINA
SE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 12 ASP A  48
THR A  44
GLY A 249
MET A 186
PHE A 176
 None
None
MLY  A 248 ( 2.4A)
None
MLY  A 181 ( 4.5A)
 1.05A 5m66C-2ftzA:
undetectable		 5m66C-2ftzA:
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.
5N5D_A_SAMA306_1
(METHYLTRANSFERASE)		 4f6e SUPEROXIDE DISMUTASE
[MN], MITOCHONDRIAL
(Saccharomyces
cerevisiae) 		4 / 7 LEU A 103
PHE A 202
ILE A 207
ASN A  87
 None
MLY  A 138 ( 3.9A)
MLY  A 206 ( 4.0A)
None
 1.01A 5n5dA-4f6eA:
undetectable		 5n5dA-4f6eA:
21.40
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.
5ND7_B_TA1B601_2
(TUBULIN BETA-2B
CHAIN)		 3iuz PUTATIVE GLYOXALASE
SUPERFAMILY PROTEIN
(Cupriavidus
pinatubonensis) 		3 / 3 THR A 217
PRO A 148
ARG A 150
 None
MLY  A  88 ( 4.6A)
None
 0.76A 5nd7B-3iuzA:
undetectable		 5nd7B-3iuzA:
20.45
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.
5NM5_B_LOCB502_1
(TUBULIN ALPHA-1B
CHAIN
TUBULIN BETA-2B
CHAIN)		 4gxr MALONYL COA
SYNTHETASE,
BENZOATE-COA LIGASE
CHIMERIC PROTEIN
(Paraburkholderia
xenovorans;
Rhodopseudomonas
palustris) 		4 / 4 ASN A 484
SER A 277
ALA A 488
VAL A 489
 None
CO3  A 608 ( 2.3A)
None
MLY  A 491 ( 4.9A)
 1.17A 5nm5A-4gxrA:
undetectable		 5nm5A-4gxrA:
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.
5O96_E_SAME501_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE E)		 5ue0 CT622 PROTEIN
(Chlamydia
trachomatis) 		5 / 9 LEU A 580
SER A 560
LEU A 609
ARG A 611
GLN A 608
 MLY  A 579 ( 4.6A)
None
None
None
None
 1.44A 5o96E-5ue0A:
undetectable
5o96F-5ue0A:
undetectable		 5o96E-5ue0A:
undetectable
5o96F-5ue0A:
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.
5OEX_A_CUA602_0
(THIOCYANATE
DEHYDROGENASE)		 4mdw UNCHARACTERIZED
PROTEIN YDHK
(Bacillus
subtilis) 		3 / 3 LYS A 132
HIS A 130
HIS A 158
 MLY  A 131 ( 3.6A)
MLY  A 131 ( 3.7A)
None
 1.22A 5oexA-4mdwA:
undetectable		 5oexA-4mdwA:
17.65
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.
5OH1_B_EF2B202_0
(CEREBLON ISOFORM 4)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		4 / 7 ASN A 127
PRO A 130
TRP A  86
TYR A  53
 None
MLY  A 123 ( 4.7A)
None
MLY  A 105 ( 3.5A)
 1.40A 5oh1B-3ln3A:
undetectable		 5oh1B-3ln3A:
13.10
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.
5OH3_A_9V2A202_0
(CEREBLON ISOFORM 4)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		4 / 7 ASN A 127
PRO A 130
TRP A  86
TYR A  53
 None
MLY  A 123 ( 4.7A)
None
MLY  A 105 ( 3.5A)
 1.35A 5oh3A-3ln3A:
undetectable		 5oh3A-3ln3A:
17.52
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.
5OH3_B_9V2B202_0
(CEREBLON ISOFORM 4)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		4 / 7 ASN A 127
PRO A 130
TRP A  86
TYR A  53
 None
MLY  A 123 ( 4.7A)
None
MLY  A 105 ( 3.5A)
 1.36A 5oh3B-3ln3A:
undetectable		 5oh3B-3ln3A:
17.52
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.
5OV9_B_CVIB602_0
(ACETYLCHOLINESTERASE)		 5oed GTGE
RAS-RELATED PROTEIN
RAB-32
(Salmonella
enterica;
Homo
sapiens) 		4 / 8 TYR A  42
ASP A  35
THR A  37
VAL B  66
 None
None
None
MLY  B  65 ( 3.1A)
 1.12A 5ov9B-5oedA:
undetectable		 5ov9B-5oedA:
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.
5OY0_2_PQN2843_1
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A2)		 3e3x BIPA
(Vibrio
parahaemolyticus) 		5 / 12 MET A  33
PHE A  35
SER A 107
ILE A 309
LEU A 104
 None
None
MLY  A 314 ( 4.8A)
None
None
 1.16A 5oy02-3e3xA:
undetectable		 5oy02-3e3xA:
15.61
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.
5OY0_B_PQNB1844_1
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A2)		 3e3x BIPA
(Vibrio
parahaemolyticus) 		5 / 10 MET A  33
PHE A  35
SER A 107
ILE A 309
LEU A 104
 None
None
MLY  A 314 ( 4.8A)
None
None
 1.21A 5oy0b-3e3xA:
undetectable		 5oy0b-3e3xA:
15.19
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.
5Q1S_A_AWYA1103_0
(DNA CROSS-LINK
REPAIR 1A PROTEIN)		 3rwx HYPOTHETICAL
BACTERIAL OUTER
MEMBRANE PROTEIN
(Bacteroides
fragilis) 		4 / 6 VAL A 155
ILE A 233
LYS A 182
TYR A 159
 None
MLY  A 232 ( 3.9A)
MLY  A 181 ( 3.3A)
MLY  A 283 ( 3.9A)
 1.40A 5q1sA-3rwxA:
undetectable		 5q1sA-3rwxA:
21.68
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.
5QJQ_A_K1SA304_0
(ADP-SUGAR
PYROPHOSPHATASE)		 4wri OKADAIC ACID BINDING
PROTEIN 2-ALPHA
(Halichondria
okadai) 		4 / 5 GLU A  25
TRP A  22
VAL A  36
LEU A  82
 MLY  A  47 ( 4.1A)
OKA  A 201 ( 4.7A)
None
None
 1.31A 5qjqA-4wriA:
undetectable
5qjqB-4wriA:
undetectable		 5qjqA-4wriA:
22.37
5qjqB-4wriA:
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.
5QJQ_B_K1SB304_0
(ADP-SUGAR
PYROPHOSPHATASE)		 4wri OKADAIC ACID BINDING
PROTEIN 2-ALPHA
(Halichondria
okadai) 		4 / 5 TRP A  22
VAL A  36
LEU A  82
GLU A  25
 OKA  A 201 ( 4.7A)
None
None
MLY  A  47 ( 4.1A)
 1.31A 5qjqA-4wriA:
undetectable
5qjqB-4wriA:
undetectable		 5qjqA-4wriA:
22.37
5qjqB-4wriA:
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.
5QJQ_C_K1SC305_0
(ADP-SUGAR
PYROPHOSPHATASE)		 4wri OKADAIC ACID BINDING
PROTEIN 2-ALPHA
(Halichondria
okadai) 		4 / 5 GLU A  25
TRP A  22
VAL A  36
LEU A  82
 MLY  A  47 ( 4.1A)
OKA  A 201 ( 4.7A)
None
None
 1.33A 5qjqC-4wriA:
undetectable
5qjqD-4wriA:
undetectable		 5qjqC-4wriA:
22.37
5qjqD-4wriA:
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.
5SYE_B_TA1B502_1
(TUBULIN BETA CHAIN)		 5thm ESTERASE-6
(Drosophila
melanogaster) 		5 / 12 VAL A 282
LEU A 249
ASP A 149
ALA A 227
GLY A 143
 None
MLY  A 250 ( 3.7A)
None
None
None
 1.19A 5syeB-5thmA:
2.8		 5syeB-5thmA:
21.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5T8S_B_SAMB402_0
(S-ADENOSYLMETHIONINE
SYNTHASE)		 4nge PRESEQUENCE
PROTEASE,
MITOCHONDRIAL
(Homo
sapiens) 		4 / 8 GLN D 949
ASP D 951
ILE D 952
ILE D 885
 None
None
None
MLY  D 884 ( 4.0A)
 0.94A 5t8sA-4ngeD:
undetectable		 5t8sA-4ngeD:
18.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5TT3_A_EZLA303_1
(ALPHA-CARBONIC
ANHYDRASE)		 4amg SNOGD
(Streptomyces
nogalater) 		5 / 10 VAL A 143
VAL A 181
ALA A 382
PRO A 378
TRP A 204
 None
None
None
None
MLY  A 384 ( 3.7A)
 1.08A 5tt3A-4amgA:
undetectable		 5tt3A-4amgA:
19.50
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.
5TT3_C_EZLC303_1
(ALPHA-CARBONIC
ANHYDRASE)		 4amg SNOGD
(Streptomyces
nogalater) 		5 / 10 VAL A 143
VAL A 181
ALA A 382
PRO A 378
TRP A 204
 None
None
None
None
MLY  A 384 ( 3.7A)
 1.03A 5tt3C-4amgA:
undetectable		 5tt3C-4amgA:
19.50
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.
5TUD_A_ERMA2001_2
(5-HYDROXYTRYPTAMINE
RECEPTOR 2B,SOLUBLE
CYTOCHROME B562
CHIMERA)		 5z5c CYSTEINE SYNTHASE
(Fusobacterium
nucleatum) 		4 / 7 THR A  73
LEU A  54
VAL A  13
GLU A 155
 CL  A 402 (-4.1A)
MLY  A  55 ( 4.2A)
None
None
 0.94A 5tudA-5z5cA:
undetectable		 5tudA-5z5cA:
11.29
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.
5UMW_B_RBFB201_1
(GLYOXALASE/BLEOMYCIN
RESISANCE
PROTEIN/DIOXYGENASE)		 4nge PRESEQUENCE
PROTEASE,
MITOCHONDRIAL
(Homo
sapiens) 		4 / 7 VAL D 701
ARG D 633
TYR D 632
GLU D 367
 None
MLY  D 363 ( 4.1A)
None
MLY  D 363 ( 4.3A)
 1.15A 5umwB-4ngeD:
undetectable
5umwE-4ngeD:
undetectable		 5umwB-4ngeD:
6.20
5umwE-4ngeD:
6.20
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.
5UTU_F_ADNF503_1
(ADENOSYLHOMOCYSTEINA
SE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 12 ASP A  48
THR A  44
GLY A 249
MET A 186
PHE A 176
 None
None
MLY  A 248 ( 2.4A)
None
MLY  A 181 ( 4.5A)
 1.03A 5utuF-2ftzA:
undetectable		 5utuF-2ftzA:
19.57
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.
5V02_R_657R201_0
(CALMODULIN-1
SMALL CONDUCTANCE
CALCIUM-ACTIVATED
POTASSIUM CHANNEL
PROTEIN 2)		 4amg SNOGD
(Streptomyces
nogalater) 		5 / 10 ALA A 382
LEU A 385
VAL A 386
VAL A  43
MET A  13
 None
MLY  A 384 ( 4.3A)
None
None
None
 1.13A 5v02B-4amgA:
undetectable
5v02R-4amgA:
undetectable		 5v02B-4amgA:
12.25
5v02R-4amgA:
16.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VC0_A_RITA602_2
(CYTOCHROME P450 3A4)		 4nk6 POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE
(Pseudomonas
syringae
group
genomosp.
3) 		4 / 7 ILE A 352
PHE A 293
THR A 298
THR A 335
 None
None
None
MLY  A 336 ( 3.9A)
 1.04A 5vc0A-4nk6A:
undetectable		 5vc0A-4nk6A:
22.18
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.
5VCG_A_08YA602_2
(CYTOCHROME P450 3A4)		 5cj4 XRCC4-MYH7-(1562-162
2) CHIMERA PROTEIN
(Homo
sapiens) 		3 / 3 ARG A1608
ARG A1613
ARG A1606
 MLY  A1615 ( 4.2A)
None
None
 0.81A 5vcgA-5cj4A:
undetectable		 5vcgA-5cj4A:
18.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VKQ_A_PCFA1803_0
(NO MECHANORECEPTOR
POTENTIAL C ISOFORM
L)		 4ys4 MEROZOITE SURFACE
PROTEIN P41
(Plasmodium
falciparum) 		5 / 10 ILE A 334
ILE A 314
LEU A 313
HIS A 257
ILE A 272
 None
None
None
MLY  A 264 ( 3.8A)
None
 1.28A 5vkqA-4ys4A:
undetectable
5vkqD-4ys4A:
undetectable		 5vkqA-4ys4A:
11.28
5vkqD-4ys4A:
11.28
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.
5VKQ_B_PCFB1802_0
(NO MECHANORECEPTOR
POTENTIAL C ISOFORM
L)		 5z5c CYSTEINE SYNTHASE
(Fusobacterium
nucleatum) 		4 / 7 THR A 215
HIS A 225
PRO A 210
ILE A 227
 MLY  A 221 ( 3.1A)
MLY  A 224 ( 4.8A)
None
None
 1.22A 5vkqA-5z5cA:
undetectable
5vkqB-5z5cA:
undetectable		 5vkqA-5z5cA:
undetectable
5vkqB-5z5cA:
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.
5VKQ_B_PCFB1808_0
(NO MECHANORECEPTOR
POTENTIAL C ISOFORM
L)		 4ys4 MEROZOITE SURFACE
PROTEIN P41
(Plasmodium
falciparum) 		5 / 10 HIS A 257
ILE A 272
ILE A 334
ILE A 314
LEU A 313
 MLY  A 264 ( 3.8A)
None
None
None
None
 1.26A 5vkqA-4ys4A:
undetectable
5vkqB-4ys4A:
undetectable		 5vkqA-4ys4A:
11.28
5vkqB-4ys4A:
11.28
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.
5VKQ_D_PCFD1801_0
(NO MECHANORECEPTOR
POTENTIAL C ISOFORM
L)		 4ys4 MEROZOITE SURFACE
PROTEIN P41
(Plasmodium
falciparum) 		5 / 10 HIS A 257
ILE A 272
ILE A 334
ILE A 314
LEU A 313
 MLY  A 264 ( 3.8A)
None
None
None
None
 1.28A 5vkqC-4ys4A:
undetectable
5vkqD-4ys4A:
undetectable		 5vkqC-4ys4A:
11.28
5vkqD-4ys4A:
11.28
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.
5VKQ_D_PCFD1803_0
(NO MECHANORECEPTOR
POTENTIAL C ISOFORM
L)		 5z5c CYSTEINE SYNTHASE
(Fusobacterium
nucleatum) 		4 / 7 THR A 215
HIS A 225
PRO A 210
ILE A 227
 MLY  A 221 ( 3.1A)
MLY  A 224 ( 4.8A)
None
None
 1.20A 5vkqC-5z5cA:
undetectable
5vkqD-5z5cA:
undetectable		 5vkqC-5z5cA:
undetectable
5vkqD-5z5cA:
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.
5VOO_D_C2FD3001_0
(5-METHYLTETRAHYDROFO
LATE HOMOCYSTEINE
S-METHYLTRANSFERASE)		 4nk6 POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE
(Pseudomonas
syringae
group
genomosp.
3) 		5 / 12 ASN A 306
GLY A 305
MET A 246
VAL A 231
ILE A 241
 MLY  A 304 ( 3.4A)
MLY  A 304 ( 2.4A)
None
None
None
 1.11A 5vooD-4nk6A:
undetectable		 5vooD-4nk6A:
20.84
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.
5VOP_A_C2FA3001_1
(5-METHYLTETRAHYDROFO
LATE HOMOCYSTEINE
S-METHYLTRANSFERASE)		 3kv0 HET-C2
(Podospora
anserina) 		3 / 3 ASP A  90
ASN A  87
ASP A  29
 None
None
MLY  A  32 ( 3.8A)
 0.67A 5vopA-3kv0A:
undetectable		 5vopA-3kv0A:
23.59
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.
5VOP_B_C2FB3001_1
(5-METHYLTETRAHYDROFO
LATE HOMOCYSTEINE
S-METHYLTRANSFERASE)		 3kv0 HET-C2
(Podospora
anserina) 		3 / 3 ASP A  90
ASN A  87
ASP A  29
 None
None
MLY  A  32 ( 3.8A)
 0.70A 5vopB-3kv0A:
undetectable		 5vopB-3kv0A:
23.59
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.
5VW5_A_NCAA403_0
(FERREDOXIN--NADP
REDUCTASE)		 2q7x UPF0052 PROTEIN
SP_1565
(Streptococcus
pneumoniae) 		4 / 8 GLY A 208
LEU A 211
GLU A 206
ALA A 210
 MLY  A 205 ( 3.6A)
None
None
None
 0.75A 5vw5A-2q7xA:
undetectable		 5vw5A-2q7xA:
20.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VYH_A_FOLA409_0
(S PROTEIN)		 5jh8 PROBABLE CHITINASE
(Chromobacterium
violaceum) 		5 / 10 TRP A 270
HIS A 267
ALA A 179
GLY A 190
THR A 252
 None
MLY  A 222 ( 2.7A)
None
None
None
 1.37A 5vyhA-5jh8A:
undetectable		 5vyhA-5jh8A:
23.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5WAU_C_CHDC306_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 5czw MYROILYSIN
(Myroides
profundi) 		4 / 5 PHE A  84
PHE A  86
LEU A  58
PHE A  98
 None
MLY  A  70 ( 4.0A)
None
None
 1.21A 5wauC-5czwA:
undetectable
5wauJ-5czwA:
undetectable		 5wauC-5czwA:
21.15
5wauJ-5czwA:
18.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5WAU_C_CHDC306_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 5czw MYROILYSIN
(Myroides
profundi) 		4 / 5 PHE A 127
PHE A  98
LEU A  58
PHE A  86
 None
None
None
MLY  A  70 ( 4.0A)
 1.08A 5wauC-5czwA:
undetectable
5wauJ-5czwA:
undetectable		 5wauC-5czwA:
21.15
5wauJ-5czwA:
18.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5WAU_C_CHDC308_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 5czw MYROILYSIN
(Myroides
profundi) 		4 / 5 PHE A  84
PHE A  86
LEU A  58
PHE A  98
 None
MLY  A  70 ( 4.0A)
None
None
 1.23A 5wauc-5czwA:
undetectable
5wauj-5czwA:
undetectable		 5wauc-5czwA:
21.15
5wauj-5czwA:
18.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5WAU_C_CHDC308_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 5czw MYROILYSIN
(Myroides
profundi) 		4 / 5 PHE A 127
PHE A  98
LEU A  58
PHE A  86
 None
None
None
MLY  A  70 ( 4.0A)
 1.04A 5wauc-5czwA:
undetectable
5wauj-5czwA:
undetectable		 5wauc-5czwA:
21.15
5wauj-5czwA:
18.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5X23_A_LSNA502_2
(CYTOCHROME P450 2C9)		 4h3w HYPOTHETICAL PROTEIN
(Parabacteroides
distasonis) 		3 / 3 LEU A 332
VAL A  54
ASP A  53
 MLY  A 333 ( 3.7A)
None
None
 0.66A 5x23A-4h3wA:
undetectable		 5x23A-4h3wA:
22.15
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.
5X7P_A_ACRA1481_1
(GLYCOSIDE HYDROLASE
FAMILY 31
ALPHA-GLUCOSIDASE)		 1lln ANTIVIRAL PROTEIN 3
(Phytolacca
americana) 		4 / 6 SER A 116
ARG A 127
GLU A 121
TYR A 117
 MLY  A 115 ( 4.2A)
None
None
None
 1.40A 5x7pA-1llnA:
0.0		 5x7pA-1llnA:
11.89
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.
5X7P_B_ACRB1481_1
(GLYCOSIDE HYDROLASE
FAMILY 31
ALPHA-GLUCOSIDASE)		 1lln ANTIVIRAL PROTEIN 3
(Phytolacca
americana) 		4 / 6 SER A 116
ARG A 127
GLU A 121
TYR A 117
 MLY  A 115 ( 4.2A)
None
None
None
 1.39A 5x7pB-1llnA:
0.0		 5x7pB-1llnA:
11.89
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.
5X7Q_A_ACRA1481_1
(GLYCOSIDE HYDROLASE
FAMILY 31
ALPHA-GLUCOSIDASE)		 1lln ANTIVIRAL PROTEIN 3
(Phytolacca
americana) 		4 / 6 SER A 116
ARG A 127
GLU A 121
TYR A 117
 MLY  A 115 ( 4.2A)
None
None
None
 1.43A 5x7qA-1llnA:
0.0		 5x7qA-1llnA:
11.89
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.
5X7Q_B_ACRB1481_1
(GLYCOSIDE HYDROLASE
FAMILY 31
ALPHA-GLUCOSIDASE)		 1lln ANTIVIRAL PROTEIN 3
(Phytolacca
americana) 		4 / 6 SER A 116
ARG A 127
GLU A 121
TYR A 117
 MLY  A 115 ( 4.2A)
None
None
None
 1.43A 5x7qB-1llnA:
0.0		 5x7qB-1llnA:
11.89
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.
5X7R_A_ACRA1481_1
(GLYCOSIDE HYDROLASE
FAMILY 31
ALPHA-GLUCOSIDASE)		 1lln ANTIVIRAL PROTEIN 3
(Phytolacca
americana) 		4 / 6 SER A 116
ARG A 127
GLU A 121
TYR A 117
 MLY  A 115 ( 4.2A)
None
None
None
 1.46A 5x7rA-1llnA:
0.0		 5x7rA-1llnA:
11.89
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.
5X7R_B_ACRB1481_1
(GLYCOSIDE HYDROLASE
FAMILY 31
ALPHA-GLUCOSIDASE)		 1lln ANTIVIRAL PROTEIN 3
(Phytolacca
americana) 		4 / 6 SER A 116
ARG A 127
GLU A 121
TYR A 117
 MLY  A 115 ( 4.2A)
None
None
None
 1.43A 5x7rB-1llnA:
0.0		 5x7rB-1llnA:
11.89
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.
5X80_B_SALB203_1
(UNCHARACTERIZED
HTH-TYPE
TRANSCRIPTIONAL
REGULATOR RV2887)		 4h3w HYPOTHETICAL PROTEIN
(Parabacteroides
distasonis) 		4 / 6 GLY A  47
TYR A  48
LEU A 321
VAL A 261
 None
MLY  A 337 ( 4.5A)
None
None
 0.92A 5x80A-4h3wA:
undetectable
5x80B-4h3wA:
undetectable		 5x80A-4h3wA:
21.07
5x80B-4h3wA:
21.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XDH_C_DAHC60_1
(PUTATIVE CYTOCHROME
C)		 4a5p PROTEIN MXIA
(Shigella
flexneri) 		4 / 6 MET A 593
ASN A 642
VAL A 644
LEU A 646
 None
MLY  A 641 ( 4.2A)
MLY  A 590 ( 4.3A)
None
 1.21A 5xdhA-4a5pA:
undetectable
5xdhC-4a5pA:
undetectable		 5xdhA-4a5pA:
11.37
5xdhC-4a5pA:
11.37
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.
5XDQ_C_CHDC308_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 5czw MYROILYSIN
(Myroides
profundi) 		4 / 5 PHE A  84
PHE A  86
LEU A  58
PHE A  98
 None
MLY  A  70 ( 4.0A)
None
None
 1.18A 5xdqC-5czwA:
undetectable
5xdqJ-5czwA:
undetectable		 5xdqC-5czwA:
21.15
5xdqJ-5czwA:
18.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XDQ_C_CHDC308_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 5czw MYROILYSIN
(Myroides
profundi) 		4 / 5 PHE A 127
PHE A  98
LEU A  58
PHE A  86
 None
None
None
MLY  A  70 ( 4.0A)
 0.98A 5xdqC-5czwA:
undetectable
5xdqJ-5czwA:
undetectable		 5xdqC-5czwA:
21.15
5xdqJ-5czwA:
18.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XDQ_P_CHDP306_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 5czw MYROILYSIN
(Myroides
profundi) 		4 / 5 PHE A  84
PHE A  86
LEU A  58
PHE A  98
 None
MLY  A  70 ( 4.0A)
None
None
 1.21A 5xdqP-5czwA:
undetectable
5xdqW-5czwA:
undetectable		 5xdqP-5czwA:
21.15
5xdqW-5czwA:
18.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XDQ_P_CHDP306_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 5czw MYROILYSIN
(Myroides
profundi) 		4 / 5 PHE A 127
PHE A  98
LEU A  58
PHE A  86
 None
None
None
MLY  A  70 ( 4.0A)
 1.01A 5xdqP-5czwA:
undetectable
5xdqW-5czwA:
undetectable		 5xdqP-5czwA:
21.15
5xdqW-5czwA:
18.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XIQ_A_HFGA1002_0
(PROLYL-TRNA
SYNTHETASE (PRORS))		 5czw MYROILYSIN
(Myroides
profundi) 		5 / 12 LEU A   7
PHE A  86
PRO A  92
SER A 106
GLY A 109
 None
MLY  A  70 ( 4.0A)
None
None
None
 1.01A 5xiqA-5czwA:
undetectable		 5xiqA-5czwA:
18.02
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.
5XXI_A_LSNA503_1
(CYTOCHROME P450 2C9)		 4hp4 EAG-LIKE K[+]
CHANNEL
(Drosophila
melanogaster) 		5 / 12 PHE A  48
ASN A  28
PRO A 105
LEU A  69
PHE A 106
 None
None
None
None
MLY  A 100 ( 4.5A)
 1.17A 5xxiA-4hp4A:
undetectable		 5xxiA-4hp4A:
12.21
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.
5Y7P_C_CHDC401_0
(BILE SALT HYDROLASE)		 2qjv UNCHARACTERIZED
IOLB-LIKE PROTEIN
(Salmonella
enterica) 		4 / 8 LEU A 104
ILE A  71
ALA A  94
LEU A  88
 None
None
MLY  A  95 ( 3.3A)
None
 0.81A 5y7pC-2qjvA:
undetectable		 5y7pC-2qjvA:
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.
5Y9Y_A_ACTA409_0
(UNCHARACTERIZED
PROTEIN KDOO)		 5z5c CYSTEINE SYNTHASE
(Fusobacterium
nucleatum) 		3 / 3 LYS A 205
PRO A 207
LYS A 241
 MLY  A 204 ( 3.3A)
None
MLY  A 240 ( 3.0A)
 1.31A 5y9yA-5z5cA:
undetectable		 5y9yA-5z5cA:
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.
5YBB_A_SAMA601_0
(TYPE I
RESTRICTION-MODIFICA
TION SYSTEM
METHYLTRANSFERASE
SUBUNIT)		 5z5c CYSTEINE SYNTHASE
(Fusobacterium
nucleatum) 		5 / 12 THR A 188
GLY A 186
THR A  53
LEU A  54
PHE A  81
 PLP  A 401 (-3.6A)
PLP  A 401 (-3.5A)
None
MLY  A  55 ( 4.2A)
None
 1.06A 5ybbA-5z5cA:
undetectable		 5ybbA-5z5cA:
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.
5Z0F_B_DAHB98_0
(MELC
TYROSINASE)		 1vk1 CONSERVED
HYPOTHETICAL PROTEIN
(Pyrococcus
furiosus) 		5 / 11 HIS A  29
ILE A  67
HIS A  71
HIS A 225
PRO A  53
 None
MLY  A  27 ( 3.8A)
PO4  A 301 (-3.9A)
None
None
 1.48A 5z0fA-1vk1A:
undetectable
5z0fB-1vk1A:
undetectable		 5z0fA-1vk1A:
14.46
5z0fB-1vk1A:
16.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5Z0G_B_DAHB98_0
(MELC
TYROSINASE)		 1vk1 CONSERVED
HYPOTHETICAL PROTEIN
(Pyrococcus
furiosus) 		5 / 11 HIS A  29
ILE A  67
HIS A  71
HIS A 225
PRO A  53
 None
MLY  A  27 ( 3.8A)
PO4  A 301 (-3.9A)
None
None
 1.48A 5z0gA-1vk1A:
undetectable
5z0gB-1vk1A:
undetectable		 5z0gA-1vk1A:
14.46
5z0gB-1vk1A:
16.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5Z0I_B_DAHB98_0
(MELC
TYROSINASE)		 1vk1 CONSERVED
HYPOTHETICAL PROTEIN
(Pyrococcus
furiosus) 		5 / 11 HIS A  29
ILE A  67
HIS A  71
HIS A 225
PRO A  53
 None
MLY  A  27 ( 3.8A)
PO4  A 301 (-3.9A)
None
None
 1.49A 5z0iA-1vk1A:
undetectable
5z0iB-1vk1A:
undetectable		 5z0iA-1vk1A:
14.46
5z0iB-1vk1A:
16.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5Z6J_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 2f4i HYPOTHETICAL PROTEIN
TM0957
(Thermotoga
maritima) 		5 / 12 ALA A 137
ILE A 204
LEU A 123
ILE A  96
THR A 138
 None
MLY  A 201 ( 4.6A)
None
None
None
 0.97A 5z6jA-2f4iA:
undetectable		 5z6jA-2f4iA:
19.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5Z6K_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 2f4i HYPOTHETICAL PROTEIN
TM0957
(Thermotoga
maritima) 		5 / 12 ALA A 137
ILE A 204
LEU A 123
ILE A  96
THR A 138
 None
MLY  A 201 ( 4.6A)
None
None
None
 0.98A 5z6kA-2f4iA:
undetectable		 5z6kA-2f4iA:
19.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5Z84_P_CHDP305_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 5czw MYROILYSIN
(Myroides
profundi) 		4 / 6 PHE A 127
PHE A  98
LEU A  58
PHE A  86
 None
None
None
MLY  A  70 ( 4.0A)
 1.01A 5z84P-5czwA:
undetectable
5z84W-5czwA:
undetectable		 5z84P-5czwA:
21.15
5z84W-5czwA:
18.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5Z85_P_CHDP307_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 5czw MYROILYSIN
(Myroides
profundi) 		4 / 6 PHE A 127
PHE A  98
LEU A  58
PHE A  86
 None
None
None
MLY  A  70 ( 4.0A)
 1.08A 5z85P-5czwA:
undetectable
5z85W-5czwA:
undetectable		 5z85P-5czwA:
21.15
5z85W-5czwA:
18.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5Z86_C_CHDC306_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 5czw MYROILYSIN
(Myroides
profundi) 		4 / 6 PHE A 127
PHE A  98
LEU A  58
PHE A  86
 None
None
None
MLY  A  70 ( 4.0A)
 1.01A 5z86C-5czwA:
undetectable
5z86J-5czwA:
undetectable		 5z86C-5czwA:
21.15
5z86J-5czwA:
18.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5Z86_P_CHDP307_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 5czw MYROILYSIN
(Myroides
profundi) 		4 / 6 PHE A 127
PHE A  98
LEU A  58
PHE A  86
 None
None
None
MLY  A  70 ( 4.0A)
 0.99A 5z86P-5czwA:
undetectable
5z86W-5czwA:
undetectable		 5z86P-5czwA:
21.15
5z86W-5czwA:
18.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ZCO_P_CHDP305_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 5czw MYROILYSIN
(Myroides
profundi) 		4 / 6 PHE A 127
PHE A  98
LEU A  58
PHE A  86
 None
None
None
MLY  A  70 ( 4.0A)
 0.99A 5zcoP-5czwA:
undetectable
5zcoW-5czwA:
undetectable		 5zcoP-5czwA:
21.15
5zcoW-5czwA:
18.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ZCP_C_CHDC306_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 5czw MYROILYSIN
(Myroides
profundi) 		4 / 6 PHE A 127
PHE A  98
LEU A  58
PHE A  86
 None
None
None
MLY  A  70 ( 4.0A)
 1.00A 5zcpC-5czwA:
undetectable
5zcpJ-5czwA:
undetectable		 5zcpC-5czwA:
21.15
5zcpJ-5czwA:
18.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ZJI_A_PQNA844_1
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A1
PHOTOSYSTEM I
REACTION CENTER
SUBUNIT IX)		 3e3x BIPA
(Vibrio
parahaemolyticus) 		5 / 10 MET A  33
PHE A  35
SER A 107
ILE A 309
LEU A 104
 None
None
MLY  A 314 ( 4.8A)
None
None
 1.20A 5zjiA-3e3xA:
undetectable
5zjiJ-3e3xA:
undetectable		 5zjiA-3e3xA:
14.20
5zjiJ-3e3xA:
10.25
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.
6A4I_A_TRPA403_0
(TRYPTOPHAN
2,3-DIOXYGENASE)		 5thm ESTERASE-6
(Drosophila
melanogaster) 		4 / 8 ARG A 162
ARG A 200
ILE A 223
PRO A 281
 MLY  A 166 ( 4.0A)
None
None
None
 0.90A 6a4iA-5thmA:
undetectable		 6a4iA-5thmA:
22.86
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.
6A7P_A_9SCA601_0
(SERUM ALBUMIN)		 5liy ALDO-KETO REDUCTASE
FAMILY 1 MEMBER B10
(Homo
sapiens) 		5 / 12 ILE X 205
LEU X  73
GLY X 158
LEU X   7
PHE X   4
 MLY  X 203 ( 4.7A)
None
None
None
None
 1.22A 6a7pA-5liyX:
undetectable		 6a7pA-5liyX:
22.43
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.
6BEC_C_RBTC601_1
(SCAFFOLD PROTEIN D13)		 4nge PRESEQUENCE
PROTEASE,
MITOCHONDRIAL
(Homo
sapiens) 		5 / 12 VAL D  90
PHE D  92
GLN D 289
PRO D 170
PHE D 169
 None
None
MLY  D 290 ( 4.8A)
None
MLY  D 287 ( 4.5A)
 1.38A 6becA-4ngeD:
undetectable
6becB-4ngeD:
undetectable
6becC-4ngeD:
undetectable		 6becA-4ngeD:
20.75
6becB-4ngeD:
20.75
6becC-4ngeD:
20.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6BEE_B_RXMB601_0
(SCAFFOLD PROTEIN D13)		 5czw MYROILYSIN
(Myroides
profundi) 		5 / 9 GLU A 143
PHE A 144
PHE A 124
VAL A  13
VAL A  69
 ZN  A 301 ( 4.2A)
None
None
None
MLY  A  70 ( 3.0A)
 1.40A 6beeA-5czwA:
0.0
6beeB-5czwA:
0.0
6beeC-5czwA:
0.0		 6beeA-5czwA:
19.35
6beeB-5czwA:
19.35
6beeC-5czwA:
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.
6BXM_A_SAMA402_0
(DIPHTHAMIDE
BIOSYNTHESIS ENZYME
DPH2)		 3gs9 PROTEIN GP18
(Listeria
monocytogenes) 		5 / 12 LEU A  82
SER A  59
VAL A  70
ILE A  86
ASP A  85
 None
None
None
None
MLY  A  41 ( 3.9A)
 1.23A 6bxmA-3gs9A:
undetectable		 6bxmA-3gs9A:
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.
6BXN_A_SAMA901_0
(DIPHTHAMIDE
BIOSYNTHESIS ENZYME
DPH2)		 3gs9 PROTEIN GP18
(Listeria
monocytogenes) 		5 / 12 LEU A  82
SER A  59
VAL A  70
ILE A  86
ASP A  85
 None
None
None
None
MLY  A  41 ( 3.9A)
 1.28A 6bxnA-3gs9A:
undetectable		 6bxnA-3gs9A:
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.
6BXN_B_SAMB901_0
(DIPHTHAMIDE
BIOSYNTHESIS ENZYME
DPH2)		 4hp4 EAG-LIKE K[+]
CHANNEL
(Drosophila
melanogaster) 		5 / 12 LEU A  51
GLY A  47
LYS A  63
VAL A  42
CYH A  44
 None
None
MLY  A  62 ( 3.3A)
None
None
 1.43A 6bxnB-4hp4A:
undetectable		 6bxnB-4hp4A:
19.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6DEB_B_MTXB303_1
(BIFUNCTIONAL PROTEIN
FOLD)		 4f6e SUPEROXIDE DISMUTASE
[MN], MITOCHONDRIAL
(Saccharomyces
cerevisiae) 		4 / 5 TYR A 178
GLN A 179
GLY A  12
ILE A  18
 None
MLY  A 181 ( 3.9A)
None
None
 1.15A 6debB-4f6eA:
undetectable		 6debB-4f6eA:
17.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6DJZ_A_GMJA301_0
(SIGMA NON-OPIOID
INTRACELLULAR
RECEPTOR 1)		 5chx XRCC4-MYH7-1590-1657
(Homo
sapiens) 		5 / 12 LEU A  28
ILE A  34
LEU A 108
ALA A  73
TYR A  66
 None
None
MLY  A  99 ( 4.5A)
MLY  A  72 ( 3.6A)
None
 1.07A 6djzA-5chxA:
undetectable		 6djzA-5chxA:
21.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6DJZ_A_GMJA301_0
(SIGMA NON-OPIOID
INTRACELLULAR
RECEPTOR 1)		 5cj4 XRCC4-MYH7-(1562-162
2) CHIMERA PROTEIN
(Homo
sapiens) 		5 / 12 LEU A  28
ILE A  34
LEU A 108
ALA A  73
TYR A  66
 None
None
MLY  A  99 ( 4.8A)
MLY  A  72 ( 3.6A)
None
 1.12A 6djzA-5cj4A:
undetectable		 6djzA-5cj4A:
22.13
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.
6DJZ_B_GMJB301_1
(SIGMA NON-OPIOID
INTRACELLULAR
RECEPTOR 1)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		4 / 6 TYR A 114
GLN A 190
GLU A  58
ALA A  98
 None
NAD  A 327 (-3.6A)
MLY  A 105 ( 4.3A)
None
 1.22A 6djzB-3ln3A:
undetectable		 6djzB-3ln3A:
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.
6DWD_B_GLYB709_0
(DEOXYNUCLEOSIDE
TRIPHOSPHATE
TRIPHOSPHOHYDROLASE
SAMHD1)		 1lln ANTIVIRAL PROTEIN 3
(Phytolacca
americana) 		4 / 5 GLY A  66
ASN A  67
ARG A  65
ARG A  64
 None
None
None
MLY  A  46 ( 3.7A)
 1.16A 6dwdB-1llnA:
0.0
6dwdD-1llnA:
0.0		 6dwdB-1llnA:
18.63
6dwdD-1llnA:
18.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6DWJ_B_GLYB710_0
(DEOXYNUCLEOSIDE
TRIPHOSPHATE
TRIPHOSPHOHYDROLASE
SAMHD1)		 1lln ANTIVIRAL PROTEIN 3
(Phytolacca
americana) 		4 / 5 ARG A  65
ARG A  64
GLY A  66
ASN A  67
 None
MLY  A  46 ( 3.7A)
None
None
 1.19A 6dwjB-1llnA:
0.0
6dwjD-1llnA:
0.0		 6dwjB-1llnA:
18.63
6dwjD-1llnA:
18.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6DWN_B_AQ4B602_1
(CYTOCHROME P450 1A1)		 2f4i HYPOTHETICAL PROTEIN
TM0957
(Thermotoga
maritima) 		4 / 7 PHE A 146
GLY A 139
VAL A 163
LEU A 159
 MLY  A 142 ( 4.3A)
None
MLY  A 164 ( 3.1A)
None
 0.79A 6dwnB-2f4iA:
undetectable		 6dwnB-2f4iA:
17.26
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.
6E43_A_BEZA502_0
(INDOLEAMINE
2,3-DIOXYGENASE 1)		 2p6v TRANSCRIPTION
INITIATION FACTOR
TFIID SUBUNIT 4
(Homo
sapiens) 		4 / 6 VAL A 623
LEU A 660
LEU A 663
ARG A 664
 MLY  A 620 ( 4.1A)
None
MLY  A 596 ( 4.4A)
None
 1.00A 6e43A-2p6vA:
undetectable		 6e43A-2p6vA:
14.58
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.
6EKU_A_ZMRA901_2
(SIALIDASE)		 5liy ALDO-KETO REDUCTASE
FAMILY 1 MEMBER B10
(Homo
sapiens) 		4 / 6 ASP X  99
GLN X  50
LEU X 122
PHE X  83
 MLY  X  95 ( 2.7A)
None
None
None
 1.26A 6ekuA-5liyX:
undetectable		 6ekuA-5liyX:
18.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6F3N_A_ADNA505_1
(-)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 12 ASP A  48
LEU A 259
GLY A 249
MET A 186
PHE A 176
 None
MLY  A 263 ( 4.6A)
MLY  A 248 ( 2.4A)
None
MLY  A 181 ( 4.5A)
 1.23A 6f3nA-2ftzA:
undetectable		 6f3nA-2ftzA:
19.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6F3N_C_ADNC505_1
(-)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 12 ASP A  48
LEU A 259
GLY A 249
MET A 186
PHE A 176
 None
MLY  A 263 ( 4.6A)
MLY  A 248 ( 2.4A)
None
MLY  A 181 ( 4.5A)
 1.31A 6f3nC-2ftzA:
undetectable		 6f3nC-2ftzA:
19.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6F3N_D_ADND506_1
(-)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		5 / 12 ASP A  48
LEU A 259
GLY A 249
MET A 186
PHE A 176
 None
MLY  A 263 ( 4.6A)
MLY  A 248 ( 2.4A)
None
MLY  A 181 ( 4.5A)
 1.23A 6f3nD-2ftzA:
undetectable		 6f3nD-2ftzA:
19.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6F7L_B_ACTB503_0
(AMINE OXIDASE LKCE)		 2vd9 ALANINE RACEMASE
(Bacillus
anthracis) 		3 / 3 VAL A 309
GLU A 301
ILE A 322
 MLY  A 307 ( 4.1A)
None
None
 0.51A 6f7lB-2vd9A:
undetectable		 6f7lB-2vd9A:
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.
6FBV_D_FI8D1904_0
(DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA
DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA')		 3gs9 PROTEIN GP18
(Listeria
monocytogenes) 		4 / 8 ILE A  17
VAL A  69
LYS A  71
GLU A  67
 None
None
None
MLY  A  12 ( 3.6A)
 1.14A 6fbvC-3gs9A:
undetectable		 6fbvC-3gs9A:
15.45
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.
6FGD_A_D8ZA831_0
(GEPHYRIN)		 2etv IRON(III) ABC
TRANSPORTER,
PERIPLASMIC
IRON-BINDING
PROTEIN, PUTATIVE
(Thermotoga
maritima) 		5 / 11 ASP A 298
PHE A 301
ILE A 302
ILE A 353
TYR A 333
 None
None
None
MLY  A 345 ( 4.1A)
None
 1.09A 6fgdA-2etvA:
2.2		 6fgdA-2etvA:
15.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6FHW_A_ACRA801_2
(GLUCOAMYLASE P)		 4fkm SIMILAR TO FERRIC
HYDROXAMATE RECEPTOR
1
(Staphylococcus
aureus) 		3 / 3 TRP A 155
GLU A 160
GLU A 140
 MLY  A 156 ( 4.2A)
MLY  A 156 ( 3.8A)
MLY  A 156 ( 3.5A)
 0.93A 6fhwA-4fkmA:
undetectable		 6fhwA-4fkmA:
15.00
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.
6G31_D_ZOLD401_0
(GERANYLGERANYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		4 / 7 LEU A  71
ASP A  74
ARG A  85
GLN A 198
 None
UNL  A 273 (-3.0A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.8A)
 1.01A 6g31D-2ftzA:
23.3		 6g31D-2ftzA:
12.37
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.
6G31_D_ZOLD401_0
(GERANYLGERANYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		4 / 7 LEU A  71
ASP A  80
ARG A  85
GLN A 198
 None
MLY  A 223 ( 3.6A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.8A)
 0.64A 6g31D-2ftzA:
23.3		 6g31D-2ftzA:
12.37
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.
6G31_J_ZOLJ401_0
(GERANYLGERANYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		4 / 6 LEU A  71
ASP A  74
ARG A  85
GLN A 198
 None
UNL  A 273 (-3.0A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.8A)
 1.17A 6g31J-2ftzA:
24.2		 6g31J-2ftzA:
12.37
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.
6G31_J_ZOLJ401_0
(GERANYLGERANYL
PYROPHOSPHATE
SYNTHASE)		 2ftz GERANYLTRANSTRANSFER
ASE
(Thermotoga
maritima) 		4 / 6 LEU A  71
ASP A  80
ARG A  85
GLN A 198
 None
MLY  A 223 ( 3.6A)
UNL  A 274 (-4.1A)
MLY  A 163 ( 3.8A)
 0.92A 6g31J-2ftzA:
24.2		 6g31J-2ftzA:
12.37
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.
6GBF_A_ACTA507_0
(MOLYBDOPTERIN
BIOSYNTHESIS PROTEIN
CNX1)		 3mc3 DSRE/DSRF-LIKE
FAMILY PROTEIN
(Sulfolobus
solfataricus) 		3 / 3 LYS A  85
SER A  43
SER A  39
 MLY  A  84 ( 2.9A)
None
None
 0.79A 6gbfA-3mc3A:
undetectable		 6gbfA-3mc3A:
14.19
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.
6HD6_B_STIB601_1
(TYROSINE-PROTEIN
KINASE ABL1)		 2qjv UNCHARACTERIZED
IOLB-LIKE PROTEIN
(Salmonella
enterica) 		4 / 7 VAL A 223
ILE A  18
GLY A 111
ALA A 245
 MLY  A 222 ( 3.1A)
MLY  A 222 ( 4.9A)
None
None
 0.80A 6hd6B-2qjvA:
undetectable		 6hd6B-2qjvA:
18.47
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.
6HQB_A_PQNA2001_0
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A1
PHOTOSYSTEM I
REACTION CENTER
SUBUNIT IX)		 4jdu AEROTOLERANCE-RELATE
D MEMBRANE PROTEIN
(Bacteroides
fragilis) 		5 / 10 SER A 216
GLY A 217
ALA A 192
GLY A 266
LEU A 112
 None
None
None
None
MLY  A 116 ( 4.5A)
 1.39A 6hqbA-4jduA:
undetectable
6hqbJ-4jduA:
undetectable		 6hqbA-4jduA:
18.14
6hqbJ-4jduA:
10.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6JNH_A_ASCA202_0
(PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE)		 3so5 LEUCINE-RICH REPEATS
AND
IMMUNOGLOBULIN-LIKE
DOMAINS PROTEIN 3
(Mus
musculus) 		3 / 3 ASN A 585
PRO A 499
GLN A 500
 MLY  A 498 ( 3.9A)
MLY  A 498 ( 2.6A)
MLY  A 498 ( 4.0A)
 0.90A 6jnhA-3so5A:
undetectable		 6jnhA-3so5A:
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.
6JOG_A_ASCA202_0
(PHOSPHOPANTETHEINE
ADENYLYLTRANSFERASE)		 3so5 LEUCINE-RICH REPEATS
AND
IMMUNOGLOBULIN-LIKE
DOMAINS PROTEIN 3
(Mus
musculus) 		3 / 3 ASN A 585
PRO A 499
GLN A 500
 MLY  A 498 ( 3.9A)
MLY  A 498 ( 2.6A)
MLY  A 498 ( 4.0A)
 0.91A 6jogA-3so5A:
undetectable		 6jogA-3so5A:
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.
6MKE_D_FK5D201_1
(PEPTIDYLPROLYL
ISOMERASE)		 3lti DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA
(Escherichia
coli) 		5 / 10 TYR A 291
PHE A 230
ILE A 285
ILE A 269
PHE A 253
 MLY  A 295 ( 4.5A)
None
None
None
None
 1.46A 6mkeD-3ltiA:
undetectable		 6mkeD-3ltiA:
13.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6MN4_B_AM2B301_0
(AMINOGLYCOSIDE
N(3)-ACETYLTRANSFERA
SE, AAC(3)-IVA)		 1iv8 MALTOOLIGOSYL
TREHALOSE SYNTHASE
(Sulfolobus
acidocaldarius) 		4 / 8 HIS A 510
GLU A 517
ASP A 394
GLU A 393
 None
MLY  A 390 ( 3.7A)
MLY  A 390 ( 3.8A)
None
 1.14A 6mn4B-1iv8A:
0.0		 6mn4B-1iv8A:
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.
6MN4_C_AM2C301_0
(AMINOGLYCOSIDE
N(3)-ACETYLTRANSFERA
SE, AAC(3)-IVA)		 1iv8 MALTOOLIGOSYL
TREHALOSE SYNTHASE
(Sulfolobus
acidocaldarius) 		4 / 8 ASP A 596
GLU A 517
ASP A 394
GLU A 393
 MLZ  A 513 ( 4.9A)
MLY  A 390 ( 3.7A)
MLY  A 390 ( 3.8A)
None
 1.17A 6mn4C-1iv8A:
undetectable		 6mn4C-1iv8A:
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.
6MN4_C_AM2C301_0
(AMINOGLYCOSIDE
N(3)-ACETYLTRANSFERA
SE, AAC(3)-IVA)		 1iv8 MALTOOLIGOSYL
TREHALOSE SYNTHASE
(Sulfolobus
acidocaldarius) 		4 / 8 HIS A 510
GLU A 517
ASP A 394
GLU A 393
 None
MLY  A 390 ( 3.7A)
MLY  A 390 ( 3.8A)
None
 1.24A 6mn4C-1iv8A:
undetectable		 6mn4C-1iv8A:
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.
6MN4_D_AM2D301_0
(AMINOGLYCOSIDE
N(3)-ACETYLTRANSFERA
SE, AAC(3)-IVA)		 1iv8 MALTOOLIGOSYL
TREHALOSE SYNTHASE
(Sulfolobus
acidocaldarius) 		4 / 8 HIS A 510
GLU A 517
ASP A 394
GLU A 393
 None
MLY  A 390 ( 3.7A)
MLY  A 390 ( 3.8A)
None
 1.19A 6mn4D-1iv8A:
0.0		 6mn4D-1iv8A:
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.
6MN4_F_AM2F301_0
(AMINOGLYCOSIDE
N(3)-ACETYLTRANSFERA
SE, AAC(3)-IVA)		 4nk6 POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE
(Pseudomonas
syringae
group
genomosp.
3) 		4 / 7 HIS A 339
ARG A 369
ASP A 368
GLU A 393
 MLY  A 338 ( 4.2A)
None
None
None
 1.36A 6mn4F-4nk6A:
undetectable		 6mn4F-4nk6A:
20.37
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.
6NQA_K_SAMK500_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE,
H3 LYSINE-79
SPECIFIC)		 2qhq UNKNOWN FUNCTION
PROTEIN VPA0580
(Vibrio
parahaemolyticus) 		5 / 10 THR A  50
GLY A 108
GLY A 111
GLU A 110
ASN A 103
 None
MLY  A  74 ( 3.4A)
None
None
None
 1.00A 6nqaK-2qhqA:
undetectable		 6nqaK-2qhqA:
13.41
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.
6R2E_A_FFOA403_0
(THYMIDYLATE SYNTHASE)		 3rwx HYPOTHETICAL
BACTERIAL OUTER
MEMBRANE PROTEIN
(Bacteroides
fragilis) 		5 / 12 PHE A  95
ILE A  72
ASP A  69
GLY A  70
ASN A  31
 None
None
None
GOL  A 291 ( 4.5A)
MLY  A  32 (-3.9A)
 1.23A 6r2eA-3rwxA:
undetectable		 6r2eA-3rwxA:
21.64
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.
6R2E_B_FFOB403_0
(THYMIDYLATE SYNTHASE)		 3rwx HYPOTHETICAL
BACTERIAL OUTER
MEMBRANE PROTEIN
(Bacteroides
fragilis) 		5 / 10 PHE A  95
ILE A  72
ASP A  69
GLY A  70
ASN A  31
 None
None
None
GOL  A 291 ( 4.5A)
MLY  A  32 (-3.9A)
 1.22A 6r2eB-3rwxA:
undetectable		 6r2eB-3rwxA:
21.64
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.
6R2E_C_FFOC404_0
(THYMIDYLATE SYNTHASE)		 3rwx HYPOTHETICAL
BACTERIAL OUTER
MEMBRANE PROTEIN
(Bacteroides
fragilis) 		5 / 10 PHE A  95
ILE A  72
ASP A  69
GLY A  70
ASN A  31
 None
None
None
GOL  A 291 ( 4.5A)
MLY  A  32 (-3.9A)
 1.20A 6r2eC-3rwxA:
undetectable		 6r2eC-3rwxA:
21.64
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.
6R2E_D_FFOD403_0
(THYMIDYLATE SYNTHASE)		 3rwx HYPOTHETICAL
BACTERIAL OUTER
MEMBRANE PROTEIN
(Bacteroides
fragilis) 		5 / 10 PHE A  95
ILE A  72
ASP A  69
GLY A  70
ASN A  31
 None
None
None
GOL  A 291 ( 4.5A)
MLY  A  32 (-3.9A)
 1.20A 6r2eD-3rwxA:
undetectable		 6r2eD-3rwxA:
21.64
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.
6R2E_F_FFOF403_0
(THYMIDYLATE SYNTHASE)		 3rwx HYPOTHETICAL
BACTERIAL OUTER
MEMBRANE PROTEIN
(Bacteroides
fragilis) 		5 / 11 PHE A  95
ILE A  72
ASP A  69
GLY A  70
ASN A  31
 None
None
None
GOL  A 291 ( 4.5A)
MLY  A  32 (-3.9A)
 1.22A 6r2eF-3rwxA:
undetectable		 6r2eF-3rwxA:
21.64
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.
6R2E_G_FFOG403_0
(THYMIDYLATE SYNTHASE)		 3rwx HYPOTHETICAL
BACTERIAL OUTER
MEMBRANE PROTEIN
(Bacteroides
fragilis) 		5 / 11 PHE A  95
ILE A  72
ASP A  69
GLY A  70
ASN A  31
 None
None
None
GOL  A 291 ( 4.5A)
MLY  A  32 (-3.9A)
 1.23A 6r2eG-3rwxA:
undetectable		 6r2eG-3rwxA:
21.64
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.
6R2E_H_FFOH403_0
(THYMIDYLATE SYNTHASE)		 3rwx HYPOTHETICAL
BACTERIAL OUTER
MEMBRANE PROTEIN
(Bacteroides
fragilis) 		5 / 12 PHE A  95
ILE A  72
ASP A  69
GLY A  70
ASN A  31
 None
None
None
GOL  A 291 ( 4.5A)
MLY  A  32 (-3.9A)
 1.22A 6r2eH-3rwxA:
undetectable		 6r2eH-3rwxA:
21.64
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.
7DFR_A_FOLA161_0
(DIHYDROFOLATE
REDUCTASE)		 2f4i HYPOTHETICAL PROTEIN
TM0957
(Thermotoga
maritima) 		5 / 12 ALA A 137
ILE A 204
LEU A 123
ILE A  96
THR A 138
 None
MLY  A 201 ( 4.6A)
None
None
None
 1.07A 7dfrA-2f4iA:
undetectable		 7dfrA-2f4iA:
19.29