SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'MRD'


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.
1C4D_D_DVAD8_0
(GRAMICIDIN A)		 1g1s P-SELECTIN
(Homo
sapiens) 		3 / 3 TRP A  50
VAL A  27
TRP A  12
 None
MRD  A 807 ( 4.7A)
None
 1.26A 1c4dC-1g1sA:
undetectable
1c4dD-1g1sA:
undetectable		 1c4dC-1g1sA:
9.00
1c4dD-1g1sA:
9.00
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.
1C9S_E_TRPE81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		5 / 9 THR A  81
SER A 124
HIS A 117
ALA A 122
ILE A 129
 MRD  A 301 ( 4.2A)
None
None
None
None
 1.49A 1c9sD-4nq1A:
undetectable
1c9sE-4nq1A:
undetectable		 1c9sD-4nq1A:
15.71
1c9sE-4nq1A:
15.71
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.
1DTL_A_BEPA206_1
(CARDIAC TROPONIN C)		 3trp CALSEQUESTRIN-1
(Oryctolagus
cuniculus) 		4 / 8 PRO A 334
GLU A 338
GLU A 344
ASP A 345
 None
None
MRD  A 354 (-4.2A)
None
 1.25A 1dtlA-3trpA:
undetectable		 1dtlA-3trpA:
19.49
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.
1E9Y_B_HAEB800_1
(UREASE SUBUNIT BETA)		 3gg7 UNCHARACTERIZED
METALLOPROTEIN
(Deinococcus
radiodurans) 		4 / 5 HIS A   5
HIS A  58
HIS A 122
ASP A 194
 MN  A 253 (-3.3A)
MRD  A 257 (-3.5A)
None
MN  A 253 (-2.7A)
 0.73A 1e9yB-3gg7A:
12.3		 1e9yB-3gg7A:
18.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1FDU_A_ESTA351_1
(17-BETA-HYDROXYSTERO
ID DEHYDROGENASE)		 1iy8 LEVODIONE REDUCTASE
(Leifsonia
aquatica) 		5 / 12 SER A 152
VAL A 153
GLY A 154
TYR A 165
GLY A 196
 NAD  A1268 (-2.5A)
None
None
MRD  A1269 ( 3.9A)
NAD  A1268 (-3.8A)
 0.51A 1fduA-1iy8A:
28.8		 1fduA-1iy8A:
28.74
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.
1FDU_A_ESTA351_1
(17-BETA-HYDROXYSTERO
ID DEHYDROGENASE)		 1iy8 LEVODIONE REDUCTASE
(Leifsonia
aquatica) 		5 / 12 VAL A 153
GLY A 154
GLY A 196
LEU A 210
SER A 206
 None
None
NAD  A1268 (-3.8A)
None
MRD  A1269 ( 3.7A)
 1.08A 1fduA-1iy8A:
28.8		 1fduA-1iy8A:
28.74
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.
1FDU_C_ESTC353_1
(17-BETA-HYDROXYSTERO
ID DEHYDROGENASE)		 1iy8 LEVODIONE REDUCTASE
(Leifsonia
aquatica) 		5 / 12 SER A 152
VAL A 153
GLY A 154
TYR A 165
GLY A 196
 NAD  A1268 (-2.5A)
None
None
MRD  A1269 ( 3.9A)
NAD  A1268 (-3.8A)
 0.49A 1fduC-1iy8A:
28.8		 1fduC-1iy8A:
28.74
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.
1FWE_C_HAEC989_1
(UREASE)		 3gg7 UNCHARACTERIZED
METALLOPROTEIN
(Deinococcus
radiodurans) 		5 / 6 HIS A   5
HIS A   7
HIS A  58
HIS A 122
ASP A 194
 MN  A 253 (-3.3A)
MN  A 253 (-3.3A)
MRD  A 257 (-3.5A)
None
MN  A 253 (-2.7A)
 0.74A 1fweC-3gg7A:
11.9		 1fweC-3gg7A:
17.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1GRM_A_DVAA6_0
(GRAMICIDIN A)		 5ez3 ACYL-COA
DEHYDROGENASE
(Brucella
melitensis) 		3 / 3 ALA A 149
VAL A 303
TRP A 433
 None
None
MRD  A 601 ( 3.2A)
 0.91A 1grmA-5ez3A:
undetectable		 1grmA-5ez3A:
2.53
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.
1GRM_B_DVAB6_0
(GRAMICIDIN A)		 5ez3 ACYL-COA
DEHYDROGENASE
(Brucella
melitensis) 		3 / 3 ALA A 149
VAL A 303
TRP A 433
 None
None
MRD  A 601 ( 3.2A)
 0.91A 1grmB-5ez3A:
undetectable		 1grmB-5ez3A:
2.53
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.
1GTF_A_TRPA81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN
(TRAP))		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		5 / 9 HIS A 117
ALA A 122
ILE A 129
THR A  81
SER A 124
 None
None
None
MRD  A 301 ( 4.2A)
None
 1.50A 1gtfA-4nq1A:
undetectable
1gtfK-4nq1A:
undetectable		 1gtfA-4nq1A:
15.71
1gtfK-4nq1A:
15.71
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.
1GTF_F_TRPF81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN
(TRAP))		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		5 / 9 THR A  81
SER A 124
HIS A 117
ALA A 122
ILE A 129
 MRD  A 301 ( 4.2A)
None
None
None
None
 1.50A 1gtfE-4nq1A:
undetectable
1gtfF-4nq1A:
undetectable		 1gtfE-4nq1A:
15.71
1gtfF-4nq1A:
15.71
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.
1GTF_J_TRPJ81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN
(TRAP))		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		5 / 9 THR A  81
SER A 124
HIS A 117
ALA A 122
ILE A 129
 MRD  A 301 ( 4.2A)
None
None
None
None
 1.49A 1gtfI-4nq1A:
undetectable
1gtfJ-4nq1A:
undetectable		 1gtfI-4nq1A:
15.71
1gtfJ-4nq1A:
15.71
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.
1HK1_A_T44A3003_1
(SERUM ALBUMIN)		 1lam LEUCINE
AMINOPEPTIDASE
(Bos
taurus) 		4 / 6 HIS A 233
ILE A 232
ALA A 194
VAL A 187
 MRD  A 503 (-4.0A)
None
None
None
 0.94A 1hk1A-1lamA:
undetectable		 1hk1A-1lamA:
22.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1HK1_A_T44A3003_1
(SERUM ALBUMIN)		 1lam LEUCINE
AMINOPEPTIDASE
(Bos
taurus) 		4 / 6 HIS A 233
ILE A 232
ALA A 283
VAL A 187
 MRD  A 503 (-4.0A)
None
None
None
 0.99A 1hk1A-1lamA:
undetectable		 1hk1A-1lamA:
22.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1I7Z_A_COCA301_1
(CHIMERA OF IG KAPPA
CHAIN: HUMAN
CONSTANT REGION AND
MOUSE VARIABLE
REGION)		 2wqh CTPR3Y3
(synthetic
construct) 		4 / 8 TYR A  99
LEU A  83
LEU A 106
GLU A  71
 None
None
None
MRD  A1109 (-4.6A)
 1.02A 1i7zA-2wqhA:
undetectable		 1i7zA-2wqhA:
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.
1IOL_A_ESTA400_1
(ESTROGENIC 17-BETA
HYDROXYSTEROID
DEHYDROGENASE)		 1iy8 LEVODIONE REDUCTASE
(Leifsonia
aquatica) 		5 / 11 SER A 152
VAL A 153
GLY A 154
TYR A 165
GLY A 196
 NAD  A1268 (-2.5A)
None
None
MRD  A1269 ( 3.9A)
NAD  A1268 (-3.8A)
 0.37A 1iolA-1iy8A:
27.9		 1iolA-1iy8A:
27.57
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.
1ITU_A_CILA451_1
(RENAL DIPEPTIDASE)		 3gg7 UNCHARACTERIZED
METALLOPROTEIN
(Deinococcus
radiodurans) 		5 / 12 GLU A  84
HIS A  58
HIS A 122
HIS A 146
ASP A 194
 MN  A 253 (-2.6A)
MRD  A 257 (-3.5A)
None
MN  A 253 (-4.3A)
MN  A 253 (-2.7A)
 1.11A 1ituA-3gg7A:
12.5		 1ituA-3gg7A:
23.22
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.
1ITU_B_CILB452_1
(RENAL DIPEPTIDASE)		 3gg7 UNCHARACTERIZED
METALLOPROTEIN
(Deinococcus
radiodurans) 		5 / 12 GLU A  84
HIS A  58
HIS A 122
HIS A 146
ASP A 194
 MN  A 253 (-2.6A)
MRD  A 257 (-3.5A)
None
MN  A 253 (-4.3A)
MN  A 253 (-2.7A)
 1.13A 1ituB-3gg7A:
12.3		 1ituB-3gg7A:
23.22
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.
1K2R_A_H4BA1760_1
(NITRIC-OXIDE
SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.41A 1k2rA-2vy0A:
undetectable
1k2rB-2vy0A:
undetectable		 1k2rA-2vy0A:
19.68
1k2rB-2vy0A:
19.68
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.
1K2R_B_H4BB2760_1
(NITRIC-OXIDE
SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.39A 1k2rA-2vy0A:
undetectable
1k2rB-2vy0A:
undetectable		 1k2rA-2vy0A:
19.68
1k2rB-2vy0A:
19.68
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.
1K2S_A_H4BA1760_1
(NITRIC-OXIDE
SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.38A 1k2sA-2vy0A:
undetectable
1k2sB-2vy0A:
undetectable		 1k2sA-2vy0A:
19.68
1k2sB-2vy0A:
19.68
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.
1K2T_A_H4BA1760_1
(NITRIC-OXIDE
SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.46A 1k2tA-2vy0A:
undetectable
1k2tB-2vy0A:
undetectable		 1k2tA-2vy0A:
19.68
1k2tB-2vy0A:
19.68
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.
1K2T_B_H4BB2760_1
(NITRIC-OXIDE
SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 1k2tA-2vy0A:
undetectable
1k2tB-2vy0A:
undetectable		 1k2tA-2vy0A:
19.68
1k2tB-2vy0A:
19.68
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.
1K2U_A_H4BA1760_1
(NITRIC-OXIDE
SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.41A 1k2uA-2vy0A:
undetectable
1k2uB-2vy0A:
undetectable		 1k2uA-2vy0A:
19.68
1k2uB-2vy0A:
19.68
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.
1K2U_B_H4BB2760_1
(NITRIC-OXIDE
SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.41A 1k2uA-2vy0A:
undetectable
1k2uB-2vy0A:
undetectable		 1k2uA-2vy0A:
19.68
1k2uB-2vy0A:
19.68
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.
1LZX_A_H4BA760_1
(NITRIC-OXIDE
SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.42A 1lzxA-2vy0A:
undetectable
1lzxB-2vy0A:
undetectable		 1lzxA-2vy0A:
19.68
1lzxB-2vy0A:
19.68
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.
1LZX_B_H4BB1760_1
(NITRIC-OXIDE
SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 1lzxA-2vy0A:
undetectable
1lzxB-2vy0A:
undetectable		 1lzxA-2vy0A:
19.68
1lzxB-2vy0A:
19.68
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.
1LZZ_B_H4BB1760_1
(NITRIC-OXIDE
SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.40A 1lzzA-2vy0A:
undetectable
1lzzB-2vy0A:
undetectable		 1lzzA-2vy0A:
19.68
1lzzB-2vy0A:
19.68
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.
1M00_A_H4BA760_1
(NITRIC-OXIDE
SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 1m00A-2vy0A:
undetectable
1m00B-2vy0A:
undetectable		 1m00A-2vy0A:
19.68
1m00B-2vy0A:
19.68
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.
1M00_B_H4BB1760_1
(NITRIC-OXIDE
SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 1m00A-2vy0A:
undetectable
1m00B-2vy0A:
undetectable		 1m00A-2vy0A:
19.68
1m00B-2vy0A:
19.68
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.
1MAG_A_DVAA6_0
(GRAMICIDIN A)		 3trp CALSEQUESTRIN-1
(Oryctolagus
cuniculus) 		3 / 3 ALA A 320
VAL A 317
TRP A 242
 MRD  A 355 ( 3.9A)
None
MRD  A 355 (-4.0A)
 0.96A 1magA-3trpA:
undetectable		 1magA-3trpA:
3.50
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.
1MAG_B_DVAB6_0
(GRAMICIDIN A)		 3trp CALSEQUESTRIN-1
(Oryctolagus
cuniculus) 		3 / 3 ALA A 320
VAL A 317
TRP A 242
 MRD  A 355 ( 3.9A)
None
MRD  A 355 (-4.0A)
 0.96A 1magB-3trpA:
undetectable		 1magB-3trpA:
3.50
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.
1MCL_P_DHIP1_0
(IMMUNOGLOBULIN
LAMBDA DIMER MCG
(LIGHT CHAIN)
N-ACETYL-D-HIS-L-PRO
-OH)		 3f8h PUTATIVE POLYKETIDE
CYCLASE
(Ruegeria
sp.
TM1040) 		4 / 5 TYR A  98
GLU A  57
TYR A 120
PRO A 101
 MRD  A 134 (-4.2A)
MRD  A 134 ( 2.7A)
MRD  A 134 (-3.9A)
None
 1.40A 1mclA-3f8hA:
undetectable
1mclB-3f8hA:
undetectable
1mclP-3f8hA:
undetectable		 1mclA-3f8hA:
19.72
1mclB-3f8hA:
19.72
1mclP-3f8hA:
2.30
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.
1MMV_A_H4BA1760_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 1mmvA-2vy0A:
undetectable
1mmvB-2vy0A:
undetectable		 1mmvA-2vy0A:
19.68
1mmvB-2vy0A:
19.68
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.
1MMW_A_H4BA1760_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 1mmwA-2vy0A:
undetectable
1mmwB-2vy0A:
undetectable		 1mmwA-2vy0A:
19.68
1mmwB-2vy0A:
19.68
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.
1MMW_B_H4BB2760_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 1mmwA-2vy0A:
undetectable
1mmwB-2vy0A:
undetectable		 1mmwA-2vy0A:
19.68
1mmwB-2vy0A:
19.68
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1MT1_G_AG2G7003_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE BETA
CHAIN
PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE ALPHA
CHAIN)		 1n2m PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE
(Methanocaldococc
us
jannaschii) 		4 / 6 LEU A  31
ASP A  35
LEU A  38
GLY A  44
 MRD  A7006 ( 4.2A)
None
None
None
 0.15A 1mt1G-1n2mA:
3.4
1mt1J-1n2mA:
18.3		 1mt1G-1n2mA:
100.00
1mt1J-1n2mA:
67.88
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1MT1_K_AG2K7002_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE ALPHA
CHAIN
PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE BETA
CHAIN)		 1n2m PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE
(Methanocaldococc
us
jannaschii) 		4 / 7 LEU A  31
ASP A  35
LEU A  38
GLY A  44
 MRD  A7006 ( 4.2A)
None
None
None
 0.19A 1mt1H-1n2mA:
18.1
1mt1K-1n2mA:
3.2		 1mt1H-1n2mA:
67.88
1mt1K-1n2mA:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MZ9_D_VDYD1001_4
(CARTILAGE OLIGOMERIC
MATRIX PROTEIN)		 4hkg PHOSPHOPANTETHEINE
ATTACHMENT SITE
FAMILY PROTEIN
(Acinetobacter
baumannii) 		4 / 4 THR A  34
LEU A  38
VAL A  16
LEU A  15
 MRD  A 100 (-4.2A)
None
None
None
 0.85A 1mz9D-4hkgA:
undetectable		 1mz9D-4hkgA:
22.09
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1N13_D_AG2D7015_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE ALPHA
CHAIN
PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE BETA
CHAIN)		 1n2m PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE
(Methanocaldococc
us
jannaschii) 		4 / 7 LEU A  31
ASP A  35
LEU A  38
GLY A  44
 MRD  A7006 ( 4.2A)
None
None
None
 0.19A 1n13D-1n2mA:
18.2
1n13E-1n2mA:
3.0		 1n13D-1n2mA:
67.88
1n13E-1n2mA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1N13_F_AG2F7016_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE BETA
CHAIN
PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE ALPHA
CHAIN)		 1n2m PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE
(Methanocaldococc
us
jannaschii) 		4 / 8 LEU A  31
ASP A  35
LEU A  38
GLY A  44
 MRD  A7006 ( 4.2A)
None
None
None
 0.20A 1n13A-1n2mA:
3.7
1n13F-1n2mA:
18.4		 1n13A-1n2mA:
100.00
1n13F-1n2mA:
67.88
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1N13_H_AG2H7012_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE ALPHA
CHAIN
PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE BETA
CHAIN)		 1n2m PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE
(Methanocaldococc
us
jannaschii) 		4 / 6 LEU A  31
ASP A  35
LEU A  38
GLY A  44
 MRD  A7006 ( 4.2A)
None
None
None
 0.24A 1n13H-1n2mA:
18.3
1n13K-1n2mA:
3.3		 1n13H-1n2mA:
67.88
1n13K-1n2mA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1N13_J_AG2J7013_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE BETA
CHAIN
PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE ALPHA
CHAIN)		 1n2m PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE
(Methanocaldococc
us
jannaschii) 		4 / 7 LEU A  31
ASP A  35
LEU A  38
GLY A  44
 MRD  A7006 ( 4.2A)
None
None
None
 0.20A 1n13G-1n2mA:
3.4
1n13J-1n2mA:
18.5		 1n13G-1n2mA:
100.00
1n13J-1n2mA:
67.88
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.
1OM4_A_H4BA760_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 1om4A-2vy0A:
undetectable
1om4B-2vy0A:
undetectable		 1om4A-2vy0A:
20.00
1om4B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1OM4_B_H4BB761_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 1om4A-2vy0A:
undetectable
1om4B-2vy0A:
undetectable		 1om4A-2vy0A:
20.00
1om4B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1OM5_A_H4BA760_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 8 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 1om5A-2vy0A:
undetectable
1om5B-2vy0A:
undetectable		 1om5A-2vy0A:
19.82
1om5B-2vy0A:
19.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1P5Z_B_AR3B304_1
(DEOXYCYTIDINE KINASE)		 3f8h PUTATIVE POLYKETIDE
CYCLASE
(Ruegeria
sp.
TM1040) 		5 / 12 VAL A  28
LEU A  24
MET A  20
TYR A   8
PHE A  47
 None
None
MRD  A 135 ( 3.9A)
None
None
 1.45A 1p5zB-3f8hA:
undetectable		 1p5zB-3f8hA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1P6H_A_H4BA760_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.40A 1p6hA-2vy0A:
undetectable
1p6hB-2vy0A:
undetectable		 1p6hA-2vy0A:
19.82
1p6hB-2vy0A:
19.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1P6H_B_H4BB761_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.41A 1p6hA-2vy0A:
undetectable
1p6hB-2vy0A:
undetectable		 1p6hA-2vy0A:
19.82
1p6hB-2vy0A:
19.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1P6I_A_H4BA760_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.39A 1p6iA-2vy0A:
undetectable
1p6iB-2vy0A:
undetectable		 1p6iA-2vy0A:
19.82
1p6iB-2vy0A:
19.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1P6I_B_H4BB761_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.40A 1p6iA-2vy0A:
undetectable
1p6iB-2vy0A:
undetectable		 1p6iA-2vy0A:
19.82
1p6iB-2vy0A:
19.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1P6J_B_H4BB761_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 1p6jA-2vy0A:
undetectable
1p6jB-2vy0A:
undetectable		 1p6jA-2vy0A:
19.82
1p6jB-2vy0A:
19.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1P6K_A_H4BA760_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.43A 1p6kA-2vy0A:
undetectable
1p6kB-2vy0A:
undetectable		 1p6kA-2vy0A:
19.82
1p6kB-2vy0A:
19.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1P6K_B_H4BB761_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 1p6kA-2vy0A:
undetectable
1p6kB-2vy0A:
undetectable		 1p6kA-2vy0A:
19.82
1p6kB-2vy0A:
19.82
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.
1R30_A_SAMA501_0
(BIOTIN SYNTHASE)		 3hwr 2-DEHYDROPANTOATE
2-REDUCTASE
(Cupriavidus
pinatubonensis) 		5 / 12 TYR A 185
GLY A 204
ILE A 235
LEU A 181
LEU A 285
 None
None
None
MRD  A 302 ( 3.4A)
None
 1.20A 1r30A-3hwrA:
undetectable		 1r30A-3hwrA:
24.68
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.
1R30_B_SAMB501_0
(BIOTIN SYNTHASE)		 3hwr 2-DEHYDROPANTOATE
2-REDUCTASE
(Cupriavidus
pinatubonensis) 		5 / 12 TYR A 185
GLY A 204
ILE A 235
LEU A 181
LEU A 285
 None
None
None
MRD  A 302 ( 3.4A)
None
 1.20A 1r30B-3hwrA:
undetectable		 1r30B-3hwrA:
24.68
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.
1RS6_A_H4BA760_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.43A 1rs6A-2vy0A:
undetectable
1rs6B-2vy0A:
undetectable		 1rs6A-2vy0A:
19.82
1rs6B-2vy0A:
19.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1RS6_B_H4BB761_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 8 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 1rs6A-2vy0A:
undetectable
1rs6B-2vy0A:
undetectable		 1rs6A-2vy0A:
19.82
1rs6B-2vy0A:
19.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1RS7_A_H4BA760_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.43A 1rs7A-2vy0A:
undetectable
1rs7B-2vy0A:
undetectable		 1rs7A-2vy0A:
19.82
1rs7B-2vy0A:
19.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1RS7_B_H4BB761_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 1rs7A-2vy0A:
undetectable
1rs7B-2vy0A:
undetectable		 1rs7A-2vy0A:
19.82
1rs7B-2vy0A:
19.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1RTS_A_D16A309_1
(THYMIDYLATE SYNTHASE)		 3k9t PUTATIVE PEPTIDASE
(Clostridium
acetobutylicum) 		4 / 8 PHE A 221
ILE A  48
GLY A 169
PHE A 223
 None
MRD  A 441 ( 4.8A)
None
None
 0.86A 1rtsA-3k9tA:
undetectable		 1rtsA-3k9tA:
21.44
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.
1TKQ_A_DVAA6_0
(MINI-GRAMICIDIN A)		 5nyy NON-SPECIFIC
SERINE/THREONINE
PROTEIN KINASE
(Thermomonospora
curvata) 		3 / 3 ALA A 291
VAL A 138
TRP A 117
 MRD  A 403 ( 3.8A)
None
None
 0.84A 1tkqA-5nyyA:
undetectable		 1tkqA-5nyyA:
5.22
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.
1UDT_A_VIAA1000_1
(CGMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE)		 2vd3 ATP
PHOSPHORIBOSYLTRANSF
ERASE
(Methanothermobac
ter
thermautotrophic
us) 		5 / 12 ALA A 147
ILE A 156
VAL A 115
ALA A 114
LEU A 128
 None
None
MRD  A1299 ( 4.4A)
None
None
 1.31A 1udtA-2vd3A:
undetectable		 1udtA-2vd3A:
23.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1UTD_G_TRPG81_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		5 / 9 HIS A 117
ALA A 122
ILE A 129
THR A  81
SER A 124
 None
None
None
MRD  A 301 ( 4.2A)
None
 1.49A 1utdG-4nq1A:
undetectable
1utdH-4nq1A:
undetectable		 1utdG-4nq1A:
15.71
1utdH-4nq1A:
15.71
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.
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.
1ZVL_A_H4BA900_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.42A 1zvlA-2vy0A:
undetectable
1zvlB-2vy0A:
undetectable		 1zvlA-2vy0A:
20.05
1zvlB-2vy0A:
20.05
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.
1ZVL_B_H4BB920_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 1zvlA-2vy0A:
0.0
1zvlB-2vy0A:
0.0		 1zvlA-2vy0A:
20.05
1zvlB-2vy0A:
20.05
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.
1ZZQ_A_H4BA760_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 1zzqA-2vy0A:
undetectable
1zzqB-2vy0A:
undetectable		 1zzqA-2vy0A:
19.86
1zzqB-2vy0A:
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.
1ZZQ_B_H4BB761_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 1zzqA-2vy0A:
undetectable
1zzqB-2vy0A:
undetectable		 1zzqA-2vy0A:
19.86
1zzqB-2vy0A:
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.
209D_C_DVAC2_0
(N8-ACTINOMYCIN D)		 5ez3 ACYL-COA
DEHYDROGENASE
(Brucella
melitensis) 		3 / 3 THR A 145
PRO A 143
THR A 147
 MRD  A 601 (-3.7A)
None
None
 0.64A 209dC-5ez3A:
undetectable		 209dC-5ez3A:
2.05
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.
2BXE_B_1FLB2002_1
(SERUM ALBUMIN)		 2wqh CTPR3Y3
(synthetic
construct) 		5 / 11 ALA A  77
ALA A  79
LEU A  70
ALA A  69
GLU A  44
 None
None
MRD  A1109 (-4.7A)
None
None
 0.91A 2bxeB-2wqhA:
undetectable		 2bxeB-2wqhA:
11.30
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.
2BXG_A_IBPA2002_1
(SERUM ALBUMIN)		 3hwr 2-DEHYDROPANTOATE
2-REDUCTASE
(Cupriavidus
pinatubonensis) 		4 / 8 ARG A 221
ALA A 220
GLU A 214
VAL A 231
 None
None
None
MRD  A 302 ( 4.8A)
 0.78A 2bxgA-3hwrA:
undetectable		 2bxgA-3hwrA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2EIL_P_CHDP1271_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE
VIIA-HEART
CYTOCHROME C OXIDASE
SUBUNIT 3)		 3ail 303AA LONG
HYPOTHETICAL
ESTERASE
(Sulfurisphaera
tokodaii) 		4 / 8 ARG A 200
GLN A 208
PHE A 182
LEU A 184
 None
None
MRD  A 305 (-4.4A)
None
 0.99A 2eilP-3ailA:
undetectable
2eilW-3ailA:
undetectable		 2eilP-3ailA:
20.54
2eilW-3ailA:
11.46
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.
2G6H_A_H4BA760_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 8 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.42A 2g6hA-2vy0A:
undetectable
2g6hB-2vy0A:
undetectable		 2g6hA-2vy0A:
19.86
2g6hB-2vy0A:
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.
2G6H_B_H4BB761_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.40A 2g6hA-2vy0A:
undetectable
2g6hB-2vy0A:
undetectable		 2g6hA-2vy0A:
19.86
2g6hB-2vy0A:
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.
2G6K_A_H4BA760_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.42A 2g6kA-2vy0A:
undetectable
2g6kB-2vy0A:
undetectable		 2g6kA-2vy0A:
19.86
2g6kB-2vy0A:
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.
2G6K_B_H4BB761_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.40A 2g6kA-2vy0A:
undetectable
2g6kB-2vy0A:
undetectable		 2g6kA-2vy0A:
19.86
2g6kB-2vy0A:
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.
2G6M_A_H4BA760_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.41A 2g6mA-2vy0A:
undetectable
2g6mB-2vy0A:
undetectable		 2g6mA-2vy0A:
19.86
2g6mB-2vy0A:
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.
2G6M_B_H4BB761_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.41A 2g6mA-2vy0A:
undetectable
2g6mB-2vy0A:
undetectable		 2g6mA-2vy0A:
19.86
2g6mB-2vy0A:
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.
2HX3_A_H4BA760_1
(NITRIC-OXIDE
SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.42A 2hx3A-2vy0A:
undetectable
2hx3B-2vy0A:
undetectable		 2hx3A-2vy0A:
20.00
2hx3B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2HX3_B_H4BB760_1
(NITRIC-OXIDE
SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 2hx3A-2vy0A:
undetectable
2hx3B-2vy0A:
undetectable		 2hx3A-2vy0A:
20.00
2hx3B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2HX4_A_H4BA760_1
(NITRIC-OXIDE
SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 2hx4A-2vy0A:
undetectable
2hx4B-2vy0A:
undetectable		 2hx4A-2vy0A:
20.00
2hx4B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2HX4_B_H4BB760_1
(NITRIC-OXIDE
SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.41A 2hx4A-2vy0A:
undetectable
2hx4B-2vy0A:
undetectable		 2hx4A-2vy0A:
20.00
2hx4B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2HYY_A_STIA600_2
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE ABL1)		 3q9t CHOLINE
DEHYDROGENASE AND
RELATED
FLAVOPROTEINS
(Aspergillus
oryzae) 		4 / 6 LEU A 494
VAL A  73
VAL A 311
ILE A 460
 MRD  A 581 ( 4.9A)
None
None
None
 0.90A 2hyyA-3q9tA:
undetectable		 2hyyA-3q9tA:
18.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2JN3_A_JN3A131_1
(FATTY ACID-BINDING
PROTEIN, LIVER)		 5jft CASPASE 3,
APOPTOSIS-RELATED
CYSTEINE PROTEASE A
(Danio
rerio) 		5 / 12 VAL A 118
PHE A 162
THR A 143
LYS A 140
LEU A 237
 None
None
MRD  A 302 (-4.0A)
MRD  A 302 (-3.6A)
None
 1.03A 2jn3A-5jftA:
undetectable		 2jn3A-5jftA:
17.80
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.
2NO0_A_GEOA302_1
(DEOXYCYTIDINE KINASE)		 3f8h PUTATIVE POLYKETIDE
CYCLASE
(Ruegeria
sp.
TM1040) 		5 / 12 VAL A  28
LEU A  24
MET A  20
TYR A   8
PHE A  47
 None
None
MRD  A 135 ( 3.9A)
None
None
 1.45A 2no0A-3f8hA:
undetectable		 2no0A-3f8hA:
22.63
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.
2PKK_A_2FAA501_2
(ADENOSINE KINASE)		 3mmh METHIONINE-R-SULFOXI
DE REDUCTASE
(Neisseria
meningitidis) 		4 / 4 ALA A 153
VAL A 130
PHE A 122
THR A  94
 None
None
None
MRD  A 177 (-4.5A)
 1.40A 2pkkA-3mmhA:
undetectable		 2pkkA-3mmhA:
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.
2QEU_A_ACTA142_0
(PUTATIVE
CARBOXYMUCONOLACTONE
DECARBOXYLASE)		 4qfu GLYCOSIDE HYDROLASE
FAMILY 5
(Bacteroides
vulgatus) 		4 / 5 GLU A 282
PRO A 283
ILE A 284
GLY A 239
 MRD  A 501 (-2.7A)
None
None
None
 0.78A 2qeuA-4qfuA:
undetectable
2qeuC-4qfuA:
undetectable		 2qeuA-4qfuA:
15.78
2qeuC-4qfuA:
15.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2QQC_E_AG2E671_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE (EC
4.1.1.19) (PVLARGDC))		 1n2m PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE
(Methanocaldococc
us
jannaschii) 		4 / 7 LEU A  31
ASP A  35
LEU A  38
GLY A  44
 MRD  A7006 ( 4.2A)
None
None
None
 0.23A 2qqcD-1n2mA:
18.4
2qqcE-1n2mA:
3.0		 2qqcD-1n2mA:
99.11
2qqcE-1n2mA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2QQC_K_AG2K671_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE (EC
4.1.1.19) (PVLARGDC))		 1n2m PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE
(Methanocaldococc
us
jannaschii) 		4 / 8 LEU A  31
ASP A  35
LEU A  38
GLY A  44
 MRD  A7006 ( 4.2A)
None
None
None
 0.21A 2qqcH-1n2mA:
18.4
2qqcK-1n2mA:
3.3		 2qqcH-1n2mA:
99.11
2qqcK-1n2mA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2QQD_B_AG2B671_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE (EC
4.1.1.19) (PVLARGDC))		 1n2m PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE
(Methanocaldococc
us
jannaschii) 		4 / 8 LEU A  31
ASP A  35
LEU A  38
GLY A  44
 MRD  A7006 ( 4.2A)
None
None
None
 0.22A 2qqdB-1n2mA:
18.5
2qqdC-1n2mA:
29.7		 2qqdB-1n2mA:
100.00
2qqdC-1n2mA:
98.79
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.
2V0M_D_KLND1498_1
(CYTOCHROME P450 3A4)		 6amz 2,3,4,5-TETRAHYDROPY
RIDINE-2,6-DICARBOXY
LATE
N-SUCCINYLTRANSFERAS
E
(Acinetobacter
baumannii) 		5 / 11 SER A 231
ILE A 252
ALA A 250
THR A 212
GLU A 179
 None
None
None
MRD  A 301 (-3.1A)
None
 1.32A 2v0mD-6amzA:
undetectable		 2v0mD-6amzA:
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.
2VPP_A_GEOA1210_1
(DEOXYNUCLEOSIDE
KINASE)		 3f8h PUTATIVE POLYKETIDE
CYCLASE
(Ruegeria
sp.
TM1040) 		5 / 12 VAL A  28
MET A  20
TYR A   8
ALA A  46
PHE A  47
 None
MRD  A 135 ( 3.9A)
None
None
None
 1.34A 2vppA-3f8hA:
undetectable		 2vppA-3f8hA:
22.03
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.
2VPP_B_GEOB1207_1
(DEOXYNUCLEOSIDE
KINASE)		 3f8h PUTATIVE POLYKETIDE
CYCLASE
(Ruegeria
sp.
TM1040) 		5 / 12 VAL A  28
MET A  20
TYR A   8
ALA A  46
PHE A  47
 None
MRD  A 135 ( 3.9A)
None
None
None
 1.33A 2vppB-3f8hA:
undetectable		 2vppB-3f8hA:
22.03
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.
2XCT_G_CPFG1020_1
(DNA GYRASE SUBUNIT
B, DNA GYRASE
SUBUNIT A)		 1vrm HYPOTHETICAL PROTEIN
TM1553
(Thermotoga
maritima) 		3 / 3 ARG A 136
GLY A 135
SER A  93
 MRD  A   2 ( 3.3A)
None
None
 0.57A 2xctB-1vrmA:
undetectable		 2xctB-1vrmA:
20.22
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.
2ZIA_B_CL9B401_1
(DEOXYCYTIDINE KINASE)		 3f8h PUTATIVE POLYKETIDE
CYCLASE
(Ruegeria
sp.
TM1040) 		5 / 12 VAL A  28
LEU A  24
MET A  20
TYR A   8
PHE A  47
 None
None
MRD  A 135 ( 3.9A)
None
None
 1.45A 2ziaB-3f8hA:
undetectable		 2ziaB-3f8hA:
22.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ZJ0_B_2FAB500_2
(ADENOSYLHOMOCYSTEINA
SE)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		4 / 5 GLN A 111
THR A 110
THR A  81
HIS A 120
 None
None
MRD  A 301 ( 4.2A)
MRD  A 301 ( 4.8A)
 1.28A 2zj0B-4nq1A:
undetectable		 2zj0B-4nq1A:
22.34
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.
3ABL_P_CHDP1271_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 3ail 303AA LONG
HYPOTHETICAL
ESTERASE
(Sulfurisphaera
tokodaii) 		4 / 6 ARG A 200
GLN A 208
PHE A 182
LEU A 184
 None
None
MRD  A 305 (-4.4A)
None
 1.00A 3ablP-3ailA:
undetectable
3ablW-3ailA:
undetectable		 3ablP-3ailA:
20.54
3ablW-3ailA:
11.46
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.
3AG2_C_CHDC271_0
(CYTOCHROME C OXIDASE
SUBUNIT 3)		 3ail 303AA LONG
HYPOTHETICAL
ESTERASE
(Sulfurisphaera
tokodaii) 		4 / 7 ARG A 200
GLN A 208
PHE A 182
LEU A 184
 None
None
MRD  A 305 (-4.4A)
None
 1.01A 3ag2C-3ailA:
undetectable		 3ag2C-3ailA:
20.54
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.
3AIC_B_ACRB5044_2
(GLUCOSYLTRANSFERASE-
SI)		 4e21 6-PHOSPHOGLUCONATE
DEHYDROGENASE
(DECARBOXYLATING)
(Geobacter
metallireducens) 		3 / 3 LEU A 301
TRP A 286
TYR A 196
 None
None
MRD  A 401 (-4.5A)
 1.00A 3aicB-4e21A:
undetectable		 3aicB-4e21A:
17.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AIC_E_ACRE5044_2
(GLUCOSYLTRANSFERASE-
SI)		 4e21 6-PHOSPHOGLUCONATE
DEHYDROGENASE
(DECARBOXYLATING)
(Geobacter
metallireducens) 		3 / 3 LEU A 301
TRP A 286
TYR A 196
 None
None
MRD  A 401 (-4.5A)
 1.00A 3aicE-4e21A:
undetectable		 3aicE-4e21A:
17.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AIC_G_ACRG5044_2
(GLUCOSYLTRANSFERASE-
SI)		 4e21 6-PHOSPHOGLUCONATE
DEHYDROGENASE
(DECARBOXYLATING)
(Geobacter
metallireducens) 		3 / 3 LEU A 301
TRP A 286
TYR A 196
 None
None
MRD  A 401 (-4.5A)
 0.99A 3aicG-4e21A:
undetectable		 3aicG-4e21A:
17.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AIC_H_ACRH5044_2
(GLUCOSYLTRANSFERASE-
SI)		 4e21 6-PHOSPHOGLUCONATE
DEHYDROGENASE
(DECARBOXYLATING)
(Geobacter
metallireducens) 		3 / 3 LEU A 301
TRP A 286
TYR A 196
 None
None
MRD  A 401 (-4.5A)
 0.97A 3aicH-4e21A:
undetectable		 3aicH-4e21A:
17.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3B3M_A_H4BA760_1
(NITRIC-OXIDE
SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.43A 3b3mA-2vy0A:
undetectable
3b3mB-2vy0A:
undetectable		 3b3mA-2vy0A:
20.00
3b3mB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3B3M_B_H4BB760_1
(NITRIC-OXIDE
SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 3b3mA-2vy0A:
undetectable
3b3mB-2vy0A:
undetectable		 3b3mA-2vy0A:
20.00
3b3mB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3B3N_A_H4BA760_1
(NITRIC-OXIDE
SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 3b3nA-2vy0A:
undetectable
3b3nB-2vy0A:
undetectable		 3b3nA-2vy0A:
20.00
3b3nB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3B3N_B_H4BB760_1
(NITRIC-OXIDE
SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 3b3nA-2vy0A:
undetectable
3b3nB-2vy0A:
undetectable		 3b3nA-2vy0A:
20.00
3b3nB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3B3O_A_H4BA760_1
(NITRIC-OXIDE
SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.43A 3b3oA-2vy0A:
undetectable
3b3oB-2vy0A:
undetectable		 3b3oA-2vy0A:
20.00
3b3oB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3B3O_B_H4BB760_1
(NITRIC-OXIDE
SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.41A 3b3oA-2vy0A:
undetectable
3b3oB-2vy0A:
undetectable		 3b3oA-2vy0A:
20.00
3b3oB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3B3P_A_H4BA760_1
(NITRIC-OXIDE
SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.43A 3b3pA-2vy0A:
undetectable
3b3pB-2vy0A:
undetectable		 3b3pA-2vy0A:
20.00
3b3pB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3B3P_B_H4BB760_1
(NITRIC-OXIDE
SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 8 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.46A 3b3pA-2vy0A:
undetectable
3b3pB-2vy0A:
undetectable		 3b3pA-2vy0A:
20.00
3b3pB-2vy0A:
20.00
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.
3CD2_A_MTXA307_1
(DIHYDROFOLATE
REDUCTASE)		 3k9t PUTATIVE PEPTIDASE
(Clostridium
acetobutylicum) 		5 / 12 ILE A 349
ILE A 173
SER A 218
PRO A  49
ILE A 206
 None
None
None
MRD  A 441 ( 4.9A)
None
 1.01A 3cd2A-3k9tA:
undetectable		 3cd2A-3k9tA:
17.87
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.
3CE6_A_ADNA500_2
(ADENOSYLHOMOCYSTEINA
SE)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		4 / 5 GLN A 111
THR A 110
THR A  81
HIS A 120
 None
None
MRD  A 301 ( 4.2A)
MRD  A 301 ( 4.8A)
 1.27A 3ce6A-4nq1A:
undetectable		 3ce6A-4nq1A:
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.
3CE6_B_ADNB500_2
(ADENOSYLHOMOCYSTEINA
SE)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		4 / 5 GLN A 111
THR A 110
THR A  81
HIS A 120
 None
None
MRD  A 301 ( 4.2A)
MRD  A 301 ( 4.8A)
 1.25A 3ce6B-4nq1A:
undetectable		 3ce6B-4nq1A:
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.
3CE6_C_ADNC500_2
(ADENOSYLHOMOCYSTEINA
SE)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		4 / 5 GLN A 111
THR A 110
THR A  81
HIS A 120
 None
None
MRD  A 301 ( 4.2A)
MRD  A 301 ( 4.8A)
 1.25A 3ce6C-4nq1A:
undetectable		 3ce6C-4nq1A:
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.
3FBX_A_ACTA608_0
(PUTATIVE
PHOSPHOLIPASE B-LIKE
2)		 3dmo CYTIDINE DEAMINASE
(Burkholderia
pseudomallei) 		3 / 3 GLU A  44
VAL A  43
CYH A  51
 MRD  A 132 (-3.6A)
None
MRD  A 132 ( 4.6A)
 1.02A 3fbxA-3dmoA:
undetectable		 3fbxA-3dmoA:
12.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3FC5_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.42A 3fc5A-2vy0A:
undetectable
3fc5B-2vy0A:
undetectable		 3fc5A-2vy0A:
20.00
3fc5B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3FC5_B_H4BB761_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.40A 3fc5A-2vy0A:
undetectable
3fc5B-2vy0A:
undetectable		 3fc5A-2vy0A:
20.00
3fc5B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3G1U_A_ADNA438_2
(ADENOSYLHOMOCYSTEINA
SE)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		4 / 4 GLN A 111
THR A 110
THR A  81
HIS A 120
 None
None
MRD  A 301 ( 4.2A)
MRD  A 301 ( 4.8A)
 1.26A 3g1uA-4nq1A:
undetectable		 3g1uA-4nq1A:
23.40
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.
3G1U_C_ADNC438_2
(ADENOSYLHOMOCYSTEINA
SE)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		4 / 5 GLN A 111
THR A 110
THR A  81
HIS A 120
 None
None
MRD  A 301 ( 4.2A)
MRD  A 301 ( 4.8A)
 1.27A 3g1uC-4nq1A:
undetectable		 3g1uC-4nq1A:
23.40
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.
3GLQ_A_RABA602_2
(ADENOSYLHOMOCYSTEINA
SE)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		4 / 5 GLN A 111
THR A 110
THR A  81
HIS A 120
 None
None
MRD  A 301 ( 4.2A)
MRD  A 301 ( 4.8A)
 1.27A 3glqA-4nq1A:
undetectable		 3glqA-4nq1A:
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.
3GLQ_B_RABB602_2
(ADENOSYLHOMOCYSTEINA
SE)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		4 / 5 GLN A 111
THR A 110
THR A  81
HIS A 120
 None
None
MRD  A 301 ( 4.2A)
MRD  A 301 ( 4.8A)
 1.25A 3glqB-4nq1A:
undetectable		 3glqB-4nq1A:
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.
3HP1_A_LLTA401_1
(DEOXYCYTIDINE KINASE)		 3f8h PUTATIVE POLYKETIDE
CYCLASE
(Ruegeria
sp.
TM1040) 		5 / 12 VAL A  28
MET A  20
TYR A   8
ALA A  46
PHE A  47
 None
MRD  A 135 ( 3.9A)
None
None
None
 1.34A 3hp1A-3f8hA:
0.0		 3hp1A-3f8hA:
22.63
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.
3HSN_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.46A 3hsnA-2vy0A:
undetectable
3hsnB-2vy0A:
undetectable		 3hsnA-2vy0A:
20.00
3hsnB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3HSN_B_H4BB1760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 3hsnA-2vy0A:
undetectable
3hsnB-2vy0A:
undetectable		 3hsnA-2vy0A:
20.00
3hsnB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3HSO_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.43A 3hsoA-2vy0A:
undetectable
3hsoB-2vy0A:
undetectable		 3hsoA-2vy0A:
20.00
3hsoB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3HSO_B_H4BB1760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.45A 3hsoA-2vy0A:
undetectable
3hsoB-2vy0A:
undetectable		 3hsoA-2vy0A:
20.00
3hsoB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3HSP_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.42A 3hspA-2vy0A:
undetectable
3hspB-2vy0A:
undetectable		 3hspA-2vy0A:
20.00
3hspB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3HSP_B_H4BB1760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.41A 3hspA-2vy0A:
undetectable
3hspB-2vy0A:
undetectable		 3hspA-2vy0A:
20.00
3hspB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3I5U_A_SAMA401_0
(O-METHYLTRANSFERASE)		 5wyb PROBABLE ENOYL-COA
HYDRATASE/ISOMERASE
(Pseudomonas
aeruginosa) 		5 / 12 PHE B  83
LEU B 144
GLY B 124
GLY B  77
ALA B 155
 MRD  B 301 (-4.3A)
None
None
MRD  B 301 ( 4.8A)
MRD  B 301 (-4.2A)
 1.21A 3i5uA-5wybB:
undetectable		 3i5uA-5wybB:
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.
3JT3_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.48A 3jt3A-2vy0A:
undetectable
3jt3B-2vy0A:
undetectable		 3jt3A-2vy0A:
20.00
3jt3B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JT3_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.47A 3jt3A-2vy0A:
undetectable
3jt3B-2vy0A:
undetectable		 3jt3A-2vy0A:
20.00
3jt3B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JT4_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 3jt4A-2vy0A:
undetectable
3jt4B-2vy0A:
undetectable		 3jt4A-2vy0A:
20.00
3jt4B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JT4_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 3jt4A-2vy0A:
undetectable
3jt4B-2vy0A:
undetectable		 3jt4A-2vy0A:
20.00
3jt4B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JT5_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.46A 3jt5A-2vy0A:
undetectable
3jt5B-2vy0A:
undetectable		 3jt5A-2vy0A:
20.00
3jt5B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JT5_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 3jt5A-2vy0A:
undetectable
3jt5B-2vy0A:
undetectable		 3jt5A-2vy0A:
20.00
3jt5B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JT6_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 3jt6A-2vy0A:
undetectable
3jt6B-2vy0A:
undetectable		 3jt6A-2vy0A:
20.00
3jt6B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JT6_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.41A 3jt6A-2vy0A:
undetectable
3jt6B-2vy0A:
undetectable		 3jt6A-2vy0A:
20.00
3jt6B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JT7_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 3jt7A-2vy0A:
undetectable
3jt7B-2vy0A:
undetectable		 3jt7A-2vy0A:
20.00
3jt7B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JT7_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 3jt7A-2vy0A:
undetectable
3jt7B-2vy0A:
undetectable		 3jt7A-2vy0A:
20.00
3jt7B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JT8_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 3jt8A-2vy0A:
undetectable
3jt8B-2vy0A:
undetectable		 3jt8A-2vy0A:
20.00
3jt8B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JT8_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.45A 3jt8A-2vy0A:
undetectable
3jt8B-2vy0A:
undetectable		 3jt8A-2vy0A:
20.00
3jt8B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JT9_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 3jt9A-2vy0A:
undetectable
3jt9B-2vy0A:
undetectable		 3jt9A-2vy0A:
20.00
3jt9B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JT9_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 3jt9A-2vy0A:
undetectable
3jt9B-2vy0A:
undetectable		 3jt9A-2vy0A:
20.00
3jt9B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JTA_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.46A 3jtaA-2vy0A:
undetectable
3jtaB-2vy0A:
undetectable		 3jtaA-2vy0A:
20.00
3jtaB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JTA_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 3jtaA-2vy0A:
undetectable
3jtaB-2vy0A:
undetectable		 3jtaA-2vy0A:
20.00
3jtaB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JWS_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.46A 3jwsA-2vy0A:
undetectable
3jwsB-2vy0A:
undetectable		 3jwsA-2vy0A:
20.00
3jwsB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JWS_B_H4BB761_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.45A 3jwsA-2vy0A:
undetectable
3jwsB-2vy0A:
undetectable		 3jwsA-2vy0A:
20.00
3jwsB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JWT_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.43A 3jwtA-2vy0A:
undetectable
3jwtB-2vy0A:
undetectable		 3jwtA-2vy0A:
20.00
3jwtB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JWT_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.45A 3jwtA-2vy0A:
undetectable
3jwtB-2vy0A:
undetectable		 3jwtA-2vy0A:
20.00
3jwtB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JWU_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.46A 3jwuA-2vy0A:
undetectable
3jwuB-2vy0A:
undetectable		 3jwuA-2vy0A:
20.00
3jwuB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JWU_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.45A 3jwuA-2vy0A:
undetectable
3jwuB-2vy0A:
undetectable		 3jwuA-2vy0A:
20.00
3jwuB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JWV_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.47A 3jwvA-2vy0A:
undetectable
3jwvB-2vy0A:
undetectable		 3jwvA-2vy0A:
20.00
3jwvB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JWV_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.46A 3jwvA-2vy0A:
undetectable
3jwvB-2vy0A:
undetectable		 3jwvA-2vy0A:
20.00
3jwvB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JX0_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.46A 3jx0A-2vy0A:
undetectable
3jx0B-2vy0A:
undetectable		 3jx0A-2vy0A:
20.00
3jx0B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JX0_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 3jx0A-2vy0A:
undetectable
3jx0B-2vy0A:
undetectable		 3jx0A-2vy0A:
20.00
3jx0B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JX1_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.43A 3jx1A-2vy0A:
undetectable
3jx1B-2vy0A:
undetectable		 3jx1A-2vy0A:
20.00
3jx1B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JZ0_B_CLYB900_1
(LINCOSAMIDE
NUCLEOTIDYLTRANSFERA
SE)		 3f8h PUTATIVE POLYKETIDE
CYCLASE
(Ruegeria
sp.
TM1040) 		4 / 8 TYR A  77
TYR A 120
GLU A  57
ILE A 113
 None
MRD  A 134 (-3.9A)
MRD  A 134 ( 2.7A)
None
 0.83A 3jz0B-3f8hA:
undetectable		 3jz0B-3f8hA:
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.
3LN1_B_CELB682_2
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3bln ACETYLTRANSFERASE
GNAT FAMILY
(Bacillus
cereus) 		4 / 7 LEU A  68
LEU A  12
ILE A  70
PHE A  53
 MRD  A 146 ( 4.1A)
None
None
None
 0.90A 3ln1B-3blnA:
undetectable		 3ln1B-3blnA:
12.76
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.
3N2R_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 3n2rA-2vy0A:
undetectable
3n2rB-2vy0A:
undetectable		 3n2rA-2vy0A:
20.00
3n2rB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3N2R_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 3n2rA-2vy0A:
undetectable
3n2rB-2vy0A:
undetectable		 3n2rA-2vy0A:
20.00
3n2rB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3N58_A_ADNA500_2
(ADENOSYLHOMOCYSTEINA
SE)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		4 / 5 GLN A 111
THR A 110
THR A  81
HIS A 120
 None
None
MRD  A 301 ( 4.2A)
MRD  A 301 ( 4.8A)
 1.28A 3n58A-4nq1A:
2.0		 3n58A-4nq1A:
20.86
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.
3N5V_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.45A 3n5vA-2vy0A:
undetectable
3n5vB-2vy0A:
undetectable		 3n5vA-2vy0A:
20.00
3n5vB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3N5Y_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.46A 3n5yA-2vy0A:
undetectable
3n5yB-2vy0A:
undetectable		 3n5yA-2vy0A:
20.00
3n5yB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3N5Y_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 3n5yA-2vy0A:
undetectable
3n5yB-2vy0A:
undetectable		 3n5yA-2vy0A:
20.00
3n5yB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3N5Z_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 3n5zA-2vy0A:
undetectable
3n5zB-2vy0A:
undetectable		 3n5zA-2vy0A:
20.00
3n5zB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3N5Z_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 3n5zA-2vy0A:
undetectable
3n5zB-2vy0A:
undetectable		 3n5zA-2vy0A:
20.00
3n5zB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3N61_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 3n61A-2vy0A:
undetectable
3n61B-2vy0A:
undetectable		 3n61A-2vy0A:
19.67
3n61B-2vy0A:
19.67
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.
3N65_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 3n65A-2vy0A:
undetectable
3n65B-2vy0A:
undetectable		 3n65A-2vy0A:
20.23
3n65B-2vy0A:
20.23
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.
3NLK_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 3nlkA-2vy0A:
undetectable
3nlkB-2vy0A:
undetectable		 3nlkA-2vy0A:
20.00
3nlkB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NLK_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.45A 3nlkA-2vy0A:
undetectable
3nlkB-2vy0A:
undetectable		 3nlkA-2vy0A:
20.00
3nlkB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NLM_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.46A 3nlmA-2vy0A:
undetectable
3nlmB-2vy0A:
undetectable		 3nlmA-2vy0A:
20.00
3nlmB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NLM_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 3nlmA-2vy0A:
undetectable
3nlmB-2vy0A:
undetectable		 3nlmA-2vy0A:
20.00
3nlmB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NLN_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 3nlnA-2vy0A:
undetectable
3nlnB-2vy0A:
undetectable		 3nlnA-2vy0A:
20.00
3nlnB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NLO_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 3nloA-2vy0A:
undetectable
3nloB-2vy0A:
undetectable		 3nloA-2vy0A:
20.00
3nloB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NLO_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.46A 3nloA-2vy0A:
undetectable
3nloB-2vy0A:
undetectable		 3nloA-2vy0A:
20.00
3nloB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NLV_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 3nlvA-2vy0A:
undetectable
3nlvB-2vy0A:
undetectable		 3nlvA-2vy0A:
20.00
3nlvB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NLV_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 3nlvA-2vy0A:
undetectable
3nlvB-2vy0A:
undetectable		 3nlvA-2vy0A:
20.00
3nlvB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NLW_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.46A 3nlwA-2vy0A:
undetectable
3nlwB-2vy0A:
undetectable		 3nlwA-2vy0A:
20.00
3nlwB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NLW_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 3nlwA-2vy0A:
undetectable
3nlwB-2vy0A:
undetectable		 3nlwA-2vy0A:
20.00
3nlwB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NLX_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 3nlxA-2vy0A:
undetectable
3nlxB-2vy0A:
undetectable		 3nlxA-2vy0A:
20.00
3nlxB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NLX_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 3nlxA-2vy0A:
undetectable
3nlxB-2vy0A:
undetectable		 3nlxA-2vy0A:
20.00
3nlxB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NLZ_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 3nlzA-2vy0A:
undetectable
3nlzB-2vy0A:
undetectable		 3nlzA-2vy0A:
20.00
3nlzB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NLZ_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 3nlzA-2vy0A:
undetectable
3nlzB-2vy0A:
undetectable		 3nlzA-2vy0A:
20.00
3nlzB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NM0_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 3nm0A-2vy0A:
undetectable
3nm0B-2vy0A:
undetectable		 3nm0A-2vy0A:
20.00
3nm0B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NM0_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 3nm0A-2vy0A:
undetectable
3nm0B-2vy0A:
undetectable		 3nm0A-2vy0A:
20.00
3nm0B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NMU_J_SAMJ228_0
(FIBRILLARIN-LIKE
RRNA/TRNA
2'-O-METHYLTRANSFERA
SE
NOP5/NOP56 RELATED
PROTEIN)		 1z82 GLYCEROL-3-PHOSPHATE
DEHYDROGENASE
(Thermotoga
maritima) 		5 / 11 GLY A 187
ALA A 183
ILE A 188
PHE A 247
ALA A 252
 None
None
MRD  A 601 (-3.8A)
None
None
 1.08A 3nmuB-1z82A:
1.4
3nmuJ-1z82A:
4.3		 3nmuB-1z82A:
23.16
3nmuJ-1z82A:
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.
3NNY_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 3nnyA-2vy0A:
undetectable
3nnyB-2vy0A:
undetectable		 3nnyA-2vy0A:
20.00
3nnyB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NNZ_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 3nnzA-2vy0A:
undetectable
3nnzB-2vy0A:
undetectable		 3nnzA-2vy0A:
20.00
3nnzB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NNZ_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 3nnzA-2vy0A:
undetectable
3nnzB-2vy0A:
undetectable		 3nnzA-2vy0A:
20.00
3nnzB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3PNE_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 3pneA-2vy0A:
undetectable
3pneB-2vy0A:
undetectable		 3pneA-2vy0A:
20.00
3pneB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3PNE_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 3pneA-2vy0A:
undetectable
3pneB-2vy0A:
undetectable		 3pneA-2vy0A:
20.00
3pneB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3PNF_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 3pnfA-2vy0A:
undetectable
3pnfB-2vy0A:
undetectable		 3pnfA-2vy0A:
20.00
3pnfB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3PNF_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 3pnfA-2vy0A:
undetectable
3pnfB-2vy0A:
undetectable		 3pnfA-2vy0A:
20.00
3pnfB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3PNG_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 3pngA-2vy0A:
undetectable
3pngB-2vy0A:
undetectable		 3pngA-2vy0A:
20.00
3pngB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3PNG_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 3pngA-2vy0A:
undetectable
3pngB-2vy0A:
undetectable		 3pngA-2vy0A:
20.00
3pngB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3Q99_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.43A 3q99A-2vy0A:
undetectable
3q99B-2vy0A:
undetectable		 3q99A-2vy0A:
20.00
3q99B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3Q99_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 3q99A-2vy0A:
undetectable
3q99B-2vy0A:
undetectable		 3q99A-2vy0A:
20.00
3q99B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3Q9A_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.41A 3q9aA-2vy0A:
undetectable
3q9aB-2vy0A:
undetectable		 3q9aA-2vy0A:
20.00
3q9aB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3Q9A_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 3q9aA-2vy0A:
undetectable
3q9aB-2vy0A:
undetectable		 3q9aA-2vy0A:
20.00
3q9aB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3R0L_D_ACTD127_0
(PHOSPHOLIPASE A2 CB)		 5wyb PROBABLE ENOYL-COA
HYDRATASE/ISOMERASE
(Pseudomonas
aeruginosa) 		4 / 5 PHE B  74
ILE B  32
GLY B 123
CYH B 127
 None
None
MRD  B 301 (-3.4A)
None
 1.31A 3r0lD-5wybB:
undetectable		 3r0lD-5wybB:
undetectable
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.
3R58_A_NPSA332_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C3)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		5 / 10 TYR A  55
HIS A 117
ASN A 167
TYR A 216
PRO A 318
 NAD  A 327 ( 4.7A)
MRD  A 328 ( 3.9A)
NAD  A 327 (-3.3A)
NAD  A 327 (-3.4A)
None
 0.35A 3r58A-3ln3A:
47.7		 3r58A-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
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3R8G_A_IZPA409_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C3)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		5 / 9 TYR A  55
HIS A 117
ASN A 167
TYR A 216
PRO A 318
 NAD  A 327 ( 4.7A)
MRD  A 328 ( 3.9A)
NAD  A 327 (-3.3A)
NAD  A 327 (-3.4A)
None
 0.36A 3r8gA-3ln3A:
47.6		 3r8gA-3ln3A:
64.71
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3R94_A_FLRA332_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C3)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		5 / 12 TYR A  55
HIS A 117
ASN A 167
TYR A 216
PRO A 318
 NAD  A 327 ( 4.7A)
MRD  A 328 ( 3.9A)
NAD  A 327 (-3.3A)
NAD  A 327 (-3.4A)
None
 0.44A 3r94A-3ln3A:
47.5		 3r94A-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.
3R9T_C_BEZC264_0
(ECHA1_1)		 5wyb PROBABLE ENOYL-COA
HYDRATASE/ISOMERASE
(Pseudomonas
aeruginosa) 		4 / 5 ALA B  78
GLU B 126
GLU B 146
ALA B 155
 MRD  B 301 (-3.1A)
MRD  B 301 (-2.8A)
MRD  B 301 (-2.5A)
MRD  B 301 (-4.2A)
 0.66A 3r9tC-5wybB:
28.8		 3r9tC-5wybB:
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.
3RQJ_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 3rqjA-2vy0A:
undetectable
3rqjB-2vy0A:
undetectable		 3rqjA-2vy0A:
20.00
3rqjB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3RQJ_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 3rqjA-2vy0A:
undetectable
3rqjB-2vy0A:
undetectable		 3rqjA-2vy0A:
20.00
3rqjB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3RQK_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 3rqkA-2vy0A:
undetectable
3rqkB-2vy0A:
undetectable		 3rqkA-2vy0A:
20.00
3rqkB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3RQK_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 3rqkA-2vy0A:
undetectable
3rqkB-2vy0A:
undetectable		 3rqkA-2vy0A:
20.00
3rqkB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3RQL_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 3rqlA-2vy0A:
undetectable
3rqlB-2vy0A:
undetectable		 3rqlA-2vy0A:
20.00
3rqlB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3RQM_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 3rqmA-2vy0A:
undetectable
3rqmB-2vy0A:
undetectable		 3rqmA-2vy0A:
20.00
3rqmB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3RQM_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 3rqmA-2vy0A:
undetectable
3rqmB-2vy0A:
undetectable		 3rqmA-2vy0A:
20.00
3rqmB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3RQN_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 3rqnA-2vy0A:
undetectable
3rqnB-2vy0A:
undetectable		 3rqnA-2vy0A:
20.00
3rqnB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3RQN_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 3rqnA-2vy0A:
undetectable
3rqnB-2vy0A:
undetectable		 3rqnA-2vy0A:
20.00
3rqnB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3SVP_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.46A 3svpA-2vy0A:
undetectable
3svpB-2vy0A:
undetectable		 3svpA-2vy0A:
20.00
3svpB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3SVP_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 3svpA-2vy0A:
undetectable
3svpB-2vy0A:
undetectable		 3svpA-2vy0A:
20.00
3svpB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3SVQ_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.46A 3svqA-2vy0A:
undetectable
3svqB-2vy0A:
undetectable		 3svqA-2vy0A:
20.00
3svqB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3SVQ_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.45A 3svqA-2vy0A:
undetectable
3svqB-2vy0A:
undetectable		 3svqA-2vy0A:
20.00
3svqB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3T3Q_A_9PLA501_1
(CYTOCHROME P450 2A6)		 3wz4 DOTI
(Legionella
pneumophila) 		5 / 10 PHE A 202
PHE A 116
PHE A 108
PHE A  90
ALA A  88
 None
None
None
MRD  A 502 (-4.1A)
None
 1.28A 3t3qA-3wz4A:
undetectable		 3t3qA-3wz4A:
12.18
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.
3T3S_B_9PLB1_1
(CYTOCHROME P450 2A13)		 3nqn UNCHARACTERIZED
PROTEIN
(Deinococcus
radiodurans) 		4 / 6 PHE A 108
PHE A 106
ALA A 105
THR A  97
 MRD  A 161 ( 4.7A)
None
MRD  A 163 (-3.8A)
MRD  A 163 ( 3.7A)
 1.11A 3t3sB-3nqnA:
undetectable		 3t3sB-3nqnA:
15.91
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.
3T3S_D_9PLD1_1
(CYTOCHROME P450 2A13)		 1n2m PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE
(Methanocaldococc
us
jannaschii) 		4 / 8 PHE A  34
ALA A  41
ALA A 159
THR A  75
 MRD  A7006 ( 3.9A)
None
None
None
 0.94A 3t3sD-1n2mA:
undetectable		 3t3sD-1n2mA:
15.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3T3Z_A_9PLA501_1
(CYTOCHROME P450 2E1)		 3nqn UNCHARACTERIZED
PROTEIN
(Deinococcus
radiodurans) 		4 / 6 PHE A 108
LEU A  37
ALA A  30
LEU A  78
 MRD  A 161 ( 4.7A)
None
MRD  A 161 (-3.2A)
MRD  A 161 ( 4.5A)
 0.92A 3t3zA-3nqnA:
undetectable		 3t3zA-3nqnA:
16.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3T3Z_B_9PLB501_1
(CYTOCHROME P450 2E1)		 3nqn UNCHARACTERIZED
PROTEIN
(Deinococcus
radiodurans) 		4 / 6 PHE A 108
LEU A  37
ALA A  30
LEU A  78
 MRD  A 161 ( 4.7A)
None
MRD  A 161 (-3.2A)
MRD  A 161 ( 4.5A)
 0.94A 3t3zB-3nqnA:
undetectable		 3t3zB-3nqnA:
16.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3T3Z_D_9PLD501_1
(CYTOCHROME P450 2E1)		 3nqn UNCHARACTERIZED
PROTEIN
(Deinococcus
radiodurans) 		4 / 6 PHE A 108
LEU A  37
ALA A  30
LEU A  78
 MRD  A 161 ( 4.7A)
None
MRD  A 161 (-3.2A)
MRD  A 161 ( 4.5A)
 0.94A 3t3zD-3nqnA:
undetectable		 3t3zD-3nqnA:
16.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3TYL_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 3tylA-2vy0A:
undetectable
3tylB-2vy0A:
undetectable		 3tylA-2vy0A:
20.00
3tylB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3TYL_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 3tylA-2vy0A:
undetectable
3tylB-2vy0A:
undetectable		 3tylA-2vy0A:
20.00
3tylB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3TYM_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 3tymA-2vy0A:
undetectable
3tymB-2vy0A:
undetectable		 3tymA-2vy0A:
20.00
3tymB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3TYM_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 3tymA-2vy0A:
undetectable
3tymB-2vy0A:
undetectable		 3tymA-2vy0A:
20.00
3tymB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3TYN_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 3tynA-2vy0A:
undetectable
3tynB-2vy0A:
undetectable		 3tynA-2vy0A:
20.00
3tynB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3TYN_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 3tynA-2vy0A:
undetectable
3tynB-2vy0A:
undetectable		 3tynA-2vy0A:
20.00
3tynB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3TYO_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 3tyoA-2vy0A:
undetectable
3tyoB-2vy0A:
undetectable		 3tyoA-2vy0A:
20.00
3tyoB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3TYO_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.45A 3tyoA-2vy0A:
undetectable
3tyoB-2vy0A:
undetectable		 3tyoA-2vy0A:
20.00
3tyoB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3UFO_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.45A 3ufoA-2vy0A:
undetectable
3ufoB-2vy0A:
undetectable		 3ufoA-2vy0A:
20.00
3ufoB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3UFP_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.48A 3ufpA-2vy0A:
undetectable
3ufpB-2vy0A:
undetectable		 3ufpA-2vy0A:
20.00
3ufpB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3UFQ_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.46A 3ufqA-2vy0A:
undetectable
3ufqB-2vy0A:
undetectable		 3ufqA-2vy0A:
20.00
3ufqB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3UFQ_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 3ufqA-2vy0A:
undetectable
3ufqB-2vy0A:
undetectable		 3ufqA-2vy0A:
20.00
3ufqB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3UFR_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.47A 3ufrA-2vy0A:
undetectable
3ufrB-2vy0A:
undetectable		 3ufrA-2vy0A:
20.00
3ufrB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3UFS_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.46A 3ufsA-2vy0A:
undetectable
3ufsB-2vy0A:
undetectable		 3ufsA-2vy0A:
20.00
3ufsB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3UFS_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.45A 3ufsA-2vy0A:
undetectable
3ufsB-2vy0A:
undetectable		 3ufsA-2vy0A:
20.00
3ufsB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3UFT_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 3uftA-2vy0A:
undetectable
3uftB-2vy0A:
undetectable		 3uftA-2vy0A:
20.00
3uftB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3UFT_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 3uftA-2vy0A:
undetectable
3uftB-2vy0A:
undetectable		 3uftA-2vy0A:
20.00
3uftB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3UFU_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 3ufuA-2vy0A:
undetectable
3ufuB-2vy0A:
undetectable		 3ufuA-2vy0A:
20.00
3ufuB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3UFU_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 3ufuA-2vy0A:
undetectable
3ufuB-2vy0A:
undetectable		 3ufuA-2vy0A:
20.00
3ufuB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3UFV_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 3ufvA-2vy0A:
undetectable
3ufvB-2vy0A:
undetectable		 3ufvA-2vy0A:
20.00
3ufvB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3UFV_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 3ufvA-2vy0A:
undetectable
3ufvB-2vy0A:
undetectable		 3ufvA-2vy0A:
20.00
3ufvB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3UFW_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.47A 3ufwA-2vy0A:
undetectable
3ufwB-2vy0A:
undetectable		 3ufwA-2vy0A:
20.00
3ufwB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3UFW_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 3ufwA-2vy0A:
undetectable
3ufwB-2vy0A:
undetectable		 3ufwA-2vy0A:
20.00
3ufwB-2vy0A:
20.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3UG8_A_IMNA2001_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C3)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		6 / 12 TYR A  55
TRP A  86
HIS A 117
ASN A 167
TYR A 216
PRO A 318
 NAD  A 327 ( 4.7A)
None
MRD  A 328 ( 3.9A)
NAD  A 327 (-3.3A)
NAD  A 327 (-3.4A)
None
 0.43A 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.
3V81_A_NVPA901_1
(HIV-1 REVERSE
TRANSCRIPTASE P66
SUBUNIT)		 1g1s P-SELECTIN
(Homo
sapiens) 		4 / 8 VAL A  27
TYR A  49
TYR A   5
TYR A  37
 MRD  A 807 ( 4.7A)
None
None
None
 1.11A 3v81A-1g1sA:
undetectable		 3v81A-1g1sA:
13.49
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.
3V81_A_NVPA901_1
(HIV-1 REVERSE
TRANSCRIPTASE P66
SUBUNIT)		 4mkn TRIOSEPHOSPHATE
ISOMERASE
(Chlamydomonas
reinhardtii) 		4 / 8 LEU A 164
VAL A 186
TYR A 193
LEU A 206
 None
MRD  A 304 ( 4.2A)
None
None
 1.10A 3v81A-4mknA:
1.5		 3v81A-4mknA:
19.49
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.
3W9T_D_W9TD506_1
(HEMOLYTIC LECTIN
CEL-III)		 4qfu GLYCOSIDE HYDROLASE
FAMILY 5
(Bacteroides
vulgatus) 		4 / 5 ASP A 280
GLU A 282
GLY A 239
TYR A 308
 None
MRD  A 501 (-2.7A)
None
None
 1.42A 3w9tD-4qfuA:
undetectable		 3w9tD-4qfuA:
20.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ZQ8_D_DVAD8_0
(VAL-GRAMICIDIN A)		 1g1s P-SELECTIN
(Homo
sapiens) 		3 / 3 TRP A  50
VAL A  27
TRP A  12
 None
MRD  A 807 ( 4.7A)
None
 1.06A 3zq8C-1g1sA:
undetectable
3zq8D-1g1sA:
undetectable		 3zq8C-1g1sA:
9.00
3zq8D-1g1sA:
9.00
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.
4AZV_A_SAMA1474_0
(WBDD)		 3uwa RIIA-RIIB
MEMBRANE-ASSOCIATED
PROTEIN
(Synechococcus
phage
S-SSM7) 		5 / 12 ILE A 136
PHE A 112
ILE A  57
VAL A  59
HIS A  71
 None
None
None
None
MRD  A 201 (-4.2A)
 0.99A 4azvA-3uwaA:
undetectable		 4azvA-3uwaA:
15.07
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.
4C39_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 4c39A-2vy0A:
undetectable
4c39B-2vy0A:
undetectable		 4c39A-2vy0A:
20.00
4c39B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4C39_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 4c39A-2vy0A:
undetectable
4c39B-2vy0A:
undetectable		 4c39A-2vy0A:
20.00
4c39B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4C5N_B_PXLB300_1
(PHOSPHOMETHYLPYRIMID
INE KINASE)		 3gzb PUTATIVE SNOAL-LIKE
POLYKETIDE CYCLASE
(Shewanella
putrefaciens) 		5 / 10 GLY A 103
GLY A 105
VAL A  76
HIS A  73
VAL A 117
 None
None
None
MRD  A 154 (-4.0A)
None
 1.32A 4c5nB-3gzbA:
undetectable		 4c5nB-3gzbA:
19.71
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.
4CAM_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 4camA-2vy0A:
undetectable
4camB-2vy0A:
undetectable		 4camA-2vy0A:
20.00
4camB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CAN_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 4canA-2vy0A:
undetectable
4canB-2vy0A:
undetectable		 4canA-2vy0A:
20.00
4canB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CAO_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.47A 4caoA-2vy0A:
undetectable
4caoB-2vy0A:
undetectable		 4caoA-2vy0A:
20.00
4caoB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CAP_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.47A 4capA-2vy0A:
undetectable
4capB-2vy0A:
undetectable		 4capA-2vy0A:
20.00
4capB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CAQ_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 4caqA-2vy0A:
undetectable
4caqB-2vy0A:
undetectable		 4caqA-2vy0A:
20.00
4caqB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CAQ_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 4caqA-2vy0A:
undetectable
4caqB-2vy0A:
undetectable		 4caqA-2vy0A:
20.00
4caqB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CDT_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.48A 4cdtA-2vy0A:
undetectable
4cdtB-2vy0A:
undetectable		 4cdtA-2vy0A:
20.00
4cdtB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CDT_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.46A 4cdtA-2vy0A:
undetectable
4cdtB-2vy0A:
undetectable		 4cdtA-2vy0A:
20.00
4cdtB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CTP_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 4ctpA-2vy0A:
undetectable
4ctpB-2vy0A:
undetectable		 4ctpA-2vy0A:
20.00
4ctpB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CTQ_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.46A 4ctqA-2vy0A:
undetectable
4ctqB-2vy0A:
undetectable		 4ctqA-2vy0A:
20.00
4ctqB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CTQ_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 4ctqA-2vy0A:
undetectable
4ctqB-2vy0A:
undetectable		 4ctqA-2vy0A:
20.00
4ctqB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CTR_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 4ctrA-2vy0A:
undetectable
4ctrB-2vy0A:
undetectable		 4ctrA-2vy0A:
20.00
4ctrB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CTR_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.45A 4ctrA-2vy0A:
undetectable
4ctrB-2vy0A:
undetectable		 4ctrA-2vy0A:
20.00
4ctrB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CTT_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.46A 4cttA-2vy0A:
undetectable
4cttB-2vy0A:
undetectable		 4cttA-2vy0A:
20.00
4cttB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CTT_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.45A 4cttA-2vy0A:
undetectable
4cttB-2vy0A:
undetectable		 4cttA-2vy0A:
20.00
4cttB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CTU_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 4ctuA-2vy0A:
undetectable
4ctuB-2vy0A:
undetectable		 4ctuA-2vy0A:
20.00
4ctuB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CTU_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 4ctuA-2vy0A:
undetectable
4ctuB-2vy0A:
undetectable		 4ctuA-2vy0A:
20.00
4ctuB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CTV_B_H4BB1720_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.45A 4ctvA-2vy0A:
undetectable
4ctvB-2vy0A:
undetectable		 4ctvA-2vy0A:
20.00
4ctvB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CTW_A_H4BA1718_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.46A 4ctwA-2vy0A:
undetectable
4ctwB-2vy0A:
undetectable		 4ctwA-2vy0A:
20.00
4ctwB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CTW_B_H4BB1720_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 4ctwA-2vy0A:
undetectable
4ctwB-2vy0A:
undetectable		 4ctwA-2vy0A:
20.00
4ctwB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CTX_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 4ctxA-2vy0A:
undetectable
4ctxB-2vy0A:
undetectable		 4ctxA-2vy0A:
20.00
4ctxB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CTX_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.45A 4ctxA-2vy0A:
undetectable
4ctxB-2vy0A:
undetectable		 4ctxA-2vy0A:
20.00
4ctxB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CX5_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 4cx5A-2vy0A:
undetectable
4cx5B-2vy0A:
undetectable		 4cx5A-2vy0A:
20.00
4cx5B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CX5_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 4cx5A-2vy0A:
undetectable
4cx5B-2vy0A:
undetectable		 4cx5A-2vy0A:
20.00
4cx5B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CX6_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 4cx6A-2vy0A:
undetectable
4cx6B-2vy0A:
undetectable		 4cx6A-2vy0A:
20.00
4cx6B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CX6_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 4cx6A-2vy0A:
undetectable
4cx6B-2vy0A:
undetectable		 4cx6A-2vy0A:
20.00
4cx6B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4D1N_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.41A 4d1nA-2vy0A:
undetectable
4d1nB-2vy0A:
undetectable		 4d1nA-2vy0A:
20.28
4d1nB-2vy0A:
20.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4D1N_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 4d1nA-2vy0A:
undetectable
4d1nB-2vy0A:
undetectable		 4d1nA-2vy0A:
20.28
4d1nB-2vy0A:
20.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4D1N_C_H4BC760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.42A 4d1nC-2vy0A:
undetectable
4d1nD-2vy0A:
undetectable		 4d1nC-2vy0A:
20.28
4d1nD-2vy0A:
20.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4D1N_D_H4BD760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 4d1nC-2vy0A:
undetectable
4d1nD-2vy0A:
undetectable		 4d1nC-2vy0A:
20.28
4d1nD-2vy0A:
20.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4D2Y_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.42A 4d2yA-2vy0A:
undetectable
4d2yB-2vy0A:
undetectable		 4d2yA-2vy0A:
20.00
4d2yB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4D2Y_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 4d2yA-2vy0A:
undetectable
4d2yB-2vy0A:
undetectable		 4d2yA-2vy0A:
20.00
4d2yB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4D2Z_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 4d2zA-2vy0A:
undetectable
4d2zB-2vy0A:
undetectable		 4d2zA-2vy0A:
20.00
4d2zB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4D2Z_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 4d2zA-2vy0A:
undetectable
4d2zB-2vy0A:
undetectable		 4d2zA-2vy0A:
20.00
4d2zB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4D30_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.42A 4d30A-2vy0A:
undetectable
4d30B-2vy0A:
undetectable		 4d30A-2vy0A:
20.00
4d30B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4D30_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 4d30A-2vy0A:
undetectable
4d30B-2vy0A:
undetectable		 4d30A-2vy0A:
20.00
4d30B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4D31_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.43A 4d31A-2vy0A:
undetectable
4d31B-2vy0A:
undetectable		 4d31A-2vy0A:
20.00
4d31B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4D31_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 4d31A-2vy0A:
undetectable
4d31B-2vy0A:
undetectable		 4d31A-2vy0A:
20.00
4d31B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4D32_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.46A 4d32A-2vy0A:
undetectable
4d32B-2vy0A:
undetectable		 4d32A-2vy0A:
20.00
4d32B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4D3B_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.42A 4d3bA-2vy0A:
undetectable
4d3bB-2vy0A:
undetectable		 4d3bA-2vy0A:
20.00
4d3bB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4D3B_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 4d3bA-2vy0A:
undetectable
4d3bB-2vy0A:
undetectable		 4d3bA-2vy0A:
20.00
4d3bB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4D7O_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.43A 4d7oA-2vy0A:
undetectable
4d7oB-2vy0A:
undetectable		 4d7oA-2vy0A:
20.00
4d7oB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4D7O_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 4d7oA-2vy0A:
undetectable
4d7oB-2vy0A:
undetectable		 4d7oA-2vy0A:
20.00
4d7oB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4DX7_B_DM2B1104_1
(ACRIFLAVINE
RESISTANCE PROTEIN B)		 4qfu GLYCOSIDE HYDROLASE
FAMILY 5
(Bacteroides
vulgatus) 		4 / 8 GLN A  90
GLN A 237
ILE A 288
PHE A 339
 MRD  A 502 (-3.1A)
MRD  A 501 (-3.8A)
None
MRD  A 502 (-4.6A)
 0.94A 4dx7B-4qfuA:
undetectable		 4dx7B-4qfuA:
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.
4EB6_C_VLBC503_1
(TUBULIN BETA CHAIN
TUBULIN ALPHA CHAIN)		 2ixb ALPHA-N-ACETYLGALACT
OSAMINIDASE
(Elizabethkingia
meningoseptica) 		5 / 12 ASP A  44
TYR A 444
TYR A 377
VAL A  21
ILE A  23
 None
MRD  A1447 (-4.6A)
None
None
None
 1.42A 4eb6B-2ixbA:
undetectable
4eb6C-2ixbA:
3.6		 4eb6B-2ixbA:
20.66
4eb6C-2ixbA:
21.58
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.
4EUX_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 4euxA-2vy0A:
undetectable
4euxB-2vy0A:
undetectable		 4euxA-2vy0A:
20.00
4euxB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4EUX_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.41A 4euxA-2vy0A:
undetectable
4euxB-2vy0A:
undetectable		 4euxA-2vy0A:
20.00
4euxB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FVW_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 4fvwA-2vy0A:
undetectable
4fvwB-2vy0A:
undetectable		 4fvwA-2vy0A:
20.00
4fvwB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FVW_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 4fvwA-2vy0A:
undetectable
4fvwB-2vy0A:
undetectable		 4fvwA-2vy0A:
20.00
4fvwB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FVX_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 4fvxA-2vy0A:
undetectable
4fvxB-2vy0A:
undetectable		 4fvxA-2vy0A:
20.00
4fvxB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FVY_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.43A 4fvyA-2vy0A:
undetectable
4fvyB-2vy0A:
undetectable		 4fvyA-2vy0A:
20.00
4fvyB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FVY_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 4fvyA-2vy0A:
undetectable
4fvyB-2vy0A:
undetectable		 4fvyA-2vy0A:
20.00
4fvyB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FVZ_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.39A 4fvzA-2vy0A:
undetectable
4fvzB-2vy0A:
undetectable		 4fvzA-2vy0A:
20.00
4fvzB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FVZ_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 4fvzA-2vy0A:
undetectable
4fvzB-2vy0A:
undetectable		 4fvzA-2vy0A:
20.00
4fvzB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FW0_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 4fw0A-2vy0A:
undetectable
4fw0B-2vy0A:
undetectable		 4fw0A-2vy0A:
20.00
4fw0B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FW0_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 4fw0A-2vy0A:
undetectable
4fw0B-2vy0A:
undetectable		 4fw0A-2vy0A:
20.00
4fw0B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4GQE_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 4gqeA-2vy0A:
undetectable
4gqeB-2vy0A:
undetectable		 4gqeA-2vy0A:
20.00
4gqeB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4GQE_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 4gqeA-2vy0A:
undetectable
4gqeB-2vy0A:
undetectable		 4gqeA-2vy0A:
20.00
4gqeB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4H9M_A_HAEA929_1
(UREASE)		 3gg7 UNCHARACTERIZED
METALLOPROTEIN
(Deinococcus
radiodurans) 		4 / 5 HIS A   5
HIS A  58
HIS A 122
ASP A 194
 MN  A 253 (-3.3A)
MRD  A 257 (-3.5A)
None
MN  A 253 (-2.7A)
 0.66A 4h9mA-3gg7A:
5.7		 4h9mA-3gg7A:
14.23
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.
4HXY_B_ACAB502_1
(PLM1)		 1iy8 LEVODIONE REDUCTASE
(Leifsonia
aquatica) 		4 / 7 SER A 152
GLN A 162
TYR A 165
MET A 202
 NAD  A1268 (-2.5A)
MRD  A1269 (-3.7A)
MRD  A1269 ( 3.9A)
NAD  A1268 (-3.5A)
 0.62A 4hxyB-1iy8A:
19.7		 4hxyB-1iy8A:
22.80
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.
4IMT_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.43A 4imtA-2vy0A:
undetectable
4imtB-2vy0A:
undetectable		 4imtA-2vy0A:
20.00
4imtB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4IMT_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 4imtA-2vy0A:
undetectable
4imtB-2vy0A:
undetectable		 4imtA-2vy0A:
20.00
4imtB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4IMU_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 4imuA-2vy0A:
undetectable
4imuB-2vy0A:
undetectable		 4imuA-2vy0A:
20.00
4imuB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4IMU_A_H4BA809_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 4imuA-2vy0A:
0.0
4imuB-2vy0A:
0.0		 4imuA-2vy0A:
20.00
4imuB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4IMW_A_H4BA805_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.45A 4imwA-2vy0A:
undetectable
4imwB-2vy0A:
undetectable		 4imwA-2vy0A:
20.00
4imwB-2vy0A:
20.00
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.
4JQ1_B_NPSB401_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C2)		 3ln3 DIHYDRODIOL
DEHYDROGENASE
(Mus
musculus) 		4 / 8 TYR A  55
TRP A  86
HIS A 117
TRP A 227
 NAD  A 327 ( 4.7A)
None
MRD  A 328 ( 3.9A)
MRD  A 328 (-4.0A)
 0.68A 4jq1B-3ln3A:
50.4		 4jq1B-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
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4JSE_A_H4BA804_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.43A 4jseA-2vy0A:
undetectable
4jseB-2vy0A:
undetectable		 4jseA-2vy0A:
20.00
4jseB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4JSE_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 4jseA-2vy0A:
undetectable
4jseB-2vy0A:
undetectable		 4jseA-2vy0A:
20.00
4jseB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4JSF_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 4jsfA-2vy0A:
undetectable
4jsfB-2vy0A:
undetectable		 4jsfA-2vy0A:
20.00
4jsfB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4JSF_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 4jsfA-2vy0A:
undetectable
4jsfB-2vy0A:
undetectable		 4jsfA-2vy0A:
20.00
4jsfB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4JSG_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 4jsgA-2vy0A:
undetectable
4jsgB-2vy0A:
undetectable		 4jsgA-2vy0A:
20.00
4jsgB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4JSG_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 4jsgA-2vy0A:
undetectable
4jsgB-2vy0A:
undetectable		 4jsgA-2vy0A:
20.00
4jsgB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4JSH_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.46A 4jshA-2vy0A:
undetectable
4jshB-2vy0A:
undetectable		 4jshA-2vy0A:
20.00
4jshB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4JSH_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.46A 4jshA-2vy0A:
undetectable
4jshB-2vy0A:
undetectable		 4jshA-2vy0A:
20.00
4jshB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4JSI_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 4jsiA-2vy0A:
undetectable
4jsiB-2vy0A:
undetectable		 4jsiA-2vy0A:
20.00
4jsiB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4JSJ_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 4jsjA-2vy0A:
undetectable
4jsjB-2vy0A:
undetectable		 4jsjA-2vy0A:
20.00
4jsjB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4JSJ_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 4jsjA-2vy0A:
undetectable
4jsjB-2vy0A:
undetectable		 4jsjA-2vy0A:
20.00
4jsjB-2vy0A:
20.00
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.
4K5D_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.46A 4k5dA-2vy0A:
undetectable
4k5dB-2vy0A:
undetectable		 4k5dA-2vy0A:
20.00
4k5dB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K5D_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 4k5dA-2vy0A:
undetectable
4k5dB-2vy0A:
undetectable		 4k5dA-2vy0A:
20.00
4k5dB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K5E_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.43A 4k5eA-2vy0A:
undetectable
4k5eB-2vy0A:
undetectable		 4k5eA-2vy0A:
20.00
4k5eB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K5E_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 4k5eA-2vy0A:
undetectable
4k5eB-2vy0A:
undetectable		 4k5eA-2vy0A:
20.00
4k5eB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K5F_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 4k5fA-2vy0A:
undetectable
4k5fB-2vy0A:
undetectable		 4k5fA-2vy0A:
20.00
4k5fB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K5F_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 4k5fA-2vy0A:
undetectable
4k5fB-2vy0A:
undetectable		 4k5fA-2vy0A:
20.00
4k5fB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K5G_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 4k5gA-2vy0A:
undetectable
4k5gB-2vy0A:
undetectable		 4k5gA-2vy0A:
20.00
4k5gB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K5G_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 4k5gA-2vy0A:
undetectable
4k5gB-2vy0A:
undetectable		 4k5gA-2vy0A:
20.00
4k5gB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KCH_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 4kchA-2vy0A:
undetectable
4kchB-2vy0A:
undetectable		 4kchA-2vy0A:
20.00
4kchB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KCH_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 4kchA-2vy0A:
undetectable
4kchB-2vy0A:
undetectable		 4kchA-2vy0A:
20.00
4kchB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KCI_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 4kciA-2vy0A:
undetectable
4kciB-2vy0A:
undetectable		 4kciA-2vy0A:
20.00
4kciB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KCI_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 4kciA-2vy0A:
undetectable
4kciB-2vy0A:
undetectable		 4kciA-2vy0A:
20.00
4kciB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KCJ_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.43A 4kcjA-2vy0A:
undetectable
4kcjB-2vy0A:
undetectable		 4kcjA-2vy0A:
20.00
4kcjB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KCJ_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 4kcjA-2vy0A:
undetectable
4kcjB-2vy0A:
undetectable		 4kcjA-2vy0A:
20.00
4kcjB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KCK_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.43A 4kckA-2vy0A:
undetectable
4kckB-2vy0A:
undetectable		 4kckA-2vy0A:
20.00
4kckB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KCK_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.47A 4kckA-2vy0A:
undetectable
4kckB-2vy0A:
undetectable		 4kckA-2vy0A:
20.00
4kckB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KCL_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.46A 4kclA-2vy0A:
undetectable
4kclB-2vy0A:
undetectable		 4kclA-2vy0A:
20.00
4kclB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KCL_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.45A 4kclA-2vy0A:
undetectable
4kclB-2vy0A:
undetectable		 4kclA-2vy0A:
20.00
4kclB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KCM_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 4kcmA-2vy0A:
undetectable
4kcmB-2vy0A:
undetectable		 4kcmA-2vy0A:
20.00
4kcmB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KCM_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 4kcmA-2vy0A:
undetectable
4kcmB-2vy0A:
undetectable		 4kcmA-2vy0A:
20.00
4kcmB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KCN_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 4kcnA-2vy0A:
undetectable
4kcnB-2vy0A:
undetectable		 4kcnA-2vy0A:
20.00
4kcnB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KCN_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.45A 4kcnA-2vy0A:
undetectable
4kcnB-2vy0A:
undetectable		 4kcnA-2vy0A:
20.00
4kcnB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KCO_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 4kcoA-2vy0A:
undetectable
4kcoB-2vy0A:
undetectable		 4kcoA-2vy0A:
20.00
4kcoB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KCO_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 4kcoA-2vy0A:
undetectable
4kcoB-2vy0A:
undetectable		 4kcoA-2vy0A:
20.00
4kcoB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4LUX_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.46A 4luxA-2vy0A:
undetectable
4luxB-2vy0A:
undetectable		 4luxA-2vy0A:
20.00
4luxB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4LUX_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 4luxA-2vy0A:
undetectable
4luxB-2vy0A:
undetectable		 4luxA-2vy0A:
20.00
4luxB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4LVC_A_ADNA501_2
(S-ADENOSYL-L-HOMOCYS
TEINE HYDROLASE
(SAHASE))		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		4 / 5 GLN A 111
THR A 110
THR A  81
HIS A 120
 None
None
MRD  A 301 ( 4.2A)
MRD  A 301 ( 4.8A)
 1.29A 4lvcA-4nq1A:
undetectable		 4lvcA-4nq1A:
22.89
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.
4LVC_C_ADNC501_2
(S-ADENOSYL-L-HOMOCYS
TEINE HYDROLASE
(SAHASE))		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		4 / 5 GLN A 111
THR A 110
THR A  81
HIS A 120
 None
None
MRD  A 301 ( 4.2A)
MRD  A 301 ( 4.8A)
 1.29A 4lvcC-4nq1A:
undetectable		 4lvcC-4nq1A:
22.89
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.
4MJR_A_0LAA404_1
(DNA POLYMERASE III
SUBUNIT BETA)		 5w7z DNA POLYMERASE III
SUBUNIT BETA
(Rickettsia
conorii) 		7 / 9 ARG A 152
THR A 172
GLY A 174
LEU A 177
PRO A 246
VAL A 373
MET A 375
 None
MRD  A 403 (-3.1A)
MRD  A 403 (-3.8A)
MRD  A 403 ( 4.0A)
None
MRD  A 403 ( 4.7A)
MRD  A 403 ( 4.5A)
 0.96A 4mjrA-5w7zA:
41.7		 4mjrA-5w7zA:
29.97
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.
4O4D_A_ACTA406_0
(INOSITOL
HEXAKISPHOSPHATE
KINASE)		 2mcm MACROMOMYCIN
(Streptomyces
macromomyceticus) 		4 / 7 ASP A  47
THR A  50
PHE A  72
HIS A  69
 None
MRD  A 115 (-4.3A)
None
None
 1.13A 4o4dA-2mcmA:
undetectable		 4o4dA-2mcmA:
15.85
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.
4Q15_B_HFGB803_0
(PROLINE--TRNA LIGASE)		 2mcm MACROMOMYCIN
(Streptomyces
macromomyceticus) 		5 / 12 PRO A  27
THR A  26
GLU A 103
SER A 101
GLY A  98
 None
None
None
None
MRD  A 113 ( 4.3A)
 1.28A 4q15B-2mcmA:
undetectable		 4q15B-2mcmA:
10.56
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.
4TWD_C_377C401_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 4a56 PULLULANASE
SECRETION PROTEIN
PULS
(Klebsiella
oxytoca) 		4 / 6 ASN A  54
GLU A 103
TYR A  48
LEU A  49
 MRD  A1123 (-4.3A)
None
None
None
 1.18A 4twdB-4a56A:
undetectable
4twdC-4a56A:
undetectable		 4twdB-4a56A:
15.73
4twdC-4a56A:
15.73
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.
4TWD_E_377E401_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 4a56 PULLULANASE
SECRETION PROTEIN
PULS
(Klebsiella
oxytoca) 		4 / 6 ASN A  54
GLU A 103
TYR A  48
LEU A  49
 MRD  A1123 (-4.3A)
None
None
None
 1.15A 4twdD-4a56A:
undetectable
4twdE-4a56A:
undetectable		 4twdD-4a56A:
15.73
4twdE-4a56A:
15.73
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.
4TWD_J_377J401_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 4a56 PULLULANASE
SECRETION PROTEIN
PULS
(Klebsiella
oxytoca) 		4 / 6 ASN A  54
GLU A 103
TYR A  48
LEU A  49
 MRD  A1123 (-4.3A)
None
None
None
 1.27A 4twdI-4a56A:
undetectable
4twdJ-4a56A:
undetectable		 4twdI-4a56A:
15.73
4twdJ-4a56A:
15.73
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.
4UBP_C_HAEC800_1
(PROTEIN (UREASE
(CHAIN C)))		 3gg7 UNCHARACTERIZED
METALLOPROTEIN
(Deinococcus
radiodurans) 		5 / 6 HIS A   5
HIS A   7
HIS A  58
HIS A 122
ASP A 194
 MN  A 253 (-3.3A)
MN  A 253 (-3.3A)
MRD  A 257 (-3.5A)
None
MN  A 253 (-2.7A)
 0.67A 4ubpC-3gg7A:
9.8		 4ubpC-3gg7A:
17.80
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.
4UCH_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.43A 4uchA-2vy0A:
undetectable
4uchB-2vy0A:
undetectable		 4uchA-2vy0A:
20.23
4uchB-2vy0A:
20.23
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.
4UCH_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 8 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.41A 4uchA-2vy0A:
undetectable
4uchB-2vy0A:
undetectable		 4uchA-2vy0A:
20.23
4uchB-2vy0A:
20.23
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.
4UDC_A_DEXA1778_2
(GLUCOCORTICOID
RECEPTOR)		 1hww ALPHA-MANNOSIDASE II
(Drosophila
melanogaster) 		3 / 3 MET A 264
GLN A  64
TYR A 231
 None
MRD  A1104 (-3.5A)
None
 1.11A 4udcA-1hwwA:
undetectable		 4udcA-1hwwA:
13.50
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.
4UGZ_A_H4BA760_1
(NEURONAL NITRIC
OXIDE SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.42A 4ugzA-2vy0A:
undetectable
4ugzB-2vy0A:
undetectable		 4ugzA-2vy0A:
20.00
4ugzB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UGZ_B_H4BB760_1
(NEURONAL NITRIC
OXIDE SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 4ugzA-2vy0A:
undetectable
4ugzB-2vy0A:
undetectable		 4ugzA-2vy0A:
20.00
4ugzB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UH0_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 4uh0A-2vy0A:
undetectable
4uh0B-2vy0A:
undetectable		 4uh0A-2vy0A:
20.00
4uh0B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UH0_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.45A 4uh0A-2vy0A:
undetectable
4uh0B-2vy0A:
undetectable		 4uh0A-2vy0A:
20.00
4uh0B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UH1_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 4uh1A-2vy0A:
undetectable
4uh1B-2vy0A:
undetectable		 4uh1A-2vy0A:
20.00
4uh1B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UH1_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 4uh1A-2vy0A:
undetectable
4uh1B-2vy0A:
undetectable		 4uh1A-2vy0A:
20.00
4uh1B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UH2_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 4uh2A-2vy0A:
undetectable
4uh2B-2vy0A:
undetectable		 4uh2A-2vy0A:
20.00
4uh2B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UH2_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 4uh2A-2vy0A:
undetectable
4uh2B-2vy0A:
undetectable		 4uh2A-2vy0A:
20.00
4uh2B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UH3_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.43A 4uh3A-2vy0A:
undetectable
4uh3B-2vy0A:
undetectable		 4uh3A-2vy0A:
20.00
4uh3B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UH3_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.41A 4uh3A-2vy0A:
undetectable
4uh3B-2vy0A:
undetectable		 4uh3A-2vy0A:
20.00
4uh3B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UH4_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 4uh4A-2vy0A:
undetectable
4uh4B-2vy0A:
undetectable		 4uh4A-2vy0A:
20.00
4uh4B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UH4_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 4uh4A-2vy0A:
undetectable
4uh4B-2vy0A:
undetectable		 4uh4A-2vy0A:
20.00
4uh4B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UH5_A_H4BA760_1
(NEURONAL NITRIC
OXIDE SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.43A 4uh5A-2vy0A:
undetectable
4uh5B-2vy0A:
undetectable		 4uh5A-2vy0A:
20.05
4uh5B-2vy0A:
20.05
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.
4UH5_B_H4BB760_1
(NEURONAL NITRIC
OXIDE SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 4uh5A-2vy0A:
undetectable
4uh5B-2vy0A:
undetectable		 4uh5A-2vy0A:
20.05
4uh5B-2vy0A:
20.05
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.
4UH6_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.42A 4uh6A-2vy0A:
undetectable
4uh6B-2vy0A:
undetectable		 4uh6A-2vy0A:
20.05
4uh6B-2vy0A:
20.05
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.
4UH6_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 4uh6A-2vy0A:
undetectable
4uh6B-2vy0A:
undetectable		 4uh6A-2vy0A:
20.05
4uh6B-2vy0A:
20.05
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.
4UPM_A_H4BA760_1
(NEURONAL NITRIC
OXIDE SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 4upmA-2vy0A:
undetectable
4upmB-2vy0A:
undetectable		 4upmA-2vy0A:
20.00
4upmB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UPM_B_H4BB760_1
(NEURONAL NITRIC
OXIDE SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 4upmA-2vy0A:
undetectable
4upmB-2vy0A:
undetectable		 4upmA-2vy0A:
20.00
4upmB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UPN_A_H4BA760_1
(NEURONAL NITRIC
OXIDE SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.42A 4upnA-2vy0A:
undetectable
4upnB-2vy0A:
undetectable		 4upnA-2vy0A:
20.00
4upnB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UPN_B_H4BB760_1
(NEURONAL NITRIC
OXIDE SYNTHASE)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 4upnA-2vy0A:
undetectable
4upnB-2vy0A:
undetectable		 4upnA-2vy0A:
20.00
4upnB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UPO_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 4upoA-2vy0A:
undetectable
4upoB-2vy0A:
undetectable		 4upoA-2vy0A:
20.00
4upoB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UPO_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 4upoA-2vy0A:
undetectable
4upoB-2vy0A:
undetectable		 4upoA-2vy0A:
20.00
4upoB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UPP_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 4uppA-2vy0A:
undetectable
4uppB-2vy0A:
undetectable		 4uppA-2vy0A:
20.00
4uppB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UPP_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 4uppA-2vy0A:
undetectable
4uppB-2vy0A:
undetectable		 4uppA-2vy0A:
20.00
4uppB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4V3U_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.41A 4v3uA-2vy0A:
undetectable
4v3uB-2vy0A:
undetectable		 4v3uA-2vy0A:
20.28
4v3uB-2vy0A:
20.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4V3U_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 4v3uA-2vy0A:
undetectable
4v3uB-2vy0A:
undetectable		 4v3uA-2vy0A:
20.28
4v3uB-2vy0A:
20.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4V3U_C_H4BC760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.40A 4v3uC-2vy0A:
undetectable
4v3uD-2vy0A:
undetectable		 4v3uC-2vy0A:
20.28
4v3uD-2vy0A:
20.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4V3U_D_H4BD760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.39A 4v3uC-2vy0A:
undetectable
4v3uD-2vy0A:
undetectable		 4v3uC-2vy0A:
20.28
4v3uD-2vy0A:
20.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4V3V_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.46A 4v3vA-2vy0A:
undetectable
4v3vB-2vy0A:
undetectable		 4v3vA-2vy0A:
20.00
4v3vB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4V3W_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.38A 4v3wA-2vy0A:
undetectable
4v3wB-2vy0A:
undetectable		 4v3wA-2vy0A:
20.00
4v3wB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4V3W_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.41A 4v3wA-2vy0A:
undetectable
4v3wB-2vy0A:
undetectable		 4v3wA-2vy0A:
20.00
4v3wB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4V3X_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.42A 4v3xA-2vy0A:
undetectable
4v3xB-2vy0A:
undetectable		 4v3xA-2vy0A:
20.00
4v3xB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4V3X_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 4v3xA-2vy0A:
undetectable
4v3xB-2vy0A:
undetectable		 4v3xA-2vy0A:
20.00
4v3xB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4V3Y_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 4v3yA-2vy0A:
undetectable
4v3yB-2vy0A:
undetectable		 4v3yA-2vy0A:
20.00
4v3yB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4V3Z_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.42A 4v3zA-2vy0A:
undetectable
4v3zB-2vy0A:
undetectable		 4v3zA-2vy0A:
20.00
4v3zB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4V3Z_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 4v3zA-2vy0A:
undetectable
4v3zB-2vy0A:
undetectable		 4v3zA-2vy0A:
20.00
4v3zB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4Y0P_A_TE4A201_1
(BETA-LACTOGLOBULIN)		 1z82 GLYCEROL-3-PHOSPHATE
DEHYDROGENASE
(Thermotoga
maritima) 		5 / 12 LEU A 189
ILE A 182
ILE A 290
VAL A 294
VAL A 298
 MRD  A 601 (-4.2A)
None
None
MRD  A 601 (-4.2A)
None
 0.92A 4y0pA-1z82A:
undetectable		 4y0pA-1z82A:
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.
4YDQ_B_HFGB802_0
(PROLINE--TRNA LIGASE)		 2mcm MACROMOMYCIN
(Streptomyces
macromomyceticus) 		5 / 12 PRO A  27
THR A  26
GLU A 103
SER A 101
GLY A  98
 None
None
None
None
MRD  A 113 ( 4.3A)
 1.31A 4ydqB-2mcmA:
undetectable		 4ydqB-2mcmA:
10.55
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) 		5 / 12 TRP A  86
HIS A 117
ASN A 167
TRP A 227
LEU A 306
 None
MRD  A 328 ( 3.9A)
NAD  A 327 (-3.3A)
MRD  A 328 (-4.0A)
MRD  A 328 ( 4.3A)
 0.62A 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.
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.
4Z4H_A_IPHA904_0
(PROTEIN ARGONAUTE-2)		 4qfu GLYCOSIDE HYDROLASE
FAMILY 5
(Bacteroides
vulgatus) 		4 / 5 ARG A 216
GLN A 237
PRO A 215
ILE A 186
 MRD  A 501 ( 4.7A)
MRD  A 501 (-3.8A)
None
CL  A 503 ( 4.7A)
 1.29A 4z4hA-4qfuA:
2.2		 4z4hA-4qfuA:
19.17
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.
5AD4_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.46A 5ad4A-2vy0A:
undetectable
5ad4B-2vy0A:
undetectable		 5ad4A-2vy0A:
20.00
5ad4B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5AD4_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.47A 5ad4A-2vy0A:
undetectable
5ad4B-2vy0A:
undetectable		 5ad4A-2vy0A:
20.00
5ad4B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5AD5_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 5ad5A-2vy0A:
undetectable
5ad5B-2vy0A:
undetectable		 5ad5A-2vy0A:
20.00
5ad5B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5AD5_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 5ad5A-2vy0A:
undetectable
5ad5B-2vy0A:
undetectable		 5ad5A-2vy0A:
20.00
5ad5B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5AD6_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.48A 5ad6A-2vy0A:
undetectable
5ad6B-2vy0A:
undetectable		 5ad6A-2vy0A:
20.00
5ad6B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5AD6_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 5ad6A-2vy0A:
undetectable
5ad6B-2vy0A:
undetectable		 5ad6A-2vy0A:
20.00
5ad6B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5AD7_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.45A 5ad7A-2vy0A:
undetectable
5ad7B-2vy0A:
undetectable		 5ad7A-2vy0A:
20.00
5ad7B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5AD8_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 5ad8A-2vy0A:
undetectable
5ad8B-2vy0A:
undetectable		 5ad8A-2vy0A:
20.00
5ad8B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ADA_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.46A 5adaA-2vy0A:
undetectable
5adaB-2vy0A:
undetectable		 5adaA-2vy0A:
20.00
5adaB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ADA_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.45A 5adaA-2vy0A:
undetectable
5adaB-2vy0A:
undetectable		 5adaA-2vy0A:
20.00
5adaB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ADB_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.45A 5adbA-2vy0A:
undetectable
5adbB-2vy0A:
undetectable		 5adbA-2vy0A:
20.00
5adbB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ADC_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.46A 5adcA-2vy0A:
undetectable
5adcB-2vy0A:
undetectable		 5adcA-2vy0A:
20.00
5adcB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ADC_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 5adcA-2vy0A:
undetectable
5adcB-2vy0A:
undetectable		 5adcA-2vy0A:
20.00
5adcB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ADF_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 5adfA-2vy0A:
undetectable
5adfB-2vy0A:
undetectable		 5adfA-2vy0A:
20.05
5adfB-2vy0A:
20.05
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.
5ADG_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.41A 5adgA-2vy0A:
undetectable
5adgB-2vy0A:
undetectable		 5adgA-2vy0A:
20.05
5adgB-2vy0A:
20.05
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.
5ADG_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.45A 5adgA-2vy0A:
undetectable
5adgB-2vy0A:
undetectable		 5adgA-2vy0A:
20.05
5adgB-2vy0A:
20.05
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.
5ADI_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.43A 5adiA-2vy0A:
undetectable
5adiB-2vy0A:
undetectable		 5adiA-2vy0A:
20.05
5adiB-2vy0A:
20.05
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.
5AGK_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.42A 5agkA-2vy0A:
undetectable
5agkB-2vy0A:
undetectable		 5agkA-2vy0A:
20.00
5agkB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5AGL_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 5aglA-2vy0A:
undetectable
5aglB-2vy0A:
undetectable		 5aglA-2vy0A:
20.00
5aglB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5AGL_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 5aglA-2vy0A:
undetectable
5aglB-2vy0A:
undetectable		 5aglA-2vy0A:
20.00
5aglB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5AGM_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 5agmA-2vy0A:
undetectable
5agmB-2vy0A:
undetectable		 5agmA-2vy0A:
20.00
5agmB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5AGM_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 5agmA-2vy0A:
undetectable
5agmB-2vy0A:
undetectable		 5agmA-2vy0A:
20.00
5agmB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5AGN_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 5agnA-2vy0A:
undetectable
5agnB-2vy0A:
undetectable		 5agnA-2vy0A:
20.00
5agnB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5AGN_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 5agnA-2vy0A:
undetectable
5agnB-2vy0A:
undetectable		 5agnA-2vy0A:
20.00
5agnB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5AGO_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.43A 5agoA-2vy0A:
undetectable
5agoB-2vy0A:
undetectable		 5agoA-2vy0A:
20.00
5agoB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5AGP_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 5agpA-2vy0A:
undetectable
5agpB-2vy0A:
undetectable		 5agpA-2vy0A:
20.00
5agpB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5AGP_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 5agpA-2vy0A:
undetectable
5agpB-2vy0A:
undetectable		 5agpA-2vy0A:
20.00
5agpB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5B1B_C_CHDC306_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 3ail 303AA LONG
HYPOTHETICAL
ESTERASE
(Sulfurisphaera
tokodaii) 		4 / 6 ARG A 200
GLN A 208
PHE A 182
LEU A 184
 None
None
MRD  A 305 (-4.4A)
None
 1.02A 5b1bC-3ailA:
undetectable
5b1bJ-3ailA:
undetectable		 5b1bC-3ailA:
20.54
5b1bJ-3ailA:
11.46
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.
5B1B_P_CHDP306_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 3ail 303AA LONG
HYPOTHETICAL
ESTERASE
(Sulfurisphaera
tokodaii) 		4 / 7 ARG A 200
GLN A 208
PHE A 182
LEU A 184
 None
None
MRD  A 305 (-4.4A)
None
 1.00A 5b1bP-3ailA:
undetectable
5b1bW-3ailA:
undetectable		 5b1bP-3ailA:
20.54
5b1bW-3ailA:
11.46
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.
5ECL_A_ILEA602_0
(JASMONIC ACID-AMIDO
SYNTHETASE JAR1)		 3wz4 DOTI
(Legionella
pneumophila) 		4 / 6 ALA A 138
VAL A 136
TYR A 168
VAL A 204
 None
None
MRD  A 501 ( 4.1A)
None
 0.88A 5eclA-3wz4A:
undetectable		 5eclA-3wz4A:
13.36
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.
5EEU_B_TRPB101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		5 / 9 THR A  81
SER A 124
HIS A 117
ALA A 122
ILE A 129
 MRD  A 301 ( 4.2A)
None
None
None
None
 1.47A 5eeuB-4nq1A:
undetectable
5eeuC-4nq1A:
undetectable		 5eeuB-4nq1A:
15.71
5eeuC-4nq1A:
15.71
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.
5EEU_K_TRPK101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		5 / 9 HIS A 117
ALA A 122
ILE A 129
THR A  81
SER A 124
 None
None
None
MRD  A 301 ( 4.2A)
None
 1.50A 5eeuA-4nq1A:
undetectable
5eeuK-4nq1A:
undetectable		 5eeuA-4nq1A:
15.71
5eeuK-4nq1A:
15.71
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.
5EEV_B_TRPB101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		5 / 9 THR A  81
SER A 124
HIS A 117
ALA A 122
ILE A 129
 MRD  A 301 ( 4.2A)
None
None
None
None
 1.47A 5eevB-4nq1A:
undetectable
5eevC-4nq1A:
undetectable		 5eevB-4nq1A:
15.71
5eevC-4nq1A:
15.71
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.
5EEV_H_TRPH101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		5 / 9 THR A  81
SER A 124
HIS A 117
ALA A 122
ILE A 129
 MRD  A 301 ( 4.2A)
None
None
None
None
 1.50A 5eevH-4nq1A:
undetectable
5eevI-4nq1A:
undetectable		 5eevH-4nq1A:
15.71
5eevI-4nq1A:
15.71
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.
5EEV_K_TRPK101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		5 / 9 HIS A 117
ALA A 122
ILE A 129
THR A  81
SER A 124
 None
None
None
MRD  A 301 ( 4.2A)
None
 1.50A 5eevA-4nq1A:
undetectable
5eevK-4nq1A:
undetectable		 5eevA-4nq1A:
15.71
5eevK-4nq1A:
15.71
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.
5EEW_B_TRPB101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		5 / 9 THR A  81
SER A 124
HIS A 117
ALA A 122
ILE A 129
 MRD  A 301 ( 4.2A)
None
None
None
None
 1.47A 5eewB-4nq1A:
undetectable
5eewC-4nq1A:
undetectable		 5eewB-4nq1A:
15.71
5eewC-4nq1A:
15.71
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.
5EEW_K_TRPK101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		5 / 9 HIS A 117
ALA A 122
ILE A 129
THR A  81
SER A 124
 None
None
None
MRD  A 301 ( 4.2A)
None
 1.49A 5eewA-4nq1A:
undetectable
5eewK-4nq1A:
undetectable		 5eewA-4nq1A:
15.71
5eewK-4nq1A:
15.71
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.
5EEX_B_TRPB101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		5 / 9 THR A  81
SER A 124
HIS A 117
ALA A 122
ILE A 129
 MRD  A 301 ( 4.2A)
None
None
None
None
 1.47A 5eexB-4nq1A:
undetectable
5eexC-4nq1A:
undetectable		 5eexB-4nq1A:
15.71
5eexC-4nq1A:
15.71
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.
5EEY_B_TRPB101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		5 / 9 THR A  81
SER A 124
HIS A 117
ALA A 122
ILE A 129
 MRD  A 301 ( 4.2A)
None
None
None
None
 1.47A 5eeyB-4nq1A:
undetectable
5eeyC-4nq1A:
undetectable		 5eeyB-4nq1A:
15.71
5eeyC-4nq1A:
15.71
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.
5EEY_H_TRPH101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		5 / 9 THR A  81
SER A 124
HIS A 117
ALA A 122
ILE A 129
 MRD  A 301 ( 4.2A)
None
None
None
None
 1.49A 5eeyH-4nq1A:
undetectable
5eeyI-4nq1A:
undetectable		 5eeyH-4nq1A:
15.71
5eeyI-4nq1A:
15.71
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.
5EEY_K_TRPK101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		5 / 9 HIS A 117
ALA A 122
ILE A 129
THR A  81
SER A 124
 None
None
None
MRD  A 301 ( 4.2A)
None
 1.50A 5eeyA-4nq1A:
undetectable
5eeyK-4nq1A:
undetectable		 5eeyA-4nq1A:
15.71
5eeyK-4nq1A:
15.71
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.
5EEZ_B_TRPB101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		5 / 9 THR A  81
SER A 124
HIS A 117
ALA A 122
ILE A 129
 MRD  A 301 ( 4.2A)
None
None
None
None
 1.47A 5eezB-4nq1A:
undetectable
5eezC-4nq1A:
undetectable		 5eezB-4nq1A:
15.71
5eezC-4nq1A:
15.71
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.
5EEZ_H_TRPH101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		5 / 9 THR A  81
SER A 124
HIS A 117
ALA A 122
ILE A 129
 MRD  A 301 ( 4.2A)
None
None
None
None
 1.50A 5eezH-4nq1A:
undetectable
5eezI-4nq1A:
undetectable		 5eezH-4nq1A:
15.71
5eezI-4nq1A:
15.71
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.
5EEZ_K_TRPK101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		5 / 9 HIS A 117
ALA A 122
ILE A 129
THR A  81
SER A 124
 None
None
None
MRD  A 301 ( 4.2A)
None
 1.50A 5eezA-4nq1A:
undetectable
5eezK-4nq1A:
undetectable		 5eezA-4nq1A:
15.71
5eezK-4nq1A:
15.71
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.
5EF0_B_TRPB101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		5 / 9 THR A  81
SER A 124
HIS A 117
ALA A 122
ILE A 129
 MRD  A 301 ( 4.2A)
None
None
None
None
 1.47A 5ef0B-4nq1A:
undetectable
5ef0C-4nq1A:
undetectable		 5ef0B-4nq1A:
15.71
5ef0C-4nq1A:
15.71
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.
5EF0_H_TRPH101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		5 / 9 THR A  81
SER A 124
HIS A 117
ALA A 122
ILE A 129
 MRD  A 301 ( 4.2A)
None
None
None
None
 1.49A 5ef0H-4nq1A:
undetectable
5ef0I-4nq1A:
undetectable		 5ef0H-4nq1A:
15.71
5ef0I-4nq1A:
15.71
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.
5EF1_B_TRPB101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		5 / 9 THR A  81
SER A 124
HIS A 117
ALA A 122
ILE A 129
 MRD  A 301 ( 4.2A)
None
None
None
None
 1.47A 5ef1B-4nq1A:
undetectable
5ef1C-4nq1A:
undetectable		 5ef1B-4nq1A:
15.71
5ef1C-4nq1A:
15.71
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.
5EF1_H_TRPH101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		5 / 9 THR A  81
SER A 124
HIS A 117
ALA A 122
ILE A 129
 MRD  A 301 ( 4.2A)
None
None
None
None
 1.49A 5ef1H-4nq1A:
undetectable
5ef1I-4nq1A:
undetectable		 5ef1H-4nq1A:
15.71
5ef1I-4nq1A:
15.71
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.
5EF1_K_TRPK101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		5 / 9 HIS A 117
ALA A 122
ILE A 129
THR A  81
SER A 124
 None
None
None
MRD  A 301 ( 4.2A)
None
 1.49A 5ef1A-4nq1A:
undetectable
5ef1K-4nq1A:
undetectable		 5ef1A-4nq1A:
15.71
5ef1K-4nq1A:
15.71
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.
5EF2_B_TRPB101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		5 / 9 THR A  81
SER A 124
HIS A 117
ALA A 122
ILE A 129
 MRD  A 301 ( 4.2A)
None
None
None
None
 1.47A 5ef2B-4nq1A:
undetectable
5ef2C-4nq1A:
undetectable		 5ef2B-4nq1A:
15.71
5ef2C-4nq1A:
15.71
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.
5EF2_H_TRPH101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		5 / 9 THR A  81
SER A 124
HIS A 117
ALA A 122
ILE A 129
 MRD  A 301 ( 4.2A)
None
None
None
None
 1.49A 5ef2H-4nq1A:
undetectable
5ef2I-4nq1A:
undetectable		 5ef2H-4nq1A:
15.71
5ef2I-4nq1A:
15.71
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.
5EF2_K_TRPK101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		5 / 9 HIS A 117
ALA A 122
ILE A 129
THR A  81
SER A 124
 None
None
None
MRD  A 301 ( 4.2A)
None
 1.49A 5ef2A-4nq1A:
undetectable
5ef2K-4nq1A:
undetectable		 5ef2A-4nq1A:
15.71
5ef2K-4nq1A:
15.71
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.
5EF3_B_TRPB101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		5 / 9 THR A  81
SER A 124
HIS A 117
ALA A 122
ILE A 129
 MRD  A 301 ( 4.2A)
None
None
None
None
 1.47A 5ef3B-4nq1A:
undetectable
5ef3C-4nq1A:
undetectable		 5ef3B-4nq1A:
15.71
5ef3C-4nq1A:
15.71
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.
5EF3_H_TRPH101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		5 / 9 THR A  81
SER A 124
HIS A 117
ALA A 122
ILE A 129
 MRD  A 301 ( 4.2A)
None
None
None
None
 1.49A 5ef3H-4nq1A:
undetectable
5ef3I-4nq1A:
undetectable		 5ef3H-4nq1A:
15.71
5ef3I-4nq1A:
15.71
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.
5ESG_A_1YNA701_2
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 3hyn PUTATIVE SIGNAL
TRANSDUCTION PROTEIN
([Eubacterium]
rectale) 		4 / 4 LEU A 168
TYR A 184
PRO A 110
ILE A  82
 None
MRD  A 189 (-3.6A)
None
None
 1.25A 5esgA-3hynA:
undetectable		 5esgA-3hynA:
16.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5FCT_A_C2FA402_0
(THYMIDYLATE SYNTHASE)		 3nrf APAG PROTEIN
(Pseudomonas
aeruginosa) 		5 / 11 PHE A  30
LEU A  82
ASP A 103
GLY A 102
ALA A  50
 MRD  A 128 (-4.4A)
None
None
None
None
 1.09A 5fctA-3nrfA:
undetectable		 5fctA-3nrfA:
15.58
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.
5FVP_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.46A 5fvpA-2vy0A:
undetectable
5fvpB-2vy0A:
undetectable		 5fvpA-2vy0A:
20.00
5fvpB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5FVP_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 5fvpA-2vy0A:
undetectable
5fvpB-2vy0A:
undetectable		 5fvpA-2vy0A:
20.00
5fvpB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5FVQ_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.41A 5fvqA-2vy0A:
undetectable
5fvqB-2vy0A:
undetectable		 5fvqA-2vy0A:
20.00
5fvqB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5FVQ_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.41A 5fvqA-2vy0A:
undetectable
5fvqB-2vy0A:
undetectable		 5fvqA-2vy0A:
20.00
5fvqB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5FVR_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 5fvrA-2vy0A:
undetectable
5fvrB-2vy0A:
undetectable		 5fvrA-2vy0A:
20.00
5fvrB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5FVR_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.41A 5fvrA-2vy0A:
undetectable
5fvrB-2vy0A:
undetectable		 5fvrA-2vy0A:
20.00
5fvrB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5FVS_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.42A 5fvsA-2vy0A:
undetectable
5fvsB-2vy0A:
undetectable		 5fvsA-2vy0A:
20.00
5fvsB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5FVS_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 5fvsA-2vy0A:
undetectable
5fvsB-2vy0A:
undetectable		 5fvsA-2vy0A:
20.00
5fvsB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5FVT_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.42A 5fvtA-2vy0A:
undetectable
5fvtB-2vy0A:
undetectable		 5fvtA-2vy0A:
20.00
5fvtB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5FVT_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.41A 5fvtA-2vy0A:
undetectable
5fvtB-2vy0A:
undetectable		 5fvtA-2vy0A:
20.00
5fvtB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5FVU_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 5fvuA-2vy0A:
undetectable
5fvuB-2vy0A:
undetectable		 5fvuA-2vy0A:
20.05
5fvuB-2vy0A:
20.05
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.
5FVU_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 5fvuA-2vy0A:
undetectable
5fvuB-2vy0A:
undetectable		 5fvuA-2vy0A:
20.05
5fvuB-2vy0A:
20.05
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.
5FVV_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.41A 5fvvA-2vy0A:
undetectable
5fvvB-2vy0A:
undetectable		 5fvvA-2vy0A:
20.05
5fvvB-2vy0A:
20.05
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.
5FVV_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.40A 5fvvA-2vy0A:
undetectable
5fvvB-2vy0A:
undetectable		 5fvvA-2vy0A:
20.05
5fvvB-2vy0A:
20.05
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.
5FVW_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 5fvwA-2vy0A:
undetectable
5fvwB-2vy0A:
undetectable		 5fvwA-2vy0A:
20.05
5fvwB-2vy0A:
20.05
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.
5FVW_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.45A 5fvwA-2vy0A:
undetectable
5fvwB-2vy0A:
undetectable		 5fvwA-2vy0A:
20.05
5fvwB-2vy0A:
20.05
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.
5FVX_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 5fvxA-2vy0A:
undetectable
5fvxB-2vy0A:
undetectable		 5fvxA-2vy0A:
20.05
5fvxB-2vy0A:
20.05
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.
5FW0_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.43A 5fw0A-2vy0A:
undetectable
5fw0B-2vy0A:
undetectable		 5fw0A-2vy0A:
20.00
5fw0B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5FW0_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 5fw0A-2vy0A:
undetectable
5fw0B-2vy0A:
undetectable		 5fw0A-2vy0A:
20.00
5fw0B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5FXT_A_0LAA1376_1
(DNA POLYMERASE III
SUBUNIT BETA)		 5w7z DNA POLYMERASE III
SUBUNIT BETA
(Rickettsia
conorii) 		4 / 7 LEU A 155
THR A 172
PRO A 246
MET A 375
 None
MRD  A 403 (-3.1A)
None
MRD  A 403 ( 4.5A)
 0.79A 5fxtA-5w7zA:
38.1		 5fxtA-5w7zA:
26.62
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.
5G0N_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.40A 5g0nA-2vy0A:
undetectable
5g0nB-2vy0A:
undetectable		 5g0nA-2vy0A:
20.00
5g0nB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5G0N_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.41A 5g0nA-2vy0A:
undetectable
5g0nB-2vy0A:
undetectable		 5g0nA-2vy0A:
20.00
5g0nB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5G0O_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.43A 5g0oA-2vy0A:
undetectable
5g0oB-2vy0A:
undetectable		 5g0oA-2vy0A:
20.00
5g0oB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5G0O_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 5g0oA-2vy0A:
undetectable
5g0oB-2vy0A:
undetectable		 5g0oA-2vy0A:
20.00
5g0oB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5G48_A_1FLA1375_1
(DNA POLYMERASE III
SUBUNIT BETA)		 5w7z DNA POLYMERASE III
SUBUNIT BETA
(Rickettsia
conorii) 		5 / 8 THR A 172
LEU A 177
PRO A 246
PRO A 359
MET A 375
 MRD  A 403 (-3.1A)
MRD  A 403 ( 4.0A)
None
None
MRD  A 403 ( 4.5A)
 0.68A 5g48A-5w7zA:
37.9		 5g48A-5w7zA:
26.62
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.
5G48_B_1FLB1375_1
(DNA POLYMERASE III
SUBUNIT BETA)		 5w7z DNA POLYMERASE III
SUBUNIT BETA
(Rickettsia
conorii) 		6 / 9 LEU A 155
THR A 172
LEU A 177
PRO A 246
PRO A 359
MET A 375
 None
MRD  A 403 (-3.1A)
MRD  A 403 ( 4.0A)
None
None
MRD  A 403 ( 4.5A)
 0.77A 5g48B-5w7zA:
10.3		 5g48B-5w7zA:
26.62
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.
5H3A_A_D16A401_1
(ORF70)		 3k9t PUTATIVE PEPTIDASE
(Clostridium
acetobutylicum) 		4 / 7 PHE A 221
ILE A  48
GLY A 169
PHE A 223
 None
MRD  A 441 ( 4.8A)
None
None
 0.77A 5h3aA-3k9tA:
undetectable		 5h3aA-3k9tA:
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.
5H3A_B_D16B401_1
(ORF70)		 3k9t PUTATIVE PEPTIDASE
(Clostridium
acetobutylicum) 		4 / 7 PHE A 221
ILE A  48
GLY A 169
PHE A 223
 None
MRD  A 441 ( 4.8A)
None
None
 0.79A 5h3aB-3k9tA:
undetectable		 5h3aB-3k9tA:
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.
5HM8_G_ADNG501_2
(ADENOSYLHOMOCYSTEINA
SE)		 3k9t PUTATIVE PEPTIDASE
(Clostridium
acetobutylicum) 		4 / 5 GLU A 353
GLU A 347
THR A 344
LEU A 248
 None
MRD  A 439 ( 4.8A)
None
None
 1.21A 5hm8G-3k9tA:
undetectable		 5hm8G-3k9tA:
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.
5IH0_A_ERYA404_1
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)		 3gzb PUTATIVE SNOAL-LIKE
POLYKETIDE CYCLASE
(Shewanella
putrefaciens) 		4 / 6 TYR A  28
ASP A 139
HIS A 137
ILE A  49
 None
MRD  A 154 (-4.6A)
None
None
 1.27A 5ih0A-3gzbA:
undetectable		 5ih0A-3gzbA:
19.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ITZ_B_LOCB502_1
(TUBULIN BETA-2B
CHAIN)		 4wpg DTDP-4-DEHYDRORHAMNO
SE REDUCTASE
(Streptococcus
pyogenes) 		5 / 12 LEU A  18
LEU A  11
THR A  95
ILE A   4
ILE A   2
 None
None
MRD  A 302 (-2.9A)
None
None
 1.09A 5itzB-4wpgA:
6.4		 5itzB-4wpgA:
23.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5K9D_A_CE9A402_0
(DIHYDROOROTATE
DEHYDROGENASE
(QUINONE),
MITOCHONDRIAL)		 5ez3 ACYL-COA
DEHYDROGENASE
(Brucella
melitensis) 		5 / 12 ALA A 152
LEU A 151
ALA A 149
THR A 145
THR A 304
 None
None
None
MRD  A 601 (-3.7A)
MPD  A 602 ( 4.6A)
 1.16A 5k9dA-5ez3A:
undetectable		 5k9dA-5ez3A:
22.85
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.
5KC4_E_RBFE201_1
(RIBOFLAVIN
TRANSPORTER RIBU)		 5ha4 DIAMINOPIMELATE
EPIMERASE
(Acinetobacter
baumannii) 		5 / 12 GLU A  73
GLY A  10
ASN A  13
LEU A 218
ALA A 246
 None
None
None
MRD  A 302 ( 4.5A)
MRD  A 302 (-3.6A)
 1.39A 5kc4E-5ha4A:
undetectable		 5kc4E-5ha4A:
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.
5KI6_A_IPHA903_0
(PROTEIN ARGONAUTE-2)		 4qfu GLYCOSIDE HYDROLASE
FAMILY 5
(Bacteroides
vulgatus) 		4 / 5 ARG A 216
GLN A 237
PRO A 215
ILE A 186
 MRD  A 501 ( 4.7A)
MRD  A 501 (-3.8A)
None
CL  A 503 ( 4.7A)
 1.36A 5ki6A-4qfuA:
2.1		 5ki6A-4qfuA:
19.17
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.
5NEL_C_ACTC302_0
(PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE)		 3gg7 UNCHARACTERIZED
METALLOPROTEIN
(Deinococcus
radiodurans) 		4 / 6 HIS A 122
HIS A   7
HIS A   5
HIS A  58
 None
MN  A 253 (-3.3A)
MN  A 253 (-3.3A)
MRD  A 257 (-3.5A)
 1.07A 5nelB-3gg7A:
4.3
5nelC-3gg7A:
2.3		 5nelB-3gg7A:
21.55
5nelC-3gg7A:
21.55
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.
5NFJ_C_SAMC501_0
(MITOCHONDRIAL
RIBONUCLEASE P
PROTEIN 1)		 5wyb PROBABLE ENOYL-COA
HYDRATASE/ISOMERASE
(Pseudomonas
aeruginosa) 		5 / 12 GLY B 123
THR B  39
SER B  75
LEU B  64
LEU B 105
 MRD  B 301 (-3.4A)
None
None
None
None
 1.21A 5nfjC-5wybB:
undetectable		 5nfjC-5wybB:
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.
5UNR_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.45A 5unrA-2vy0A:
undetectable
5unrB-2vy0A:
undetectable		 5unrA-2vy0A:
20.00
5unrB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UNS_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 5unsA-2vy0A:
undetectable
5unsB-2vy0A:
undetectable		 5unsA-2vy0A:
20.00
5unsB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UNS_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 5unsA-2vy0A:
undetectable
5unsB-2vy0A:
undetectable		 5unsA-2vy0A:
20.00
5unsB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UNT_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 5untA-2vy0A:
undetectable
5untB-2vy0A:
undetectable		 5untA-2vy0A:
20.00
5untB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UNT_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.41A 5untA-2vy0A:
undetectable
5untB-2vy0A:
undetectable		 5untA-2vy0A:
20.00
5untB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UNU_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.46A 5unuA-2vy0A:
undetectable
5unuB-2vy0A:
undetectable		 5unuA-2vy0A:
20.00
5unuB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UNU_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.45A 5unuA-2vy0A:
undetectable
5unuB-2vy0A:
undetectable		 5unuA-2vy0A:
20.00
5unuB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UNV_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.47A 5unvA-2vy0A:
undetectable
5unvB-2vy0A:
undetectable		 5unvA-2vy0A:
20.00
5unvB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UNV_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.50A 5unvA-2vy0A:
undetectable
5unvB-2vy0A:
undetectable		 5unvA-2vy0A:
20.00
5unvB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UNW_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.46A 5unwA-2vy0A:
undetectable
5unwB-2vy0A:
undetectable		 5unwA-2vy0A:
20.00
5unwB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UNW_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.47A 5unwA-2vy0A:
undetectable
5unwB-2vy0A:
undetectable		 5unwA-2vy0A:
20.00
5unwB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UNX_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.48A 5unxA-2vy0A:
undetectable
5unxB-2vy0A:
undetectable		 5unxA-2vy0A:
20.00
5unxB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UNX_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.45A 5unxA-2vy0A:
undetectable
5unxB-2vy0A:
undetectable		 5unxA-2vy0A:
20.00
5unxB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UNY_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.46A 5unyA-2vy0A:
undetectable
5unyB-2vy0A:
undetectable		 5unyA-2vy0A:
20.00
5unyB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UNY_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 5unyA-2vy0A:
undetectable
5unyB-2vy0A:
undetectable		 5unyA-2vy0A:
20.00
5unyB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UNZ_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.45A 5unzA-2vy0A:
undetectable
5unzB-2vy0A:
undetectable		 5unzA-2vy0A:
20.00
5unzB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UO0_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.47A 5uo0A-2vy0A:
undetectable
5uo0B-2vy0A:
undetectable		 5uo0A-2vy0A:
20.00
5uo0B-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UO1_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.46A 5uo1A-2vy0A:
undetectable
5uo1B-2vy0A:
undetectable		 5uo1A-2vy0A:
20.05
5uo1B-2vy0A:
20.05
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.
5UO1_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 5uo1A-2vy0A:
undetectable
5uo1B-2vy0A:
undetectable		 5uo1A-2vy0A:
20.05
5uo1B-2vy0A:
20.05
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.
5UO2_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.41A 5uo2A-2vy0A:
undetectable
5uo2B-2vy0A:
undetectable		 5uo2A-2vy0A:
20.05
5uo2B-2vy0A:
20.05
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.
5UO2_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 5uo2A-2vy0A:
undetectable
5uo2B-2vy0A:
undetectable		 5uo2A-2vy0A:
20.05
5uo2B-2vy0A:
20.05
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.
5UO3_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 5uo3A-2vy0A:
undetectable
5uo3B-2vy0A:
undetectable		 5uo3A-2vy0A:
20.05
5uo3B-2vy0A:
20.05
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.
5UO3_B_H4BB803_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.45A 5uo3A-2vy0A:
undetectable
5uo3B-2vy0A:
undetectable		 5uo3A-2vy0A:
20.05
5uo3B-2vy0A:
20.05
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.
5UO4_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.43A 5uo4A-2vy0A:
undetectable
5uo4B-2vy0A:
undetectable		 5uo4A-2vy0A:
20.05
5uo4B-2vy0A:
20.05
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.
5UO4_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 5uo4A-2vy0A:
undetectable
5uo4B-2vy0A:
undetectable		 5uo4A-2vy0A:
20.05
5uo4B-2vy0A:
20.05
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.
5UO5_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.43A 5uo5A-2vy0A:
undetectable
5uo5B-2vy0A:
undetectable		 5uo5A-2vy0A:
20.05
5uo5B-2vy0A:
20.05
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.
5UO5_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 5uo5A-2vy0A:
undetectable
5uo5B-2vy0A:
undetectable		 5uo5A-2vy0A:
20.05
5uo5B-2vy0A:
20.05
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.
5UO6_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.47A 5uo6A-2vy0A:
undetectable
5uo6B-2vy0A:
undetectable		 5uo6A-2vy0A:
20.05
5uo6B-2vy0A:
20.05
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.
5UO7_B_H4BB803_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 5uo7A-2vy0A:
undetectable
5uo7B-2vy0A:
undetectable		 5uo7A-2vy0A:
20.05
5uo7B-2vy0A:
20.05
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.
5VKQ_B_PCFB1801_0
(NO MECHANORECEPTOR
POTENTIAL C ISOFORM
L)		 5nyy NON-SPECIFIC
SERINE/THREONINE
PROTEIN KINASE
(Thermomonospora
curvata) 		4 / 5 TRP A 230
THR A 262
ASN A 285
TRP A 235
 None
None
MRD  A 403 (-3.5A)
None
 1.49A 5vkqB-5nyyA:
undetectable
5vkqC-5nyyA:
undetectable		 5vkqB-5nyyA:
10.55
5vkqC-5nyyA:
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.
5VUI_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.47A 5vuiA-2vy0A:
undetectable
5vuiB-2vy0A:
undetectable		 5vuiA-2vy0A:
20.00
5vuiB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VUI_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 5vuiA-2vy0A:
undetectable
5vuiB-2vy0A:
undetectable		 5vuiA-2vy0A:
20.00
5vuiB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VUJ_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 5vujA-2vy0A:
undetectable
5vujB-2vy0A:
undetectable		 5vujA-2vy0A:
20.00
5vujB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VUK_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.47A 5vukA-2vy0A:
undetectable
5vukB-2vy0A:
undetectable		 5vukA-2vy0A:
20.00
5vukB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VUK_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 5vukA-2vy0A:
undetectable
5vukB-2vy0A:
undetectable		 5vukA-2vy0A:
20.00
5vukB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VUL_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 5vulA-2vy0A:
undetectable
5vulB-2vy0A:
undetectable		 5vulA-2vy0A:
20.00
5vulB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VUL_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 5vulA-2vy0A:
undetectable
5vulB-2vy0A:
undetectable		 5vulA-2vy0A:
20.00
5vulB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VUM_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.45A 5vumA-2vy0A:
undetectable
5vumB-2vy0A:
undetectable		 5vumA-2vy0A:
20.00
5vumB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VUN_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.42A 5vunA-2vy0A:
undetectable
5vunB-2vy0A:
undetectable		 5vunA-2vy0A:
20.00
5vunB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VUN_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.41A 5vunA-2vy0A:
undetectable
5vunB-2vy0A:
undetectable		 5vunA-2vy0A:
20.00
5vunB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VUO_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.42A 5vuoA-2vy0A:
undetectable
5vuoB-2vy0A:
undetectable		 5vuoA-2vy0A:
20.00
5vuoB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VUO_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.41A 5vuoA-2vy0A:
undetectable
5vuoB-2vy0A:
undetectable		 5vuoA-2vy0A:
20.00
5vuoB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VUP_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.43A 5vupA-2vy0A:
undetectable
5vupB-2vy0A:
undetectable		 5vupA-2vy0A:
20.00
5vupB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VUP_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 5vupA-2vy0A:
undetectable
5vupB-2vy0A:
undetectable		 5vupA-2vy0A:
20.00
5vupB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VUQ_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 5vuqA-2vy0A:
undetectable
5vuqB-2vy0A:
undetectable		 5vuqA-2vy0A:
20.00
5vuqB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VUQ_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.45A 5vuqA-2vy0A:
undetectable
5vuqB-2vy0A:
undetectable		 5vuqA-2vy0A:
20.00
5vuqB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VUS_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.46A 5vusA-2vy0A:
undetectable
5vusB-2vy0A:
undetectable		 5vusA-2vy0A:
20.00
5vusB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VUT_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.41A 5vutA-2vy0A:
undetectable
5vutB-2vy0A:
undetectable		 5vutA-2vy0A:
20.00
5vutB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VUT_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.41A 5vutA-2vy0A:
undetectable
5vutB-2vy0A:
undetectable		 5vutA-2vy0A:
20.00
5vutB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VUU_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.43A 5vuuA-2vy0A:
undetectable
5vuuB-2vy0A:
undetectable		 5vuuA-2vy0A:
20.00
5vuuB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VUU_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.45A 5vuuA-2vy0A:
undetectable
5vuuB-2vy0A:
undetectable		 5vuuA-2vy0A:
20.00
5vuuB-2vy0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VUV_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 5vuvA-2vy0A:
undetectable
5vuvB-2vy0A:
undetectable		 5vuvA-2vy0A:
20.05
5vuvB-2vy0A:
20.05
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.
5VUW_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 5vuwA-2vy0A:
undetectable
5vuwB-2vy0A:
undetectable		 5vuwA-2vy0A:
20.05
5vuwB-2vy0A:
20.05
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.
5VUW_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 5vuwA-2vy0A:
undetectable
5vuwB-2vy0A:
undetectable		 5vuwA-2vy0A:
20.05
5vuwB-2vy0A:
20.05
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.
5VUX_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.43A 5vuxA-2vy0A:
undetectable
5vuxB-2vy0A:
undetectable		 5vuxA-2vy0A:
20.05
5vuxB-2vy0A:
20.05
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.
5VUY_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 5vuyA-2vy0A:
undetectable
5vuyB-2vy0A:
undetectable		 5vuyA-2vy0A:
20.05
5vuyB-2vy0A:
20.05
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.
5VUY_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 5vuyA-2vy0A:
undetectable
5vuyB-2vy0A:
undetectable		 5vuyA-2vy0A:
20.05
5vuyB-2vy0A:
20.05
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.
5VUZ_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 5vuzA-2vy0A:
undetectable
5vuzB-2vy0A:
undetectable		 5vuzA-2vy0A:
20.05
5vuzB-2vy0A:
20.05
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.
5VUZ_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 5vuzA-2vy0A:
undetectable
5vuzB-2vy0A:
undetectable		 5vuzA-2vy0A:
20.05
5vuzB-2vy0A:
20.05
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.
5VV0_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 5vv0A-2vy0A:
undetectable
5vv0B-2vy0A:
undetectable		 5vv0A-2vy0A:
20.05
5vv0B-2vy0A:
20.05
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.
5VV0_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 5vv0A-2vy0A:
undetectable
5vv0B-2vy0A:
undetectable		 5vv0A-2vy0A:
20.05
5vv0B-2vy0A:
20.05
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.
5VV1_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.43A 5vv1A-2vy0A:
undetectable
5vv1B-2vy0A:
undetectable		 5vv1A-2vy0A:
20.05
5vv1B-2vy0A:
20.05
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.
5VV1_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 5vv1A-2vy0A:
undetectable
5vv1B-2vy0A:
undetectable		 5vv1A-2vy0A:
20.05
5vv1B-2vy0A:
20.05
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.
5VV2_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.42A 5vv2A-2vy0A:
undetectable
5vv2B-2vy0A:
undetectable		 5vv2A-2vy0A:
20.05
5vv2B-2vy0A:
20.05
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.
5VV2_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 5vv2A-2vy0A:
undetectable
5vv2B-2vy0A:
undetectable		 5vv2A-2vy0A:
20.05
5vv2B-2vy0A:
20.05
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.
5VV3_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.46A 5vv3A-2vy0A:
undetectable
5vv3B-2vy0A:
undetectable		 5vv3A-2vy0A:
20.05
5vv3B-2vy0A:
20.05
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.
5VV3_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 5vv3A-2vy0A:
undetectable
5vv3B-2vy0A:
undetectable		 5vv3A-2vy0A:
20.05
5vv3B-2vy0A:
20.05
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.
5VV4_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 5vv4A-2vy0A:
undetectable
5vv4B-2vy0A:
undetectable		 5vv4A-2vy0A:
20.05
5vv4B-2vy0A:
20.05
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.
5VV5_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 5vv5A-2vy0A:
undetectable
5vv5B-2vy0A:
undetectable		 5vv5A-2vy0A:
20.05
5vv5B-2vy0A:
20.05
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.
5X5Q_C_D16C402_1
(THYMIDYLATE SYNTHASE)		 3k9t PUTATIVE PEPTIDASE
(Clostridium
acetobutylicum) 		4 / 7 PHE A 221
ILE A  48
GLY A 169
PHE A 223
 None
MRD  A 441 ( 4.8A)
None
None
 0.81A 5x5qC-3k9tA:
undetectable		 5x5qC-3k9tA:
20.98
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.
5X5Q_D_D16D402_1
(THYMIDYLATE SYNTHASE)		 3k9t PUTATIVE PEPTIDASE
(Clostridium
acetobutylicum) 		4 / 8 PHE A 221
ILE A  48
GLY A 169
PHE A 223
 None
MRD  A 441 ( 4.8A)
None
None
 0.80A 5x5qD-3k9tA:
undetectable		 5x5qD-3k9tA:
20.98
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.
5XIW_D_LOCD503_2
(TUBULIN BETA CHAIN)		 4wpg DTDP-4-DEHYDRORHAMNO
SE REDUCTASE
(Streptococcus
pyogenes) 		5 / 12 LEU A  18
ALA A 192
THR A  95
ILE A   4
ILE A   2
 None
None
MRD  A 302 (-2.9A)
None
None
 0.92A 5xiwD-4wpgA:
6.1		 5xiwD-4wpgA:
15.02
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.
5Z84_P_CHDP305_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 3ail 303AA LONG
HYPOTHETICAL
ESTERASE
(Sulfurisphaera
tokodaii) 		4 / 6 ARG A 200
GLN A 208
PHE A 182
LEU A 184
 None
None
MRD  A 305 (-4.4A)
None
 1.05A 5z84P-3ailA:
undetectable
5z84W-3ailA:
undetectable		 5z84P-3ailA:
20.54
5z84W-3ailA:
11.46
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.
5Z85_P_CHDP307_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 3ail 303AA LONG
HYPOTHETICAL
ESTERASE
(Sulfurisphaera
tokodaii) 		4 / 6 ARG A 200
GLN A 208
PHE A 182
LEU A 184
 None
None
MRD  A 305 (-4.4A)
None
 1.05A 5z85P-3ailA:
undetectable
5z85W-3ailA:
undetectable		 5z85P-3ailA:
20.54
5z85W-3ailA:
11.46
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.
5Z86_P_CHDP307_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 3ail 303AA LONG
HYPOTHETICAL
ESTERASE
(Sulfurisphaera
tokodaii) 		4 / 6 ARG A 200
GLN A 208
PHE A 182
LEU A 184
 None
None
MRD  A 305 (-4.4A)
None
 1.05A 5z86P-3ailA:
undetectable
5z86W-3ailA:
undetectable		 5z86P-3ailA:
20.54
5z86W-3ailA:
11.46
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.
5ZCO_P_CHDP305_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 3ail 303AA LONG
HYPOTHETICAL
ESTERASE
(Sulfurisphaera
tokodaii) 		4 / 6 ARG A 200
GLN A 208
PHE A 182
LEU A 184
 None
None
MRD  A 305 (-4.4A)
None
 1.06A 5zcoP-3ailA:
undetectable
5zcoW-3ailA:
undetectable		 5zcoP-3ailA:
20.54
5zcoW-3ailA:
11.46
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.
6APH_A_ADNA501_2
(ADENOSYLHOMOCYSTEINA
SE)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		4 / 5 GLN A 111
THR A 110
THR A  81
HIS A 120
 None
None
MRD  A 301 ( 4.2A)
MRD  A 301 ( 4.8A)
 1.27A 6aphA-4nq1A:
undetectable		 6aphA-4nq1A:
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.
6AUQ_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 6 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.47A 6auqA-2vy0A:
undetectable
6auqB-2vy0A:
undetectable		 6auqA-2vy0A:
15.73
6auqB-2vy0A:
15.73
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.
6AUQ_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 6auqA-2vy0A:
undetectable
6auqB-2vy0A:
undetectable		 6auqA-2vy0A:
15.73
6auqB-2vy0A:
15.73
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.
6AUR_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.42A 6aurA-2vy0A:
undetectable
6aurB-2vy0A:
undetectable		 6aurA-2vy0A:
15.73
6aurB-2vy0A:
15.73
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.
6AUR_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 6aurA-2vy0A:
undetectable
6aurB-2vy0A:
undetectable		 6aurA-2vy0A:
15.73
6aurB-2vy0A:
15.73
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.
6AUS_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.42A 6ausA-2vy0A:
undetectable
6ausB-2vy0A:
undetectable		 6ausA-2vy0A:
15.73
6ausB-2vy0A:
15.73
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.
6AUS_B_H4BB803_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.40A 6ausA-2vy0A:
undetectable
6ausB-2vy0A:
undetectable		 6ausA-2vy0A:
15.73
6ausB-2vy0A:
15.73
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.
6AUT_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.43A 6autA-2vy0A:
undetectable
6autB-2vy0A:
undetectable		 6autA-2vy0A:
15.73
6autB-2vy0A:
15.73
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.
6AUT_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.40A 6autA-2vy0A:
undetectable
6autB-2vy0A:
undetectable		 6autA-2vy0A:
15.73
6autB-2vy0A:
15.73
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.
6AUU_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.43A 6auuA-2vy0A:
undetectable
6auuB-2vy0A:
undetectable		 6auuA-2vy0A:
15.73
6auuB-2vy0A:
15.73
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.
6AUU_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 6auuA-2vy0A:
undetectable
6auuB-2vy0A:
undetectable		 6auuA-2vy0A:
15.73
6auuB-2vy0A:
15.73
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.
6AUV_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.43A 6auvA-2vy0A:
undetectable
6auvB-2vy0A:
undetectable		 6auvA-2vy0A:
15.73
6auvB-2vy0A:
15.73
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.
6AUV_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.41A 6auvA-2vy0A:
undetectable
6auvB-2vy0A:
undetectable		 6auvA-2vy0A:
15.73
6auvB-2vy0A:
15.73
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.
6AUW_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.42A 6auwA-2vy0A:
undetectable
6auwB-2vy0A:
undetectable		 6auwA-2vy0A:
15.73
6auwB-2vy0A:
15.73
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.
6AUW_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 6auwA-2vy0A:
undetectable
6auwB-2vy0A:
undetectable		 6auwA-2vy0A:
15.73
6auwB-2vy0A:
15.73
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.
6AUX_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.43A 6auxA-2vy0A:
undetectable
6auxB-2vy0A:
undetectable		 6auxA-2vy0A:
15.73
6auxB-2vy0A:
15.73
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.
6AUX_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.41A 6auxA-2vy0A:
undetectable
6auxB-2vy0A:
undetectable		 6auxA-2vy0A:
15.73
6auxB-2vy0A:
15.73
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.
6AUY_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.41A 6auyA-2vy0A:
undetectable
6auyB-2vy0A:
undetectable		 6auyA-2vy0A:
15.73
6auyB-2vy0A:
15.73
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.
6AUY_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.41A 6auyA-2vy0A:
undetectable
6auyB-2vy0A:
undetectable		 6auyA-2vy0A:
15.73
6auyB-2vy0A:
15.73
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.
6AUZ_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.41A 6auzA-2vy0A:
undetectable
6auzB-2vy0A:
undetectable		 6auzA-2vy0A:
15.73
6auzB-2vy0A:
15.73
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.
6AUZ_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 6auzA-2vy0A:
undetectable
6auzB-2vy0A:
undetectable		 6auzA-2vy0A:
15.73
6auzB-2vy0A:
15.73
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.
6AV0_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.43A 6av0A-2vy0A:
undetectable
6av0B-2vy0A:
undetectable		 6av0A-2vy0A:
15.73
6av0B-2vy0A:
15.73
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.
6AV0_B_H4BB803_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 6av0A-2vy0A:
undetectable
6av0B-2vy0A:
undetectable		 6av0A-2vy0A:
15.73
6av0B-2vy0A:
15.73
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.
6AV1_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.45A 6av1A-2vy0A:
undetectable
6av1B-2vy0A:
undetectable		 6av1A-2vy0A:
15.73
6av1B-2vy0A:
15.73
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.
6AV1_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.45A 6av1A-2vy0A:
undetectable
6av1B-2vy0A:
undetectable		 6av1A-2vy0A:
15.73
6av1B-2vy0A:
15.73
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.
6AV2_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.42A 6av2A-2vy0A:
undetectable
6av2B-2vy0A:
undetectable		 6av2A-2vy0A:
15.73
6av2B-2vy0A:
15.73
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.
6AV2_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.44A 6av2A-2vy0A:
undetectable
6av2B-2vy0A:
undetectable		 6av2A-2vy0A:
15.73
6av2B-2vy0A:
15.73
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.
6AV3_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 6av3A-2vy0A:
undetectable
6av3B-2vy0A:
undetectable		 6av3A-2vy0A:
15.73
6av3B-2vy0A:
15.73
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.
6AV3_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 6av3A-2vy0A:
undetectable
6av3B-2vy0A:
undetectable		 6av3A-2vy0A:
15.73
6av3B-2vy0A:
15.73
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.
6AV4_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.40A 6av4A-2vy0A:
undetectable
6av4B-2vy0A:
undetectable		 6av4A-2vy0A:
15.73
6av4B-2vy0A:
15.73
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.
6AV4_B_H4BB802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 6av4A-2vy0A:
undetectable
6av4B-2vy0A:
undetectable		 6av4A-2vy0A:
15.73
6av4B-2vy0A:
15.73
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.
6AV5_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.42A 6av5A-2vy0A:
undetectable
6av5B-2vy0A:
undetectable		 6av5A-2vy0A:
15.73
6av5B-2vy0A:
15.73
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.
6AV5_B_H4BB803_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.43A 6av5A-2vy0A:
undetectable
6av5B-2vy0A:
undetectable		 6av5A-2vy0A:
15.73
6av5B-2vy0A:
15.73
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.
6CIC_A_H4BA802_0
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.44A 6cicA-2vy0A:
undetectable
6cicB-2vy0A:
undetectable		 6cicA-2vy0A:
15.73
6cicB-2vy0A:
15.73
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.
6CIC_B_H4BB802_0
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.41A 6cicA-2vy0A:
undetectable
6cicB-2vy0A:
undetectable		 6cicA-2vy0A:
15.73
6cicB-2vy0A:
15.73
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.
6CID_A_H4BA802_0
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 VAL A 245
TRP A 252
PHE A 254
GLU A 251
 None
None
None
MRD  A1301 (-4.3A)
 1.41A 6cidA-2vy0A:
undetectable
6cidB-2vy0A:
undetectable		 6cidA-2vy0A:
15.73
6cidB-2vy0A:
15.73
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.
6CID_B_H4BB803_0
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2vy0 ENDO-BETA-1,3-GLUCAN
ASE
(Pyrococcus
furiosus) 		4 / 7 TRP A 252
PHE A 254
GLU A 251
VAL A 245
 None
None
MRD  A1301 (-4.3A)
None
 1.42A 6cidA-2vy0A:
undetectable
6cidB-2vy0A:
undetectable		 6cidA-2vy0A:
15.73
6cidB-2vy0A:
15.73
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.
6DCH_A_ACTA401_0
(SCOE PROTEIN)		 3gg7 UNCHARACTERIZED
METALLOPROTEIN
(Deinococcus
radiodurans) 		4 / 5 THR A  33
HIS A   5
ASP A 194
HIS A 146
 MRD  A 257 ( 4.5A)
MN  A 253 (-3.3A)
MN  A 253 (-2.7A)
MN  A 253 (-4.3A)
 0.85A 6dchA-3gg7A:
undetectable		 6dchA-3gg7A:
21.87
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.
6EFN_A_SAMA501_0
(SPORULATION KILLING
FACTOR MATURATION
PROTEIN SKFB)		 5ez3 ACYL-COA
DEHYDROGENASE
(Brucella
melitensis) 		5 / 11 THR A 387
ARG A 126
ALA A 149
THR A 145
ALA A 134
 None
None
None
MRD  A 601 (-3.7A)
None
 1.41A 6efnA-5ez3A:
undetectable		 6efnA-5ez3A:
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.
6F3N_A_ADNA505_2
(-)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		4 / 4 GLN A 111
THR A 110
THR A  81
HIS A 120
 None
None
MRD  A 301 ( 4.2A)
MRD  A 301 ( 4.8A)
 1.26A 6f3nA-4nq1A:
undetectable		 6f3nA-4nq1A:
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.
6F3N_C_ADNC505_2
(-)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		4 / 4 GLN A 111
THR A 110
THR A  81
HIS A 120
 None
None
MRD  A 301 ( 4.2A)
MRD  A 301 ( 4.8A)
 1.27A 6f3nC-4nq1A:
undetectable		 6f3nC-4nq1A:
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.
6F3N_D_ADND506_2
(-)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		4 / 4 GLN A 111
THR A 110
THR A  81
HIS A 120
 None
None
MRD  A 301 ( 4.2A)
MRD  A 301 ( 4.8A)
 1.27A 6f3nD-4nq1A:
undetectable		 6f3nD-4nq1A:
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.
6FBP_B_ADNB404_0
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 3gg7 UNCHARACTERIZED
METALLOPROTEIN
(Deinococcus
radiodurans) 		5 / 12 ASP A 194
HIS A  58
PRO A  59
SER A 120
SER A 166
 MN  A 253 (-2.7A)
MRD  A 257 (-3.5A)
None
None
None
 1.47A 6fbpA-3gg7A:
undetectable
6fbpB-3gg7A:
undetectable		 6fbpA-3gg7A:
14.52
6fbpB-3gg7A:
14.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6GBN_A_ADNA501_2
(-)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		4 / 5 GLN A 111
THR A 110
THR A  81
HIS A 120
 None
None
MRD  A 301 ( 4.2A)
MRD  A 301 ( 4.8A)
 1.28A 6gbnA-4nq1A:
2.0		 6gbnA-4nq1A:
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.
6GBN_B_ADNB501_2
(-)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		4 / 5 GLN A 111
THR A 110
THR A  81
HIS A 120
 None
None
MRD  A 301 ( 4.2A)
MRD  A 301 ( 4.8A)
 1.28A 6gbnB-4nq1A:
undetectable		 6gbnB-4nq1A:
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.
6GBN_D_ADND501_2
(-)		 4nq1 4-HYDROXY-TETRAHYDRO
DIPICOLINATE
SYNTHASE
(Legionella
pneumophila) 		4 / 5 GLN A 111
THR A 110
THR A  81
HIS A 120
 None
None
MRD  A 301 ( 4.2A)
MRD  A 301 ( 4.8A)
 1.28A 6gbnD-4nq1A:
undetectable		 6gbnD-4nq1A:
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.
6R2E_F_FFOF403_0
(THYMIDYLATE SYNTHASE)		 3nrf APAG PROTEIN
(Pseudomonas
aeruginosa) 		5 / 11 PHE A  30
LEU A  82
ASP A 103
GLY A 102
ALA A  50
 MRD  A 128 (-4.4A)
None
None
None
None
 1.20A 6r2eF-3nrfA:
undetectable		 6r2eF-3nrfA:
14.86