SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'AKG'


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.
1A27_A_ESTA350_1
(17-BETA-HYDROXYSTERO
ID-DEHYDROGENASE)		 5nci LEUCINE HYDROXYLASE
(Streptomyces
muensis) 		5 / 12 SER A 212
VAL A 144
LEU A 223
ASN A  97
PHE A 146
 AKG  A 302 (-2.6A)
AKG  A 302 (-4.3A)
AKG  A 302 ( 4.8A)
AKG  A 302 (-3.3A)
None
 1.39A 1a27A-5nciA:
undetectable		 1a27A-5nciA:
22.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1AEG_A_4APA296_1
(CYTOCHROME C
PEROXIDASE)		 5ui3 DIHYDRODIPICOLINATE
SYNTHASE
(Chlamydomonas
reinhardtii) 		4 / 8 LYS D  33
THR D  34
GLY D  66
LEU D  82
 None
None
AKG  D 401 ( 3.8A)
None
 0.82A 1aegA-5ui3D:
undetectable		 1aegA-5ui3D:
12.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1AKD_A_CAMA420_0
(CYTOCHROME P450CAM)		 5uqd DUMPY: SHORTER THAN
WILD-TYPE
(Caenorhabditis
elegans) 		5 / 11 PHE A1595
VAL A1292
GLY A1291
VAL A1591
VAL A1530
 AKG  A1701 (-3.8A)
None
None
None
None
 1.28A 1akdA-5uqdA:
undetectable		 1akdA-5uqdA:
21.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1AQ7_B_AG2B4_1
(TRYPSIN
AERUGINOSIN 98-B)		 1ofe FERREDOXIN-DEPENDENT
GLUTAMATE SYNTHASE 2
(Synechocystis
sp.
PCC
6803) 		5 / 8 ASP A1105
SER A1059
GLN A 969
GLY A1063
GLY A1106
 FMN  A2508 (-3.0A)
FMN  A2508 ( 3.9A)
AKG  A2510 ( 2.7A)
FMN  A2508 (-3.1A)
FMN  A2508 (-3.4A)
 1.49A 1aq7A-1ofeA:
undetectable		 1aq7A-1ofeA:
9.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1C4D_B_DVAB8_0
(GRAMICIDIN A)		 3uyj LYSINE-SPECIFIC
DEMETHYLASE 8
(Homo
sapiens) 		3 / 3 TRP A 310
VAL A 330
TRP A 414
 AKG  A 601 (-3.1A)
None
AKG  A 601 (-4.4A)
 1.28A 1c4dA-3uyjA:
undetectable
1c4dB-3uyjA:
undetectable		 1c4dA-3uyjA:
7.48
1c4dB-3uyjA:
7.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1CD2_A_FOLA307_1
(DIHYDROFOLATE
REDUCTASE)		 3la2 GLOBAL NITROGEN
REGULATOR
(Nostoc
sp.
PCC
7120) 		3 / 3 GLU A 106
ILE A 105
ARG A  88
 None
None
AKG  A 224 (-3.8A)
 0.85A 1cd2A-3la2A:
undetectable		 1cd2A-3la2A:
22.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1CQE_A_FLPA1650_1
(PROTEIN
(PROSTAGLANDIN H2
SYNTHASE-1))		 3la2 GLOBAL NITROGEN
REGULATOR
(Nostoc
sp.
PCC
7120) 		5 / 12 VAL A 108
LEU A 112
GLY A  76
SER A  79
LEU A  80
 None
None
AKG  A 224 (-3.1A)
None
None
 0.89A 1cqeA-3la2A:
undetectable		 1cqeA-3la2A:
18.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1CQE_B_FLPB2650_1
(PROTEIN
(PROSTAGLANDIN H2
SYNTHASE-1))		 3la2 GLOBAL NITROGEN
REGULATOR
(Nostoc
sp.
PCC
7120) 		5 / 12 VAL A 108
LEU A 112
GLY A  76
SER A  79
LEU A  80
 None
None
AKG  A 224 (-3.1A)
None
None
 0.89A 1cqeB-3la2A:
undetectable		 1cqeB-3la2A:
18.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1DB1_A_VDXA428_1
(VITAMIN D NUCLEAR
RECEPTOR)		 3uyj LYSINE-SPECIFIC
DEMETHYLASE 8
(Homo
sapiens) 		5 / 12 TYR A 272
LEU A 392
LEU A 329
SER A 410
SER A 318
 AKG  A 601 (-4.7A)
None
AKG  A 601 ( 4.4A)
AKG  A 601 ( 4.7A)
AKG  A 601 (-2.6A)
 1.18A 1db1A-3uyjA:
undetectable		 1db1A-3uyjA:
23.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1DB1_A_VDXA428_2
(VITAMIN D NUCLEAR
RECEPTOR)		 5e25 BRANCHED-CHAIN
AMINOTRANSFERASE
(Geoglobus
acetivorans) 		4 / 6 LEU A  28
ILE A  93
ARG A  91
VAL A  20
 None
None
AKG  A 302 ( 4.1A)
None
 0.94A 1db1A-5e25A:
undetectable		 1db1A-5e25A:
22.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1EI6_A_PPFA410_1
(PHOSPHONOACETATE
HYDROLASE)		 4xac EVDO2
(Micromonospora
carbonacea) 		4 / 5 ASP A 131
HIS A 129
HIS A 209
HIS A 215
 NI  A 301 (-2.5A)
NI  A 301 (-3.3A)
AKG  A 303 (-4.4A)
NI  A 301 ( 3.3A)
 1.09A 1ei6A-4xacA:
undetectable		 1ei6A-4xacA:
20.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1EI6_A_PPFA410_1
(PHOSPHONOACETATE
HYDROLASE)		 5epa SNOK
(Streptomyces
nogalater) 		5 / 5 THR A 137
ASP A 123
HIS A 121
HIS A 204
HIS A 210
 AKG  A 301 ( 4.3A)
FE  A 300 ( 2.5A)
FE  A 300 ( 3.3A)
AKG  A 301 (-4.4A)
FE  A 300 ( 3.3A)
 1.31A 1ei6A-5epaA:
undetectable		 1ei6A-5epaA:
23.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1EI6_A_PPFA410_1
(PHOSPHONOACETATE
HYDROLASE)		 5equ SNON,SNON
(Streptomyces
nogalater) 		5 / 5 THR A 146
ASP A 132
HIS A 130
HIS A 207
HIS A 213
 AKG  A 301 ( 4.3A)
FE  A 300 (-2.2A)
FE  A 300 (-3.1A)
AKG  A 301 (-4.2A)
FE  A 300 ( 3.2A)
 1.22A 1ei6A-5equA:
undetectable		 1ei6A-5equA:
21.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1EI6_C_PPFC413_1
(PHOSPHONOACETATE
HYDROLASE)		 5epa SNOK
(Streptomyces
nogalater) 		5 / 8 THR A 137
ASP A 123
HIS A 121
HIS A 204
HIS A 210
 AKG  A 301 ( 4.3A)
FE  A 300 ( 2.5A)
FE  A 300 ( 3.3A)
AKG  A 301 (-4.4A)
FE  A 300 ( 3.3A)
 1.37A 1ei6C-5epaA:
undetectable		 1ei6C-5epaA:
23.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1EI6_C_PPFC413_1
(PHOSPHONOACETATE
HYDROLASE)		 5equ SNON,SNON
(Streptomyces
nogalater) 		4 / 8 THR A 146
ASP A 132
HIS A 130
HIS A 207
 AKG  A 301 ( 4.3A)
FE  A 300 (-2.2A)
FE  A 300 (-3.1A)
AKG  A 301 (-4.2A)
 0.99A 1ei6C-5equA:
undetectable		 1ei6C-5equA:
21.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1EQH_A_FLPA701_1
(PROSTAGLANDIN H2
SYNTHASE-1)		 3la2 GLOBAL NITROGEN
REGULATOR
(Nostoc
sp.
PCC
7120) 		5 / 12 VAL A 108
LEU A 112
GLY A  76
SER A  79
LEU A  80
 None
None
AKG  A 224 (-3.1A)
None
None
 0.88A 1eqhA-3la2A:
undetectable		 1eqhA-3la2A:
18.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1EQH_B_FLPB1701_1
(PROSTAGLANDIN H2
SYNTHASE-1)		 3la2 GLOBAL NITROGEN
REGULATOR
(Nostoc
sp.
PCC
7120) 		5 / 12 VAL A 108
LEU A 112
GLY A  76
SER A  79
LEU A  80
 None
None
AKG  A 224 (-3.1A)
None
None
 0.87A 1eqhB-3la2A:
undetectable		 1eqhB-3la2A:
18.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1HWK_A_117A2_1
(HMG-COA REDUCTASE)		 4npl RNA DEMETHYLASE
ALKBH5
(Danio
rerio) 		4 / 8 ARG A 208
SER A 150
VAL A 179
SER A 155
 AKG  A 301 (-3.0A)
AKG  A 301 ( 4.8A)
None
None
 1.12A 1hwkA-4nplA:
undetectable		 1hwkA-4nplA:
19.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1HWK_C_117C4_1
(HMG-COA REDUCTASE)		 4npl RNA DEMETHYLASE
ALKBH5
(Danio
rerio) 		4 / 8 ARG A 208
SER A 150
VAL A 179
SER A 155
 AKG  A 301 (-3.0A)
AKG  A 301 ( 4.8A)
None
None
 1.16A 1hwkC-4nplA:
undetectable		 1hwkC-4nplA:
19.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1HWK_D_117D3_2
(HMG-COA REDUCTASE)		 4npl RNA DEMETHYLASE
ALKBH5
(Danio
rerio) 		4 / 8 ARG A 208
SER A 150
VAL A 179
SER A 155
 AKG  A 301 (-3.0A)
AKG  A 301 ( 4.8A)
None
None
 1.17A 1hwkD-4nplA:
undetectable		 1hwkD-4nplA:
19.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1JTV_A_TESA500_1
(17
BETA-HYDROXYSTEROID
DEHYDROGENASE TYPE 1)		 5f8p ALPHA-KETOGLUTARATE-
DEPENDENT
DIOXYGENASE FTO
(Homo
sapiens) 		4 / 8 LEU A 109
PRO A  93
HIS A 231
VAL A 228
 FIJ  A 602 (-4.7A)
FIJ  A 602 (-4.5A)
FIJ  A 602 (-4.0A)
AKG  A 603 ( 4.7A)
 1.12A 1jtvA-5f8pA:
undetectable		 1jtvA-5f8pA:
22.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1K6C_B_MK1B902_1
(POL POLYPROTEIN)		 5ijz NADP-SPECIFIC
GLUTAMATE
DEHYDROGENASE
(Corynebacterium
glutamicum) 		5 / 10 ARG A  96
VAL A 376
ILE A 124
GLY A 125
GLY A 126
 NAP  A 501 (-4.0A)
AKG  A 502 (-4.1A)
None
None
None
 0.84A 1k6cA-5ijzA:
undetectable		 1k6cA-5ijzA:
14.55
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.
1MX1_C_THAC3_1
(LIVER
CARBOXYLESTERASE I)		 5y7r IRON/ALPHA-KETOGLUTA
RATE-DEPENDENT
DIOXYGENASE ASQJ
(Aspergillus
nidulans) 		5 / 12 GLY B 213
LEU B 159
LEU B 124
LEU B 225
HIS B 134
 AKG  B 402 (-2.9A)
AKG  B 402 (-4.4A)
None
None
58K  B 403 (-3.4A)
 1.25A 1mx1C-5y7rB:
undetectable		 1mx1C-5y7rB:
10.06
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.
1NT5_A_DVAA6_0
(GRAMICIDIN A)		 1oij PUTATIVE
ALKYLSULFATASE ATSK
(Pseudomonas
putida) 		3 / 3 ALA C 266
VAL C 136
TRP C 137
 AKG  C1301 ( 3.7A)
None
None
 0.90A 1nt5A-1oijC:
undetectable		 1nt5A-1oijC:
4.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1NT5_B_DVAB6_0
(GRAMICIDIN A)		 1oij PUTATIVE
ALKYLSULFATASE ATSK
(Pseudomonas
putida) 		3 / 3 ALA C 266
VAL C 136
TRP C 137
 AKG  C1301 ( 3.7A)
None
None
 0.90A 1nt5B-1oijC:
undetectable		 1nt5B-1oijC:
4.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1PXX_B_DIFB1701_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 5ijz NADP-SPECIFIC
GLUTAMATE
DEHYDROGENASE
(Corynebacterium
glutamicum) 		5 / 9 LEU A 122
LEU A 401
VAL A 376
GLY A 374
ALA A 373
 None
None
AKG  A 502 (-4.1A)
None
None
 1.25A 1pxxB-5ijzA:
1.0		 1pxxB-5ijzA:
20.50
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.
1PXX_D_DIFD3701_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 5ijz NADP-SPECIFIC
GLUTAMATE
DEHYDROGENASE
(Corynebacterium
glutamicum) 		5 / 10 LEU A 122
LEU A 401
VAL A 376
GLY A 374
ALA A 373
 None
None
AKG  A 502 (-4.1A)
None
None
 1.25A 1pxxD-5ijzA:
0.9		 1pxxD-5ijzA:
20.50
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.
1TLM_A_MILA128_1
(TRANSTHYRETIN)		 2iuw ALKYLATED REPAIR
PROTEIN ALKB HOMOLOG
3
(Homo
sapiens) 		3 / 3 LEU A  92
LEU A 245
SER A 206
 None
None
AKG  A 700 ( 4.1A)
 0.61A 1tlmA-2iuwA:
undetectable		 1tlmA-2iuwA:
18.81
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1UOB_A_PNNA1311_0
(DEACETOXYCEPHALOSPOR
IN C SYNTHETASE)		 1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE
(Streptomyces
clavuligerus) 		5 / 12 LEU A 158
HIS A 243
ASP A 185
LEU A 223
PHE A 264
 None
FE2  A 901 ( 3.4A)
FE2  A 901 ( 2.2A)
None
AKG  A 902 (-4.9A)
 1.43A 1uobA-1e5iA:
44.6		 1uobA-1e5iA:
99.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1UOB_A_PNNA1311_0
(DEACETOXYCEPHALOSPOR
IN C SYNTHETASE)		 1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE
(Streptomyces
clavuligerus) 		12 / 12 MET A  73
SER A 102
LEU A 158
MET A 180
HIS A 183
ASP A 185
LEU A 204
HIS A 243
SER A 260
VAL A 262
PHE A 264
ILE A 305
 None
None
None
AKG  A 902 ( 3.7A)
FE2  A 901 ( 3.5A)
FE2  A 901 ( 2.2A)
AKG  A 902 ( 3.7A)
FE2  A 901 ( 3.4A)
AKG  A 902 (-2.8A)
AKG  A 902 ( 4.8A)
AKG  A 902 (-4.9A)
AKG  A 902 (-4.5A)
 0.22A 1uobA-1e5iA:
44.6		 1uobA-1e5iA:
99.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1UOB_A_PNNA1311_0
(DEACETOXYCEPHALOSPOR
IN C SYNTHETASE)		 1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE
(Streptomyces
clavuligerus) 		7 / 12 SER A 102
LEU A 158
HIS A 243
ASP A 185
SER A 260
VAL A 262
PHE A 264
 None
None
FE2  A 901 ( 3.4A)
FE2  A 901 ( 2.2A)
AKG  A 902 (-2.8A)
AKG  A 902 ( 4.8A)
AKG  A 902 (-4.9A)
 1.36A 1uobA-1e5iA:
44.6		 1uobA-1e5iA:
99.67
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.
1UOB_A_PNNA1311_0
(DEACETOXYCEPHALOSPOR
IN C SYNTHETASE)		 2brt LEUCOANTHOCYANIDIN
DIOXYGENASE
(Arabidopsis
thaliana) 		6 / 12 HIS A 232
ASP A 234
LEU A 249
HIS A 288
SER A 300
PHE A 304
 FE2  A1350 ( 3.5A)
FE2  A1350 (-2.6A)
AKG  A1351 ( 4.0A)
FE2  A1350 ( 3.5A)
AKG  A1351 (-2.5A)
NAR  A1352 ( 3.5A)
 0.47A 1uobA-2brtA:
22.1		 1uobA-2brtA:
23.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1UOB_A_PNNA1311_0
(DEACETOXYCEPHALOSPOR
IN C SYNTHETASE)		 4xac EVDO2
(Micromonospora
carbonacea) 		5 / 12 HIS A 129
ASP A 131
LEU A 160
HIS A 215
VAL A 230
 NI  A 301 (-3.3A)
NI  A 301 (-2.5A)
None
NI  A 301 ( 3.3A)
AKG  A 303 ( 4.8A)
 0.89A 1uobA-4xacA:
9.7		 1uobA-4xacA:
23.91
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.
1UOB_A_PNNA1311_0
(DEACETOXYCEPHALOSPOR
IN C SYNTHETASE)		 5cg9 TET-LIKE DIOXYGENASE
(Naegleria
gruberi) 		5 / 12 HIS A 229
ASP A 231
LEU A 253
HIS A 279
VAL A 293
 MN  A 403 ( 3.3A)
MN  A 403 ( 2.5A)
AKG  A 402 (-3.7A)
MN  A 403 ( 3.4A)
AKG  A 402 (-4.8A)
 0.65A 1uobA-5cg9A:
8.1		 1uobA-5cg9A:
21.99
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.
1UOB_A_PNNA1311_0
(DEACETOXYCEPHALOSPOR
IN C SYNTHETASE)		 5equ SNON,SNON
(Streptomyces
nogalater) 		5 / 12 MET A 161
HIS A 213
ASP A 132
HIS A 207
SER A 226
 AKG  A 301 ( 3.7A)
FE  A 300 ( 3.2A)
FE  A 300 (-2.2A)
AKG  A 301 (-4.2A)
AKG  A 301 ( 4.9A)
 1.16A 1uobA-5equA:
9.9		 1uobA-5equA:
24.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1UOB_A_PNNA1311_0
(DEACETOXYCEPHALOSPOR
IN C SYNTHETASE)		 5o9w THEBAINE
6-O-DEMETHYLASE
(Papaver
somniferum) 		6 / 12 HIS A 238
ASP A 240
LEU A 256
HIS A 295
SER A 307
PHE A 311
 NI  A 401 ( 3.3A)
NI  A 401 ( 2.5A)
AKG  A 402 (-3.6A)
NI  A 401 ( 3.3A)
AKG  A 402 (-2.5A)
AKG  A 402 (-4.8A)
 0.45A 1uobA-5o9wA:
22.8		 1uobA-5o9wA:
undetectable
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1UOF_A_PNNA1312_0
(DEACETOXYCEPHALOSPOR
IN C SYNTHETASE)		 1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE
(Streptomyces
clavuligerus) 		7 / 11 ARG A 179
HIS A 183
ASP A 185
THR A 190
HIS A 243
VAL A 245
VAL A 262
 None
FE2  A 901 ( 3.5A)
FE2  A 901 ( 2.2A)
None
FE2  A 901 ( 3.4A)
None
AKG  A 902 ( 4.8A)
 1.04A 1uofA-1e5iA:
42.9		 1uofA-1e5iA:
99.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1UOF_A_PNNA1312_0
(DEACETOXYCEPHALOSPOR
IN C SYNTHETASE)		 1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE
(Streptomyces
clavuligerus) 		7 / 11 ARG A 179
MET A 180
HIS A 183
ASP A 185
THR A 190
HIS A 243
VAL A 245
 None
AKG  A 902 ( 3.7A)
FE2  A 901 ( 3.5A)
FE2  A 901 ( 2.2A)
None
FE2  A 901 ( 3.4A)
None
 1.11A 1uofA-1e5iA:
42.9		 1uofA-1e5iA:
99.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1UOF_A_PNNA1312_0
(DEACETOXYCEPHALOSPOR
IN C SYNTHETASE)		 1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE
(Streptomyces
clavuligerus) 		6 / 11 HIS A 183
ASP A 185
THR A 190
ARG A 258
SER A 260
VAL A 262
 FE2  A 901 ( 3.5A)
FE2  A 901 ( 2.2A)
None
AKG  A 902 (-2.8A)
AKG  A 902 (-2.8A)
AKG  A 902 ( 4.8A)
 0.79A 1uofA-1e5iA:
42.9		 1uofA-1e5iA:
99.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1UOF_A_PNNA1312_0
(DEACETOXYCEPHALOSPOR
IN C SYNTHETASE)		 1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE
(Streptomyces
clavuligerus) 		7 / 11 HIS A 183
ASP A 185
THR A 190
HIS A 243
VAL A 245
SER A 260
VAL A 262
 FE2  A 901 ( 3.5A)
FE2  A 901 ( 2.2A)
None
FE2  A 901 ( 3.4A)
None
AKG  A 902 (-2.8A)
AKG  A 902 ( 4.8A)
 0.50A 1uofA-1e5iA:
42.9		 1uofA-1e5iA:
99.67
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.
1UOF_A_PNNA1312_0
(DEACETOXYCEPHALOSPOR
IN C SYNTHETASE)		 2iuw ALKYLATED REPAIR
PROTEIN ALKB HOMOLOG
3
(Homo
sapiens) 		6 / 11 HIS A 191
ASP A 193
HIS A 257
VAL A 259
ARG A 269
SER A 208
 FE  A 500 ( 3.3A)
FE  A 500 ( 2.6A)
FE  A 500 ( 3.3A)
None
AKG  A 700 (-2.9A)
AKG  A 700 ( 4.8A)
 1.30A 1uofA-2iuwA:
3.4		 1uofA-2iuwA:
21.02
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.
1UOF_A_PNNA1312_0
(DEACETOXYCEPHALOSPOR
IN C SYNTHETASE)		 3uyj LYSINE-SPECIFIC
DEMETHYLASE 8
(Homo
sapiens) 		5 / 11 HIS A 321
ASP A 323
HIS A 400
VAL A 402
SER A 410
 NI  A 501 ( 3.2A)
NI  A 501 ( 2.4A)
NI  A 501 ( 3.4A)
AKG  A 601 (-4.1A)
AKG  A 601 ( 4.7A)
 0.96A 1uofA-3uyjA:
7.0		 1uofA-3uyjA:
22.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1UOF_A_PNNA1312_0
(DEACETOXYCEPHALOSPOR
IN C SYNTHETASE)		 5cg9 TET-LIKE DIOXYGENASE
(Naegleria
gruberi) 		5 / 11 HIS A 229
ASP A 231
HIS A 279
VAL A 281
VAL A 293
 MN  A 403 ( 3.3A)
MN  A 403 ( 2.5A)
MN  A 403 ( 3.4A)
AKG  A 402 (-4.9A)
AKG  A 402 (-4.8A)
 0.59A 1uofA-5cg9A:
6.3		 1uofA-5cg9A:
21.99
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.
1UOF_A_PNNA1312_0
(DEACETOXYCEPHALOSPOR
IN C SYNTHETASE)		 5o9w THEBAINE
6-O-DEMETHYLASE
(Papaver
somniferum) 		5 / 11 HIS A 238
ASP A 240
THR A 245
ARG A 305
SER A 307
 NI  A 401 ( 3.3A)
NI  A 401 ( 2.5A)
None
AKG  A 402 (-2.7A)
AKG  A 402 (-2.5A)
 1.04A 1uofA-5o9wA:
21.4		 1uofA-5o9wA:
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.
1UOF_A_PNNA1312_0
(DEACETOXYCEPHALOSPOR
IN C SYNTHETASE)		 5o9w THEBAINE
6-O-DEMETHYLASE
(Papaver
somniferum) 		5 / 11 HIS A 238
ASP A 240
THR A 245
HIS A 295
SER A 307
 NI  A 401 ( 3.3A)
NI  A 401 ( 2.5A)
None
NI  A 401 ( 3.3A)
AKG  A 402 (-2.5A)
 0.64A 1uofA-5o9wA:
21.4		 1uofA-5o9wA:
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.
1VE3_A_SAMA302_1
(HYPOTHETICAL PROTEIN
PH0226)		 3tht ALKYLATED DNA REPAIR
PROTEIN ALKB HOMOLOG
8
(Homo
sapiens) 		4 / 4 TYR A 229
ARG A 328
ASP A 240
ASP A 247
 AKG  A 403 (-4.4A)
AKG  A 403 (-3.2A)
MN  A 402 ( 2.6A)
None
 1.28A 1ve3A-3thtA:
0.0		 1ve3A-3thtA:
20.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1VE3_B_SAMB301_1
(HYPOTHETICAL PROTEIN
PH0226)		 3tht ALKYLATED DNA REPAIR
PROTEIN ALKB HOMOLOG
8
(Homo
sapiens) 		4 / 4 TYR A 229
ARG A 328
ASP A 240
ASP A 247
 AKG  A 403 (-4.4A)
AKG  A 403 (-3.2A)
MN  A 402 ( 2.6A)
None
 1.29A 1ve3B-3thtA:
0.0		 1ve3B-3thtA:
20.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1WG8_A_SAMA3142_0
(PREDICTED
S-ADENOSYLMETHIONINE
-DEPENDENT
METHYLTRANSFERASE)		 2vdc GLUTAMATE SYNTHASE
[NADPH] LARGE CHAIN
(Azospirillum
brasilense) 		5 / 12 GLY A 480
GLY A1029
GLY A1031
PHE A 778
SER A1027
 None
FMN  A2474 (-3.3A)
AKG  A2475 ( 3.9A)
None
FMN  A2474 ( 4.9A)
 1.20A 1wg8A-2vdcA:
undetectable		 1wg8A-2vdcA:
11.82
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.
1YA3_A_STRA1001_1
(MINERALOCORTICOID
RECEPTOR)		 5nci LEUCINE HYDROXYLASE
(Streptomyces
muensis) 		5 / 12 LEU A 223
ASN A  97
LEU A  58
ALA A  57
ARG A  64
 AKG  A 302 ( 4.8A)
AKG  A 302 (-3.3A)
None
None
None
 1.39A 1ya3A-5nciA:
undetectable		 1ya3A-5nciA:
21.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1YA3_B_STRB2001_1
(MINERALOCORTICOID
RECEPTOR)		 1drt CLAVAMINATE SYNTHASE
1
(Streptomyces
clavuligerus) 		5 / 12 LEU A 141
ALA A 171
LEU A 270
LEU A 295
THR A 136
 AKG  A 326 (-4.7A)
None
None
None
None
 1.34A 1ya3B-1drtA:
undetectable		 1ya3B-1drtA:
20.82
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.
1YVM_A_TMGA501_1
(METHIONINE
AMINOPEPTIDASE)		 4xac EVDO2
(Micromonospora
carbonacea) 		4 / 7 TYR A 162
HIS A 129
HIS A 209
TRP A 128
 None
NI  A 301 (-3.3A)
AKG  A 303 (-4.4A)
None
 1.24A 1yvmA-4xacA:
undetectable		 1yvmA-4xacA:
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.
2A1H_A_GBNA502_1
(BRANCHED CHAIN
AMINOTRANSFERASE)		 5e25 BRANCHED-CHAIN
AMINOTRANSFERASE
(Geoglobus
acetivorans) 		4 / 8 ARG A  91
GLY A 247
THR A 248
ALA A 249
 AKG  A 302 ( 4.1A)
PLP  A 301 (-3.4A)
PLP  A 301 ( 3.7A)
AKG  A 302 (-3.6A)
 0.51A 2a1hA-5e25A:
28.7
2a1hB-5e25A:
28.7		 2a1hA-5e25A:
25.54
2a1hB-5e25A:
25.54
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.
2A1H_A_GBNA502_1
(BRANCHED CHAIN
AMINOTRANSFERASE)		 5e25 BRANCHED-CHAIN
AMINOTRANSFERASE
(Geoglobus
acetivorans) 		4 / 8 TYR A  89
ARG A  91
GLY A 247
THR A 248
 AKG  A 302 (-4.3A)
AKG  A 302 ( 4.1A)
PLP  A 301 (-3.4A)
PLP  A 301 ( 3.7A)
 0.41A 2a1hA-5e25A:
28.7
2a1hB-5e25A:
28.7		 2a1hA-5e25A:
25.54
2a1hB-5e25A:
25.54
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.
2AA5_B_STRB302_1
(MINERALOCORTICOID
RECEPTOR)		 5nci LEUCINE HYDROXYLASE
(Streptomyces
muensis) 		5 / 12 LEU A 223
ASN A  97
LEU A  58
ALA A  57
ARG A  64
 AKG  A 302 ( 4.8A)
AKG  A 302 (-3.3A)
None
None
None
 1.38A 2aa5B-5nciA:
undetectable		 2aa5B-5nciA:
22.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2AOX_A_THAA400_1
(HISTAMINE
N-METHYLTRANSFERASE)		 3w21 PUTATIVE
UNCHARACTERIZED
PROTEIN
(Burkholderia
ambifaria) 		4 / 8 PHE A 272
PHE A 261
GLN A  82
TYR A  96
 None
AKG  A 302 (-4.3A)
None
None
 1.42A 2aoxA-3w21A:
undetectable		 2aoxA-3w21A:
20.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2AOX_B_THAB401_1
(HISTAMINE
N-METHYLTRANSFERASE)		 3w21 PUTATIVE
UNCHARACTERIZED
PROTEIN
(Burkholderia
ambifaria) 		4 / 7 PHE A 272
PHE A 261
GLN A  82
TYR A  96
 None
AKG  A 302 (-4.3A)
None
None
 1.43A 2aoxB-3w21A:
undetectable		 2aoxB-3w21A:
20.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2AVS_B_MK1B902_1
(POL POLYPROTEIN)		 5ijz NADP-SPECIFIC
GLUTAMATE
DEHYDROGENASE
(Corynebacterium
glutamicum) 		5 / 12 ARG A  96
VAL A 376
ILE A 124
GLY A 125
GLY A 126
 NAP  A 501 (-4.0A)
AKG  A 502 (-4.1A)
None
None
None
 0.80A 2avsA-5ijzA:
undetectable		 2avsA-5ijzA:
15.79
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.
2AVS_B_MK1B902_3
(POL POLYPROTEIN)		 5m0t ALPHA-KETOGLUTARATE-
DEPENDENT NON-HEME
IRON OXYGENASE EASH
(Aspergillus
japonicus) 		5 / 12 GLY A 166
ALA A 167
VAL A 201
GLY A 210
PRO A 225
 None
None
None
AKG  A 302 ( 4.4A)
None
 1.12A 2avsB-5m0tA:
undetectable		 2avsB-5m0tA:
15.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2AVV_E_MK1E902_1
(POL POLYPROTEIN)		 5ijz NADP-SPECIFIC
GLUTAMATE
DEHYDROGENASE
(Corynebacterium
glutamicum) 		5 / 12 ARG A  96
VAL A 376
ILE A 124
GLY A 125
GLY A 126
 NAP  A 501 (-4.0A)
AKG  A 502 (-4.1A)
None
None
None
 0.86A 2avvD-5ijzA:
undetectable		 2avvD-5ijzA:
13.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2AYL_A_FLPA1701_1
(PROSTAGLANDIN G/H
SYNTHASE 1)		 3la2 GLOBAL NITROGEN
REGULATOR
(Nostoc
sp.
PCC
7120) 		5 / 12 VAL A 108
LEU A 112
GLY A  76
SER A  79
LEU A  80
 None
None
AKG  A 224 (-3.1A)
None
None
 0.99A 2aylA-3la2A:
undetectable		 2aylA-3la2A:
18.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2AYL_B_FLPB2701_1
(PROSTAGLANDIN G/H
SYNTHASE 1)		 3la2 GLOBAL NITROGEN
REGULATOR
(Nostoc
sp.
PCC
7120) 		5 / 12 VAL A 108
LEU A 112
GLY A  76
SER A  79
LEU A  80
 None
None
AKG  A 224 (-3.1A)
None
None
 0.99A 2aylB-3la2A:
undetectable		 2aylB-3la2A:
18.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2COI_A_GBNA420_1
(BRANCHED CHAIN
AMINOTRANSFERASE 1,
CYTOSOLIC)		 5e25 BRANCHED-CHAIN
AMINOTRANSFERASE
(Geoglobus
acetivorans) 		5 / 10 TYR A  89
ARG A  91
GLY A 247
THR A 248
ALA A 249
 AKG  A 302 (-4.3A)
AKG  A 302 ( 4.1A)
PLP  A 301 (-3.4A)
PLP  A 301 ( 3.7A)
AKG  A 302 (-3.6A)
 0.48A 2coiA-5e25A:
29.3
2coiB-5e25A:
29.6		 2coiA-5e25A:
24.56
2coiB-5e25A:
24.56
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.
2COI_B_GBNB420_1
(BRANCHED CHAIN
AMINOTRANSFERASE 1,
CYTOSOLIC)		 5e25 BRANCHED-CHAIN
AMINOTRANSFERASE
(Geoglobus
acetivorans) 		5 / 10 TYR A  89
ARG A  91
GLY A 247
THR A 248
ALA A 249
 AKG  A 302 (-4.3A)
AKG  A 302 ( 4.1A)
PLP  A 301 (-3.4A)
PLP  A 301 ( 3.7A)
AKG  A 302 (-3.6A)
 0.43A 2coiA-5e25A:
29.3
2coiB-5e25A:
29.6		 2coiA-5e25A:
24.56
2coiB-5e25A:
24.56
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.
2COJ_A_GBNA420_1
(BRANCHED CHAIN
AMINOTRANSFERASE 1,
CYTOSOLIC)		 5e25 BRANCHED-CHAIN
AMINOTRANSFERASE
(Geoglobus
acetivorans) 		6 / 11 PHE A  34
TYR A  89
ARG A  91
GLY A 247
THR A 248
ALA A 249
 AKG  A 302 (-4.9A)
AKG  A 302 (-4.3A)
AKG  A 302 ( 4.1A)
PLP  A 301 (-3.4A)
PLP  A 301 ( 3.7A)
AKG  A 302 (-3.6A)
 0.54A 2cojA-5e25A:
29.2
2cojB-5e25A:
29.6		 2cojA-5e25A:
24.56
2cojB-5e25A:
24.56
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.
2COJ_B_GBNB420_1
(BRANCHED CHAIN
AMINOTRANSFERASE 1,
CYTOSOLIC)		 5e25 BRANCHED-CHAIN
AMINOTRANSFERASE
(Geoglobus
acetivorans) 		5 / 9 TYR A  89
ARG A  91
GLY A 247
THR A 248
ALA A 249
 AKG  A 302 (-4.3A)
AKG  A 302 ( 4.1A)
PLP  A 301 (-3.4A)
PLP  A 301 ( 3.7A)
AKG  A 302 (-3.6A)
 0.51A 2cojA-5e25A:
29.2
2cojB-5e25A:
29.6		 2cojA-5e25A:
24.56
2cojB-5e25A:
24.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2EJ3_A_GBNA2414_1
(BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE)		 5e25 BRANCHED-CHAIN
AMINOTRANSFERASE
(Geoglobus
acetivorans) 		7 / 8 TYR A  89
ARG A  91
GLY A 188
GLY A 247
THR A 248
ALA A 249
ALA A 250
 AKG  A 302 (-4.3A)
AKG  A 302 ( 4.1A)
PLP  A 301 ( 4.0A)
PLP  A 301 (-3.4A)
PLP  A 301 ( 3.7A)
AKG  A 302 (-3.6A)
None
 0.31A 2ej3A-5e25A:
38.8		 2ej3A-5e25A:
41.64
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2EJ3_B_GBNB914_1
(BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE)		 5e25 BRANCHED-CHAIN
AMINOTRANSFERASE
(Geoglobus
acetivorans) 		9 / 10 PHE A  34
TYR A  89
ARG A  91
TYR A 156
GLY A 188
GLY A 247
THR A 248
ALA A 249
ALA A 250
 AKG  A 302 (-4.9A)
AKG  A 302 (-4.3A)
AKG  A 302 ( 4.1A)
PLP  A 301 (-4.3A)
PLP  A 301 ( 4.0A)
PLP  A 301 (-3.4A)
PLP  A 301 ( 3.7A)
AKG  A 302 (-3.6A)
None
 0.39A 2ej3B-5e25A:
38.7		 2ej3B-5e25A:
41.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2JFA_B_CCSB417_0
(ESTROGEN RECEPTOR)		 3kv6 JMJC
DOMAIN-CONTAINING
HISTONE
DEMETHYLATION
PROTEIN 1D
(Homo
sapiens) 		3 / 3 GLN A 360
LYS A 299
VAL A 339
 None
AKG  A 702 (-3.6A)
None
 0.88A 2jfaB-3kv6A:
undetectable		 2jfaB-3kv6A:
17.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2JN3_A_JN3A131_2
(FATTY ACID-BINDING
PROTEIN, LIVER)		 5j4r WELO5
(Hapalosiphon
welwitschii) 		4 / 6 ASN A  18
GLN A 123
ILE A 192
PHE A 191
 None
None
None
AKG  A 301 (-4.1A)
 1.17A 2jn3A-5j4rA:
undetectable		 2jn3A-5j4rA:
17.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2OAX_B_SNLB2001_1
(MINERALOCORTICOID
RECEPTOR)		 1drt CLAVAMINATE SYNTHASE
1
(Streptomyces
clavuligerus) 		5 / 12 LEU A 141
ALA A 171
LEU A 270
LEU A 295
THR A 136
 AKG  A 326 (-4.7A)
None
None
None
None
 1.30A 2oaxB-1drtA:
undetectable		 2oaxB-1drtA:
20.82
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.
2OAX_C_SNLC3001_1
(MINERALOCORTICOID
RECEPTOR)		 1drt CLAVAMINATE SYNTHASE
1
(Streptomyces
clavuligerus) 		5 / 12 LEU A 141
ALA A 171
LEU A 270
LEU A 295
THR A 136
 AKG  A 326 (-4.7A)
None
None
None
None
 1.31A 2oaxC-1drtA:
undetectable		 2oaxC-1drtA:
20.82
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.
2OAX_D_SNLD4001_1
(MINERALOCORTICOID
RECEPTOR)		 5nci LEUCINE HYDROXYLASE
(Streptomyces
muensis) 		5 / 12 LEU A 223
ASN A  97
LEU A  58
ALA A  57
ARG A  64
 AKG  A 302 ( 4.8A)
AKG  A 302 (-3.3A)
None
None
None
 1.28A 2oaxD-5nciA:
undetectable		 2oaxD-5nciA:
21.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2OAX_E_SNLE5001_1
(MINERALOCORTICOID
RECEPTOR)		 5nci LEUCINE HYDROXYLASE
(Streptomyces
muensis) 		5 / 12 LEU A 223
ASN A  97
LEU A  58
ALA A  57
ARG A  64
 AKG  A 302 ( 4.8A)
AKG  A 302 (-3.3A)
None
None
None
 1.32A 2oaxE-5nciA:
undetectable		 2oaxE-5nciA:
21.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2OTH_A_NIMA300_1
(PHOSPHOLIPASE A2
VRV-PL-VIIIA)		 2a1x PHYTANOYL-COA
DIOXYGENASE
(Homo
sapiens) 		4 / 5 LEU A 206
ALA A 277
ILE A 159
SER A 279
 None
AKG  A 451 ( 4.5A)
AKG  A 451 (-3.5A)
None
 1.13A 2othA-2a1xA:
undetectable		 2othA-2a1xA:
18.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Q0J_A_BEZA500_0
(QUINOLONE SIGNAL
RESPONSE PROTEIN)		 3obz PHYTANOYL-COA
DIOXYGENASE
DOMAIN-CONTAINING
PROTEIN 1
(Homo
sapiens) 		5 / 10 HIS A 263
ASP A 158
HIS A 156
SER A 248
LEU A 187
 AKG  A 481 ( 4.8A)
FE2  A 482 ( 2.6A)
FE2  A 482 ( 3.4A)
AKG  A 481 (-2.5A)
None
 1.34A 2q0jA-3obzA:
undetectable		 2q0jA-3obzA:
22.82
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.
2Q0J_B_BEZB500_0
(QUINOLONE SIGNAL
RESPONSE PROTEIN)		 2a1x PHYTANOYL-COA
DIOXYGENASE
(Homo
sapiens) 		5 / 11 HIS A 281
ASP A 177
HIS A 175
SER A 266
LEU A 206
 None
FE2  A 450 ( 2.8A)
FE2  A 450 ( 3.3A)
AKG  A 451 (-2.6A)
None
 1.25A 2q0jB-2a1xA:
undetectable		 2q0jB-2a1xA:
22.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Q6O_B_SAMB500_0
(HYPOTHETICAL PROTEIN)		 4xgi GLUTAMATE
DEHYDROGENASE
(Burkholderia
thailandensis) 		4 / 6 ASP A 159
PRO A 161
THR A 192
TRP A 371
 None
None
AKG  A 501 ( 4.9A)
None
 1.41A 2q6oB-4xgiA:
undetectable		 2q6oB-4xgiA:
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.
2R5P_B_MK1B902_1
(PROTEASE)		 5ijz NADP-SPECIFIC
GLUTAMATE
DEHYDROGENASE
(Corynebacterium
glutamicum) 		5 / 12 ARG A  96
VAL A 376
ILE A 124
GLY A 125
GLY A 126
 NAP  A 501 (-4.0A)
AKG  A 502 (-4.1A)
None
None
None
 0.87A 2r5pA-5ijzA:
undetectable		 2r5pA-5ijzA:
13.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2R5P_D_MK1D902_1
(PROTEASE)		 5ijz NADP-SPECIFIC
GLUTAMATE
DEHYDROGENASE
(Corynebacterium
glutamicum) 		5 / 12 ARG A  96
VAL A 376
ILE A 124
GLY A 125
GLY A 126
 NAP  A 501 (-4.0A)
AKG  A 502 (-4.1A)
None
None
None
 0.86A 2r5pC-5ijzA:
undetectable		 2r5pC-5ijzA:
13.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2UVN_A_ECNA1409_1
(CYTOCHROME P450 130)		 5ui3 DIHYDRODIPICOLINATE
SYNTHASE
(Chlamydomonas
reinhardtii) 		5 / 12 LEU D 268
PRO D 261
THR D  68
GLY D  69
GLY D  65
 None
None
AKG  D 401 (-3.6A)
None
None
 1.13A 2uvnA-5ui3D:
undetectable		 2uvnA-5ui3D:
16.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2VDB_A_NPSA1591_1
(SERUM ALBUMIN)		 5j4r WELO5
(Hapalosiphon
welwitschii) 		4 / 8 ILE A  32
LEU A 251
PHE A 252
GLY A 254
 None
None
AKG  A 301 (-4.8A)
None
 0.91A 2vdbA-5j4rA:
undetectable		 2vdbA-5j4rA:
18.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2VJ1_A_BEZA1303_0
(SARS CORONAVIRUS
MAIN PROTEINASE)		 3tht ALKYLATED DNA REPAIR
PROTEIN ALKB HOMOLOG
8
(Homo
sapiens) 		3 / 3 HIS A 292
MET A 282
MET A 260
 MN  A 402 ( 3.6A)
None
AKG  A 403 (-4.7A)
 1.36A 2vj1A-3thtA:
undetectable		 2vj1A-3thtA:
21.37
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.
2VJ1_A_BEZA1303_0
(SARS CORONAVIRUS
MAIN PROTEINASE)		 5zm4 DIOXYGENASE ANDA
(Aspergillus
stellatus) 		3 / 3 HIS A  79
MET A  73
MET A 125
 AKG  A 302 (-4.2A)
9FU  A 303 ( 4.5A)
AKG  A 302 ( 4.7A)
 1.42A 2vj1A-5zm4A:
undetectable		 2vj1A-5zm4A:
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.
2VL2_B_BEZB1162_0
(PEROXIREDOXIN-5)		 5equ SNON,SNON
(Streptomyces
nogalater) 		4 / 7 THR A 127
PRO A 126
GLY A 216
THR A 162
 AKG  A 301 (-3.0A)
None
None
None
 1.04A 2vl2B-5equA:
undetectable		 2vl2B-5equA:
24.67
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.
2VQY_A_PARA1201_2
(AAC(6')-IB)		 4xac EVDO2
(Micromonospora
carbonacea) 		3 / 3 TRP A 147
GLN A  74
TRP A 128
 AKG  A 303 (-4.0A)
None
None
 1.16A 2vqyA-4xacA:
undetectable		 2vqyA-4xacA:
20.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2XAD_E_GCSE710_1
(N-ACYL GLM
PEUDO-TEICOPLANIN
DEACETYLASE
TEICOPLANIN)		 6d3i -
(-) 		4 / 8 HIS A 270
ILE A 106
HIS A 111
ASP A 113
 CO  A 301 (-3.2A)
AKG  A 302 (-4.6A)
CO  A 301 ( 3.2A)
CO  A 301 ( 2.5A)
 1.05A 2xadA-6d3iA:
undetectable		 2xadA-6d3iA:
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.
2XAD_F_GCSF710_1
(N-ACYL GLM
PEUDO-TEICOPLANIN
DEACETYLASE
TEICOPLANIN)		 6d3i -
(-) 		4 / 8 HIS A 270
ILE A 106
HIS A 111
ASP A 113
 CO  A 301 (-3.2A)
AKG  A 302 (-4.6A)
CO  A 301 ( 3.2A)
CO  A 301 ( 2.5A)
 1.09A 2xadB-6d3iA:
undetectable		 2xadB-6d3iA:
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.
2XAD_G_GCSG710_1
(N-ACYL GLM
PEUDO-TEICOPLANIN
DEACETYLASE
TEICOPLANIN)		 6d3i -
(-) 		4 / 8 HIS A 270
ILE A 106
HIS A 111
ASP A 113
 CO  A 301 (-3.2A)
AKG  A 302 (-4.6A)
CO  A 301 ( 3.2A)
CO  A 301 ( 2.5A)
 1.05A 2xadC-6d3iA:
undetectable		 2xadC-6d3iA:
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.
2XAD_H_GCSH710_1
(N-ACYL GLM
PEUDO-TEICOPLANIN
DEACETYLASE
TEICOPLANIN)		 6d3i -
(-) 		4 / 8 HIS A 270
ILE A 106
HIS A 111
ASP A 113
 CO  A 301 (-3.2A)
AKG  A 302 (-4.6A)
CO  A 301 ( 3.2A)
CO  A 301 ( 2.5A)
 1.08A 2xadD-6d3iA:
undetectable		 2xadD-6d3iA:
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.
2Y03_A_5FWA601_1
(BETA-1 ADRENERGIC
RECEPTOR)		 1gy9 ALPHA-KETOGLUTARATE-
DEPENDENT TAURINE
DIOXYGENASE
(Escherichia
coli) 		5 / 12 TRP A 248
ASP A 101
VAL A 102
PHE A 159
ASN A  95
 None
FE  A 300 (-2.3A)
TAU  A 350 (-3.8A)
TAU  A 350 (-4.3A)
AKG  A 351 ( 3.5A)
 1.08A 2y03A-1gy9A:
undetectable		 2y03A-1gy9A:
20.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Y04_A_68HA601_1
(BETA-1 ADRENERGIC
RECEPTOR)		 1gy9 ALPHA-KETOGLUTARATE-
DEPENDENT TAURINE
DIOXYGENASE
(Escherichia
coli) 		5 / 11 TRP A 248
ASP A 101
VAL A 102
PHE A 159
ASN A  95
 None
FE  A 300 (-2.3A)
TAU  A 350 (-3.8A)
TAU  A 350 (-4.3A)
AKG  A 351 ( 3.5A)
 1.08A 2y04A-1gy9A:
undetectable		 2y04A-1gy9A:
20.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ZS9_A_PAUA603_0
(PANTOTHENATE KINASE)		 4qx8 LYSINE-SPECIFIC
DEMETHYLASE 2A
(Mus
musculus) 		4 / 6 ASP A 214
HIS A 284
TYR A 222
ASN A 142
 NI  A 601 ( 2.5A)
NI  A 601 ( 3.4A)
None
AKG  A 602 (-3.8A)
 1.08A 2zs9A-4qx8A:
undetectable		 2zs9A-4qx8A:
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.
2ZS9_A_PAUA603_0
(PANTOTHENATE KINASE)		 5cg9 TET-LIKE DIOXYGENASE
(Naegleria
gruberi) 		4 / 6 VAL A 293
ASP A 234
HIS A 297
ASN A 214
 AKG  A 402 (-4.8A)
None
None
AKG  A 402 (-3.5A)
 1.28A 2zs9A-5cg9A:
undetectable		 2zs9A-5cg9A:
20.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ZTH_A_SAMA305_1
(CATECHOL
O-METHYLTRANSFERASE)		 1bl5 ISOCITRATE
DEHYDROGENASE
(Escherichia
coli) 		3 / 3 SER A 310
GLU A 336
ASP A 307
 None
AKG  A   1 ( 4.6A)
MG  A 418 (-3.1A)
 0.71A 2zthA-1bl5A:
2.6		 2zthA-1bl5A:
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.
2ZW9_A_SAMA801_1
(LEUCINE CARBOXYL
METHYLTRANSFERASE 2)		 1drt CLAVAMINATE SYNTHASE
1
(Streptomyces
clavuligerus) 		4 / 8 THR A 172
ARG A  66
ASP A 165
GLU A 265
 AKG  A 326 (-3.0A)
None
None
None
 1.07A 2zw9A-1drtA:
2.8		 2zw9A-1drtA:
18.67
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.
2ZZM_A_SAMA401_1
(UNCHARACTERIZED
PROTEIN MJ0883)		 5o9w THEBAINE
6-O-DEMETHYLASE
(Papaver
somniferum) 		3 / 3 ARG A 305
ASP A 144
ASN A 221
 AKG  A 402 (-2.7A)
None
AKG  A 402 (-3.7A)
 0.86A 2zzmA-5o9wA:
undetectable		 2zzmA-5o9wA:
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.
3A65_A_ACAA601_1
(6-AMINOHEXANOATE-DIM
ER HYDROLASE)		 6d3i -
(-) 		5 / 12 MET A 126
VAL A  80
ASP A 113
TRP A 263
ILE A  95
 AKG  A 302 ( 4.5A)
None
CO  A 301 ( 2.5A)
None
AKG  A 302 (-4.2A)
 1.40A 3a65A-6d3iA:
undetectable		 3a65A-6d3iA:
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.
3AI8_A_HNQA255_1
(CATHEPSIN B)		 5zm4 DIOXYGENASE ANDA
(Aspergillus
stellatus) 		4 / 7 GLN A 132
GLY A 215
HIS A  74
HIS A  79
 AKG  A 302 (-3.1A)
AKG  A 302 (-3.5A)
None
AKG  A 302 (-4.2A)
 1.16A 3ai8A-5zm4A:
undetectable		 3ai8A-5zm4A:
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.
3BWM_A_SAMA301_1
(CATECHOL
O-METHYLTRANSFERASE)		 1bl5 ISOCITRATE
DEHYDROGENASE
(Escherichia
coli) 		3 / 3 SER A 310
GLU A 336
ASP A 307
 None
AKG  A   1 ( 4.6A)
MG  A 418 (-3.1A)
 0.69A 3bwmA-1bl5A:
undetectable		 3bwmA-1bl5A:
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.
3BWY_A_SAMA301_1
(COMT PROTEIN)		 1bl5 ISOCITRATE
DEHYDROGENASE
(Escherichia
coli) 		3 / 3 SER A 310
GLU A 336
ASP A 307
 None
AKG  A   1 ( 4.6A)
MG  A 418 (-3.1A)
 0.71A 3bwyA-1bl5A:
undetectable		 3bwyA-1bl5A:
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.
3D4S_A_TIMA401_1
(BETA-2 ADRENERGIC
RECEPTOR/T4-LYSOZYME
CHIMERA)		 1gy9 ALPHA-KETOGLUTARATE-
DEPENDENT TAURINE
DIOXYGENASE
(Escherichia
coli) 		5 / 12 TRP A 248
ASP A 101
VAL A 102
PHE A 159
ASN A  95
 None
FE  A 300 (-2.3A)
TAU  A 350 (-3.8A)
TAU  A 350 (-4.3A)
AKG  A 351 ( 3.5A)
 1.17A 3d4sA-1gy9A:
undetectable		 3d4sA-1gy9A:
18.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3D91_B_REMB350_1
(RENIN)		 2brt LEUCOANTHOCYANIDIN
DIOXYGENASE
(Arabidopsis
thaliana) 		5 / 12 GLN A 211
ASP A 234
VAL A 235
LEU A 249
ALA A 302
 None
FE2  A1350 (-2.6A)
NAR  A1352 (-3.8A)
AKG  A1351 ( 4.0A)
AKG  A1351 ( 3.9A)
 1.17A 3d91B-2brtA:
undetectable		 3d91B-2brtA:
19.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3EM4_V_DR7V100_2
(PROTEASE)		 2ze3 DFA0005
(Deinococcus
ficus) 		5 / 10 ASP A  82
ILE A  47
GLY A  46
LEU A 235
ILE A  71
 AKG  A 276 (-2.9A)
None
None
None
None
 1.03A 3em4V-2ze3A:
undetectable		 3em4V-2ze3A:
14.98
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.
3F8F_A_DM1A127_1
(TRANSCRIPTIONAL
REGULATOR, PADR-LIKE
FAMILY)		 4xgi GLUTAMATE
DEHYDROGENASE
(Burkholderia
thailandensis) 		5 / 10 MET A 393
ALA A 396
VAL A 400
ALA A 419
VAL A 364
 None
None
None
None
AKG  A 501 ( 4.2A)
 1.16A 3f8fA-4xgiA:
undetectable
3f8fB-4xgiA:
0.8		 3f8fA-4xgiA:
12.96
3f8fB-4xgiA:
12.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3FI0_Q_TRPQ1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 3ivu HOMOCITRATE
SYNTHASE,
MITOCHONDRIAL
(Schizosaccharomy
ces
pombe) 		4 / 8 GLN A  47
ILE A 251
VAL A 294
VAL A 298
 AKG  A1000 ( 4.9A)
None
None
None
 0.77A 3fi0Q-3ivuA:
undetectable		 3fi0Q-3ivuA:
19.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3GN0_A_DMOA551_1
(ARGINASE-1)		 3u78 LYSINE-SPECIFIC
DEMETHYLASE 7
(Homo
sapiens) 		5 / 9 HIS A 282
ASP A 284
SER A 227
ASP A 392
THR A 279
 NI  A 702 ( 3.4A)
NI  A 702 (-2.6A)
None
E67  A 707 (-3.4A)
AKG  A 701 (-3.6A)
 1.47A 3gn0A-3u78A:
undetectable		 3gn0A-3u78A:
22.53
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.
3GWV_A_RFXA801_1
(TRANSPORTER)		 1ofe FERREDOXIN-DEPENDENT
GLUTAMATE SYNTHASE 2
(Synechocystis
sp.
PCC
6803) 		5 / 12 LEU A 991
GLY A 905
LEU A 877
ILE A 988
ALA A 879
 None
None
None
None
AKG  A2510 (-3.6A)
 1.05A 3gwvA-1ofeA:
0.0		 3gwvA-1ofeA:
16.57
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.
3IJD_B_C2FB315_0
(UNCHARACTERIZED
PROTEIN)		 4npl RNA DEMETHYLASE
ALKBH5
(Danio
rerio) 		5 / 12 ILE A 212
ARG A  61
ILE A  20
THR A 185
PHE A 159
 AKG  A 301 (-4.9A)
None
None
None
None
 1.44A 3ijdB-4nplA:
undetectable		 3ijdB-4nplA:
20.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3K2H_B_LYAB514_2
(DIHYDROFOLATE
REDUCTASE/THYMIDYLAT
E SYNTHASE)		 5m0t ALPHA-KETOGLUTARATE-
DEPENDENT NON-HEME
IRON OXYGENASE EASH
(Aspergillus
japonicus) 		3 / 3 ARG A 132
THR A 115
THR A 168
 None
None
AKG  A 302 (-3.0A)
 0.79A 3k2hB-5m0tA:
undetectable		 3k2hB-5m0tA:
19.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KCX_A_CQLA1_0
(HYPOXIA-INDUCIBLE
FACTOR 1-ALPHA
INHIBITOR)		 2yu1 JMJC
DOMAIN-CONTAINING
HISTONE
DEMETHYLATION
PROTEIN 1A
(Homo
sapiens) 		6 / 10 LEU A 201
THR A 209
HIS A 212
ASP A 214
ILE A 278
HIS A 284
 None
AKG  A 701 (-3.1A)
AKG  A 701 ( 3.5A)
FE2  A 600 ( 2.1A)
None
FE2  A 600 ( 3.4A)
 0.90A 3kcxA-2yu1A:
15.9		 3kcxA-2yu1A:
21.79
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.
3KCX_A_CQLA1_0
(HYPOXIA-INDUCIBLE
FACTOR 1-ALPHA
INHIBITOR)		 2yu1 JMJC
DOMAIN-CONTAINING
HISTONE
DEMETHYLATION
PROTEIN 1A
(Homo
sapiens) 		6 / 10 THR A 209
HIS A 212
ASP A 214
LYS A 229
ILE A 278
HIS A 284
 AKG  A 701 (-3.1A)
AKG  A 701 ( 3.5A)
FE2  A 600 ( 2.1A)
AKG  A 701 (-2.9A)
None
FE2  A 600 ( 3.4A)
 0.95A 3kcxA-2yu1A:
15.9		 3kcxA-2yu1A:
21.79
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.
3KCX_A_CQLA1_0
(HYPOXIA-INDUCIBLE
FACTOR 1-ALPHA
INHIBITOR)		 3kv6 JMJC
DOMAIN-CONTAINING
HISTONE
DEMETHYLATION
PROTEIN 1D
(Homo
sapiens) 		6 / 10 LEU A 271
THR A 279
HIS A 282
ASP A 284
LYS A 299
HIS A 354
 AKG  A 702 ( 4.7A)
AKG  A 702 (-4.2A)
FE2  A 491 ( 3.6A)
FE2  A 491 ( 2.6A)
AKG  A 702 (-3.6A)
FE2  A 491 (-3.4A)
 0.93A 3kcxA-3kv6A:
15.2		 3kcxA-3kv6A:
21.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KCX_A_CQLA1_0
(HYPOXIA-INDUCIBLE
FACTOR 1-ALPHA
INHIBITOR)		 3u78 LYSINE-SPECIFIC
DEMETHYLASE 7
(Homo
sapiens) 		6 / 10 LEU A 271
THR A 279
HIS A 282
ASP A 284
LYS A 299
HIS A 354
 None
AKG  A 701 (-3.6A)
NI  A 702 ( 3.4A)
NI  A 702 (-2.6A)
AKG  A 701 (-3.2A)
NI  A 702 ( 3.5A)
 0.91A 3kcxA-3u78A:
16.2		 3kcxA-3u78A:
21.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KCX_A_CQLA1_0
(HYPOXIA-INDUCIBLE
FACTOR 1-ALPHA
INHIBITOR)		 3uyj LYSINE-SPECIFIC
DEMETHYLASE 8
(Homo
sapiens) 		7 / 10 TYR A 272
HIS A 321
ASP A 323
LYS A 336
ILE A 394
HIS A 400
TRP A 414
 AKG  A 601 (-4.7A)
NI  A 501 ( 3.2A)
NI  A 501 ( 2.4A)
AKG  A 601 (-2.6A)
None
NI  A 501 ( 3.4A)
AKG  A 601 (-4.4A)
 0.80A 3kcxA-3uyjA:
24.7		 3kcxA-3uyjA:
27.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KCX_A_CQLA1_0
(HYPOXIA-INDUCIBLE
FACTOR 1-ALPHA
INHIBITOR)		 4qu2 JMJC
DOMAIN-CONTAINING
PROTEIN 7
(Mus
musculus) 		6 / 10 TYR A 127
THR A 175
HIS A 178
ASP A 180
HIS A 277
TRP A 291
 AKG  A 502 (-4.5A)
AKG  A 502 (-3.2A)
NI  A 501 ( 3.6A)
NI  A 501 (-3.7A)
NI  A 501 ( 3.8A)
AKG  A 502 (-4.1A)
 0.92A 3kcxA-4qu2A:
21.3		 3kcxA-4qu2A:
25.28
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.
3KCX_A_CQLA1_0
(HYPOXIA-INDUCIBLE
FACTOR 1-ALPHA
INHIBITOR)		 4qu2 JMJC
DOMAIN-CONTAINING
PROTEIN 7
(Mus
musculus) 		6 / 10 TYR A 127
THR A 175
HIS A 178
ASP A 180
LYS A 193
HIS A 277
 AKG  A 502 (-4.5A)
AKG  A 502 (-3.2A)
NI  A 501 ( 3.6A)
NI  A 501 (-3.7A)
AKG  A 502 (-3.8A)
NI  A 501 ( 3.8A)
 0.73A 3kcxA-4qu2A:
21.3		 3kcxA-4qu2A:
25.28
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.
3KCX_A_CQLA1_0
(HYPOXIA-INDUCIBLE
FACTOR 1-ALPHA
INHIBITOR)		 4qx8 LYSINE-SPECIFIC
DEMETHYLASE 2A
(Mus
musculus) 		7 / 10 LEU A 201
THR A 209
HIS A 212
ASP A 214
LYS A 229
ILE A 278
HIS A 284
 None
AKG  A 602 (-3.4A)
NI  A 601 ( 3.2A)
NI  A 601 ( 2.5A)
AKG  A 602 (-2.9A)
None
NI  A 601 ( 3.4A)
 0.91A 3kcxA-4qx8A:
15.4		 3kcxA-4qx8A:
20.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KCX_A_CQLA1_0
(HYPOXIA-INDUCIBLE
FACTOR 1-ALPHA
INHIBITOR)		 5epa SNOK
(Streptomyces
nogalater) 		5 / 10 LEU A 108
THR A 118
HIS A 121
ASP A 123
HIS A 210
 AKG  A 301 ( 3.7A)
AKG  A 301 (-3.2A)
FE  A 300 ( 3.3A)
FE  A 300 ( 2.5A)
FE  A 300 ( 3.3A)
 0.73A 3kcxA-5epaA:
11.1		 3kcxA-5epaA:
20.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KCX_A_CQLA1_0
(HYPOXIA-INDUCIBLE
FACTOR 1-ALPHA
INHIBITOR)		 5equ SNON,SNON
(Streptomyces
nogalater) 		5 / 10 LEU A 114
THR A 127
HIS A 130
ASP A 132
HIS A 213
 AKG  A 301 (-4.6A)
AKG  A 301 (-3.0A)
FE  A 300 (-3.1A)
FE  A 300 (-2.2A)
FE  A 300 ( 3.2A)
 0.46A 3kcxA-5equA:
8.6		 3kcxA-5equA:
18.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KCX_A_CQLA1_0
(HYPOXIA-INDUCIBLE
FACTOR 1-ALPHA
INHIBITOR)		 5nfn JMJC
DOMAIN-CONTAINING
PROTEIN 7
(Homo
sapiens) 		7 / 10 TYR A 127
THR A 175
HIS A 178
ASP A 180
LYS A 193
HIS A 277
TRP A 291
 None
AKG  A 502 (-3.3A)
MN  A 501 ( 3.2A)
MN  A 501 ( 2.5A)
AKG  A 502 (-3.3A)
MN  A 501 ( 3.3A)
AKG  A 502 (-4.5A)
 0.74A 3kcxA-5nfnA:
21.7		 3kcxA-5nfnA:
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.
3KCX_A_CQLA1_0
(HYPOXIA-INDUCIBLE
FACTOR 1-ALPHA
INHIBITOR)		 5uqd DUMPY: SHORTER THAN
WILD-TYPE
(Caenorhabditis
elegans) 		5 / 10 THR A1449
HIS A1452
ASP A1454
LYS A1526
HIS A1593
 AKG  A1701 (-3.6A)
FE2  A1702 ( 3.3A)
FE2  A1702 (-2.6A)
AKG  A1701 (-3.6A)
FE2  A1702 ( 3.3A)
 0.53A 3kcxA-5uqdA:
13.9		 3kcxA-5uqdA:
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.
3KEE_B_30BB500_2
(GENOME POLYPROTEIN)		 5j4r WELO5
(Hapalosiphon
welwitschii) 		3 / 3 PHE A 252
TYR A 206
LEU A  15
 AKG  A 301 (-4.8A)
None
None
 0.76A 3keeB-5j4rA:
undetectable		 3keeB-5j4rA:
23.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3LD6_A_KKKA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 5ui3 DIHYDRODIPICOLINATE
SYNTHASE
(Chlamydomonas
reinhardtii) 		5 / 12 PHE D 116
GLY D 149
ALA D 151
ILE D  63
ILE D  32
 None
None
None
AKG  D 401 ( 4.9A)
None
 1.06A 3ld6A-5ui3D:
undetectable		 3ld6A-5ui3D:
10.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3LN1_A_CELA682_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3la2 GLOBAL NITROGEN
REGULATOR
(Nostoc
sp.
PCC
7120) 		5 / 12 VAL A 108
LEU A 112
GLY A  76
SER A  79
LEU A  80
 None
None
AKG  A 224 (-3.1A)
None
None
 1.05A 3ln1A-3la2A:
undetectable		 3ln1A-3la2A:
18.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3LN1_B_CELB682_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3la2 GLOBAL NITROGEN
REGULATOR
(Nostoc
sp.
PCC
7120) 		5 / 12 VAL A 108
LEU A 112
GLY A  76
SER A  79
LEU A  80
 None
None
AKG  A 224 (-3.1A)
None
None
 1.04A 3ln1B-3la2A:
undetectable		 3ln1B-3la2A:
18.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3LN1_C_CELC682_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3la2 GLOBAL NITROGEN
REGULATOR
(Nostoc
sp.
PCC
7120) 		5 / 12 VAL A 108
LEU A 112
GLY A  76
SER A  79
LEU A  80
 None
None
AKG  A 224 (-3.1A)
None
None
 1.05A 3ln1C-3la2A:
undetectable		 3ln1C-3la2A:
18.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3MG0_K_BO2K1402_1
(PROTEASOME COMPONENT
PRE2
PROTEASOME COMPONENT
C5)		 5epa SNOK
(Streptomyces
nogalater) 		5 / 11 ALA A 223
VAL A  66
ALA A 214
ALA A 212
SER A 217
 None
None
None
AKG  A 301 (-3.4A)
None
 0.92A 3mg0K-5epaA:
undetectable
3mg0L-5epaA:
undetectable		 3mg0K-5epaA:
23.10
3mg0L-5epaA:
19.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3N23_C_OBNC1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)		 1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE
(Streptomyces
clavuligerus) 		5 / 11 PRO A 241
LEU A  26
VAL A 137
ALA A 134
PHE A 264
 None
None
None
None
AKG  A 902 (-4.9A)
 1.30A 3n23C-1e5iA:
undetectable		 3n23C-1e5iA:
15.82
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.
3N8W_A_FLPA701_1
(PROSTAGLANDIN G/H
SYNTHASE 1)		 3la2 GLOBAL NITROGEN
REGULATOR
(Nostoc
sp.
PCC
7120) 		5 / 12 VAL A 108
LEU A 112
GLY A  76
SER A  79
LEU A  80
 None
None
AKG  A 224 (-3.1A)
None
None
 0.94A 3n8wA-3la2A:
undetectable		 3n8wA-3la2A:
18.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3N8Z_A_FLPA701_1
(PROSTAGLANDIN G/H
SYNTHASE 1)		 3la2 GLOBAL NITROGEN
REGULATOR
(Nostoc
sp.
PCC
7120) 		5 / 12 VAL A 108
LEU A 112
GLY A  76
SER A  79
LEU A  80
 None
None
AKG  A 224 (-3.1A)
None
None
 0.94A 3n8zA-3la2A:
undetectable		 3n8zA-3la2A:
18.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NT1_A_NPSA5_1
(PROSTAGLANDIN-ENDOPE
ROXIDE SYNTHASE 2)		 3la2 GLOBAL NITROGEN
REGULATOR
(Nostoc
sp.
PCC
7120) 		5 / 12 VAL A 108
LEU A 112
GLY A  76
SER A  79
LEU A  80
 None
None
AKG  A 224 (-3.1A)
None
None
 1.00A 3nt1A-3la2A:
undetectable		 3nt1A-3la2A:
18.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3OCT_A_1N1A663_2
(TYROSINE-PROTEIN
KINASE BTK)		 5ijz NADP-SPECIFIC
GLUTAMATE
DEHYDROGENASE
(Corynebacterium
glutamicum) 		4 / 5 PHE A 365
ILE A 224
ASN A 347
PHE A 341
 None
None
AKG  A 502 ( 3.6A)
None
 1.38A 3octA-5ijzA:
undetectable		 3octA-5ijzA:
18.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3OU7_B_SAMB300_0
(SAM-DEPENDENT
METHYLTRANSFERASE)		 3obz PHYTANOYL-COA
DIOXYGENASE
DOMAIN-CONTAINING
PROTEIN 1
(Homo
sapiens) 		5 / 12 LEU A 278
GLY A 104
GLY A  74
SER A  73
HIS A 263
 None
None
None
None
AKG  A 481 ( 4.8A)
 1.14A 3ou7B-3obzA:
undetectable		 3ou7B-3obzA:
21.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3OXV_A_478A200_1
(HIV-1 PROTEASE)		 5j4r WELO5
(Hapalosiphon
welwitschii) 		4 / 6 GLU A 202
PRO A 269
ARG A 270
GLY A 200
 None
None
AKG  A 301 (-2.6A)
None
 1.46A 3oxvA-5j4rA:
undetectable		 3oxvA-5j4rA:
17.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3PGH_C_FLPC701_1
(CYCLOOXYGENASE-2)		 3la2 GLOBAL NITROGEN
REGULATOR
(Nostoc
sp.
PCC
7120) 		5 / 12 VAL A 108
LEU A 112
GLY A  76
SER A  79
LEU A  80
 None
None
AKG  A 224 (-3.1A)
None
None
 0.96A 3pghC-3la2A:
undetectable		 3pghC-3la2A:
18.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3PGH_D_FLPD701_1
(CYCLOOXYGENASE-2)		 3la2 GLOBAL NITROGEN
REGULATOR
(Nostoc
sp.
PCC
7120) 		5 / 12 VAL A 108
LEU A 112
GLY A  76
SER A  79
LEU A  80
 None
None
AKG  A 224 (-3.1A)
None
None
 0.97A 3pghD-3la2A:
undetectable		 3pghD-3la2A:
18.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3PP7_B_SVRB499_1
(PYRUVATE KINASE)		 3qfk UNCHARACTERIZED
PROTEIN
(Staphylococcus
aureus) 		5 / 10 THR A 346
ASN A 459
GLY A 466
TYR A 469
ALA A 347
 None
AKG  A 514 ( 4.0A)
None
None
None
 1.28A 3pp7B-3qfkA:
5.0		 3pp7B-3qfkA:
23.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3QF1_A_PZEA6951_1
(LACTOPEROXIDASE)		 2vdc GLUTAMATE SYNTHASE
[NADPH] LARGE CHAIN
(Azospirillum
brasilense) 		3 / 3 HIS A 971
ARG A 914
GLU A 886
 None
None
AKG  A2475 (-4.2A)
 1.15A 3qf1A-2vdcA:
undetectable		 3qf1A-2vdcA:
18.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3QL6_A_NIMA614_1
(LACTOPEROXIDASE)		 3w21 PUTATIVE
UNCHARACTERIZED
PROTEIN
(Burkholderia
ambifaria) 		4 / 7 HIS A 155
GLU A 249
PHE A 181
PRO A 232
 ZN  A 301 ( 3.4A)
None
AKG  A 302 (-3.5A)
None
 1.37A 3ql6A-3w21A:
undetectable		 3ql6A-3w21A:
19.52
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.
3RR3_A_FLRA700_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3la2 GLOBAL NITROGEN
REGULATOR
(Nostoc
sp.
PCC
7120) 		5 / 12 VAL A 108
LEU A 112
GLY A  76
SER A  79
LEU A  80
 None
None
AKG  A 224 (-3.1A)
None
None
 1.02A 3rr3A-3la2A:
undetectable		 3rr3A-3la2A:
18.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3RR3_B_FLRB700_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3la2 GLOBAL NITROGEN
REGULATOR
(Nostoc
sp.
PCC
7120) 		5 / 12 VAL A 108
LEU A 112
GLY A  76
SER A  79
LEU A  80
 None
None
AKG  A 224 (-3.1A)
None
None
 1.02A 3rr3B-3la2A:
undetectable		 3rr3B-3la2A:
18.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3SUE_B_SUEB1201_2
(NS3 PROTEASE, NS4A
PROTEIN)		 5j4r WELO5
(Hapalosiphon
welwitschii) 		3 / 3 PHE A 252
TYR A 206
LEU A  15
 AKG  A 301 (-4.8A)
None
None
 0.68A 3sueB-5j4rA:
undetectable		 3sueB-5j4rA:
22.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3T01_A_PPFA503_1
(PHOSPHONOACETATE
HYDROLASE)		 2iuw ALKYLATED REPAIR
PROTEIN ALKB HOMOLOG
3
(Homo
sapiens) 		4 / 7 ASN A 271
ASP A 193
HIS A 191
HIS A 257
 AKG  A 700 (-3.4A)
FE  A 500 ( 2.6A)
FE  A 500 ( 3.3A)
FE  A 500 ( 3.3A)
 1.00A 3t01A-2iuwA:
undetectable		 3t01A-2iuwA:
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.
3T01_A_PPFA503_1
(PHOSPHONOACETATE
HYDROLASE)		 3tht ALKYLATED DNA REPAIR
PROTEIN ALKB HOMOLOG
8
(Homo
sapiens) 		4 / 7 ASN A 227
ASP A 240
ILE A 235
HIS A 292
 AKG  A 403 (-3.2A)
MN  A 402 ( 2.6A)
AKG  A 403 (-4.4A)
MN  A 402 ( 3.6A)
 1.03A 3t01A-3thtA:
undetectable		 3t01A-3thtA:
21.49
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.
3T01_A_PPFA503_1
(PHOSPHONOACETATE
HYDROLASE)		 4npl RNA DEMETHYLASE
ALKBH5
(Danio
rerio) 		4 / 7 ASN A 124
ASP A 137
ILE A 132
HIS A 197
 AKG  A 301 (-3.1A)
MN  A 300 (-2.8A)
AKG  A 301 (-4.3A)
MN  A 300 ( 3.4A)
 1.03A 3t01A-4nplA:
undetectable		 3t01A-4nplA:
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.
3UCB_B_017B202_1
(PROTEASE)		 4nao PUTATIVE OXYGENASE
(Claviceps
purpurea) 		4 / 7 LYS A 226
ARG A 228
GLY A 132
PRO A 133
 None
AKG  A 402 (-2.9A)
None
None
 1.30A 3ucbB-4naoA:
undetectable		 3ucbB-4naoA:
17.18
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.
3V3O_A_T1CA404_1
(TETX2 PROTEIN)		 6d3i -
(-) 		5 / 12 THR A 115
ASN A 218
HIS A 111
GLY A 107
GLY A 195
 None
None
CO  A 301 ( 3.2A)
AKG  A 302 (-3.1A)
None
 1.25A 3v3oA-6d3iA:
undetectable		 3v3oA-6d3iA:
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.
3VWQ_A_ACAA601_1
(6-AMINOHEXANOATE-DIM
ER HYDROLASE)		 2ze3 DFA0005
(Deinococcus
ficus) 		5 / 12 ALA A 226
PHE A 186
ASN A 208
GLY A 225
ILE A 196
 None
AKG  A 276 ( 4.8A)
None
None
None
 1.48A 3vwqA-2ze3A:
undetectable		 3vwqA-2ze3A:
23.37
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.
3VWR_A_ACAA601_1
(6-AMINOHEXANOATE-DIM
ER HYDROLASE)		 2ze3 DFA0005
(Deinococcus
ficus) 		5 / 11 ALA A 226
PHE A 186
ASN A 208
GLY A 225
ILE A 196
 None
AKG  A 276 ( 4.8A)
None
None
None
 1.48A 3vwrA-2ze3A:
0.0		 3vwrA-2ze3A:
23.37
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.
4AC9_C_DXCC1478_0
(MJ0495-LIKE PROTEIN)		 3ivu HOMOCITRATE
SYNTHASE,
MITOCHONDRIAL
(Schizosaccharomy
ces
pombe) 		4 / 7 SER A 166
GLY A 127
THR A 128
THR A 197
 None
None
None
AKG  A1000 (-2.9A)
 0.65A 4ac9C-3ivuA:
3.6		 4ac9C-3ivuA:
22.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ACA_C_DXCC1478_0
(TRANSLATION
ELONGATION FACTOR
SELB)		 3ivu HOMOCITRATE
SYNTHASE,
MITOCHONDRIAL
(Schizosaccharomy
ces
pombe) 		4 / 7 SER A 166
GLY A 127
THR A 128
THR A 197
 None
None
None
AKG  A1000 (-2.9A)
 0.63A 4acaC-3ivuA:
3.5		 4acaC-3ivuA:
22.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4AFT_D_QMRD301_1
(SOLUBLE
ACETYLCHOLINE
RECEPTOR)		 2yu1 JMJC
DOMAIN-CONTAINING
HISTONE
DEMETHYLATION
PROTEIN 1A
(Homo
sapiens) 		4 / 8 VAL A 230
TYR A 274
VAL A 286
ILE A 268
 None
None
AKG  A 701 (-4.2A)
None
 1.15A 4aftD-2yu1A:
undetectable
4aftE-2yu1A:
undetectable		 4aftD-2yu1A:
18.81
4aftE-2yu1A:
18.81
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.
4AMJ_A_CVDA1359_1
(BETA-1 ADRENERGIC
RECEPTOR)		 1gy9 ALPHA-KETOGLUTARATE-
DEPENDENT TAURINE
DIOXYGENASE
(Escherichia
coli) 		5 / 12 TRP A 248
ASP A 101
VAL A 102
PHE A 159
ASN A  95
 None
FE  A 300 (-2.3A)
TAU  A 350 (-3.8A)
TAU  A 350 (-4.3A)
AKG  A 351 ( 3.5A)
 1.03A 4amjA-1gy9A:
undetectable		 4amjA-1gy9A:
20.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4BQF_A_QPSA951_1
(ALPHA-GLUCAN
PHOSPHORYLASE 2,
CYTOSOLIC)		 2vdc GLUTAMATE SYNTHASE
[NADPH] LARGE CHAIN
(Azospirillum
brasilense) 		4 / 6 MET A 860
GLY A 861
ARG A 893
GLU A 866
 None
AKG  A2475 ( 4.8A)
None
None
 1.34A 4bqfA-2vdcA:
undetectable		 4bqfA-2vdcA:
20.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4EIL_E_FOLE703_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE
(Streptomyces
clavuligerus) 		5 / 11 VAL A 137
PHE A 264
LEU A 191
VAL A 133
THR A 234
 None
AKG  A 902 (-4.9A)
None
None
None
 1.35A 4eilE-1e5iA:
undetectable		 4eilE-1e5iA:
20.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4F4D_B_CHDB503_0
(FERROCHELATASE,
MITOCHONDRIAL)		 6d3i -
(-) 		4 / 8 ILE A  95
ARG A 281
PRO A 121
VAL A 124
 AKG  A 302 (-4.2A)
AKG  A 302 (-3.1A)
None
None
 1.33A 4f4dB-6d3iA:
undetectable		 4f4dB-6d3iA:
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.
4F4D_B_CHDB503_0
(FERROCHELATASE,
MITOCHONDRIAL)		 6d3i -
(-) 		4 / 8 ILE A 106
ARG A 281
PRO A 121
VAL A 124
 AKG  A 302 (-4.6A)
AKG  A 302 (-3.1A)
None
None
 1.34A 4f4dB-6d3iA:
undetectable		 4f4dB-6d3iA:
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.
4F5Z_A_BEZA302_0
(HALOALKANE
DEHALOGENASE)		 5ybp PRHA
(Penicillium
brasilianum) 		4 / 8 ASN A 152
ASP A 132
PHE A 154
HIS A 214
 None
FE  A 301 ( 2.5A)
AKG  A 302 (-4.4A)
FE  A 301 ( 3.2A)
 1.16A 4f5zA-5ybpA:
undetectable		 4f5zA-5ybpA:
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.
4F84_A_SAMA501_0
(GERANYL DIPHOSPHATE
2-C-METHYLTRANSFERAS
E)		 5ijz NADP-SPECIFIC
GLUTAMATE
DEHYDROGENASE
(Corynebacterium
glutamicum) 		5 / 12 GLY A 129
GLY A  93
VAL A  82
GLN A 113
VAL A 101
 None
AKG  A 502 (-3.4A)
None
AKG  A 502 (-2.9A)
None
 1.15A 4f84A-5ijzA:
3.9		 4f84A-5ijzA:
20.74
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.
4G77_A_TLFA711_0
(LACTOTRANSFERRIN)		 3kv6 JMJC
DOMAIN-CONTAINING
HISTONE
DEMETHYLATION
PROTEIN 1D
(Homo
sapiens) 		4 / 7 HIS A 354
ALA A 355
VAL A 356
ALA A 117
 FE2  A 491 (-3.4A)
None
AKG  A 702 (-4.0A)
None
 0.61A 4g77A-3kv6A:
undetectable		 4g77A-3kv6A:
22.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4G77_A_TLFA711_0
(LACTOTRANSFERRIN)		 3u78 LYSINE-SPECIFIC
DEMETHYLASE 7
(Homo
sapiens) 		4 / 7 HIS A 354
ALA A 355
VAL A 356
ALA A 117
 NI  A 702 ( 3.5A)
None
AKG  A 701 (-4.1A)
None
 0.70A 4g77A-3u78A:
undetectable		 4g77A-3u78A:
23.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4I90_A_ACTA500_0
(1-PHOSPHATIDYLINOSIT
OL PHOSPHODIESTERASE)		 2fct SYRINGOMYCIN
BIOSYNTHESIS ENZYME
2
(Pseudomonas
syringae) 		3 / 3 LYS A 106
ARG A 248
TRP A 145
 AKG  A 897 (-4.2A)
AKG  A 897 (-2.8A)
AKG  A 897 (-4.0A)
 0.89A 4i90A-2fctA:
undetectable		 4i90A-2fctA:
21.97
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.
4I90_A_ACTA500_0
(1-PHOSPHATIDYLINOSIT
OL PHOSPHODIESTERASE)		 3gjb CYTC3
(Streptomyces
sp.) 		3 / 3 LYS A 108
ARG A 253
TRP A 150
 AKG  A 321 (-2.4A)
AKG  A 321 (-3.4A)
None
 1.43A 4i90A-3gjbA:
undetectable		 4i90A-3gjbA:
22.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4I90_A_ACTA500_0
(1-PHOSPHATIDYLINOSIT
OL PHOSPHODIESTERASE)		 3obz PHYTANOYL-COA
DIOXYGENASE
DOMAIN-CONTAINING
PROTEIN 1
(Homo
sapiens) 		3 / 3 LYS A 145
ARG A 257
TRP A 174
 AKG  A 481 (-4.1A)
AKG  A 481 (-2.7A)
AKG  A 481 (-4.2A)
 1.33A 4i90A-3obzA:
undetectable		 4i90A-3obzA:
19.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4I90_A_ACTA500_0
(1-PHOSPHATIDYLINOSIT
OL PHOSPHODIESTERASE)		 5epa SNOK
(Streptomyces
nogalater) 		3 / 3 LYS A 110
ARG A 221
TRP A 139
 AKG  A 301 (-4.2A)
AKG  A 301 (-2.7A)
AKG  A 301 (-4.3A)
 1.24A 4i90A-5epaA:
undetectable		 4i90A-5epaA:
19.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4I90_A_ACTA500_0
(1-PHOSPHATIDYLINOSIT
OL PHOSPHODIESTERASE)		 5equ SNON,SNON
(Streptomyces
nogalater) 		3 / 3 LYS A 116
ARG A 224
TRP A 148
 AKG  A 301 ( 4.2A)
AKG  A 301 (-2.7A)
AKG  A 301 (-3.9A)
 1.14A 4i90A-5equA:
undetectable		 4i90A-5equA:
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.
4IKJ_A_SUZA201_1
(TRANSTHYRETIN)		 3uyj LYSINE-SPECIFIC
DEMETHYLASE 8
(Homo
sapiens) 		4 / 7 LEU A 392
LEU A 329
SER A 410
SER A 408
 None
AKG  A 601 ( 4.4A)
AKG  A 601 ( 4.7A)
None
 0.95A 4ikjA-3uyjA:
undetectable
4ikjB-3uyjA:
undetectable		 4ikjA-3uyjA:
18.55
4ikjB-3uyjA:
18.55
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.
4J24_A_ESTA600_1
(ESTROGEN RECEPTOR
BETA)		 3w21 PUTATIVE
UNCHARACTERIZED
PROTEIN
(Burkholderia
ambifaria) 		5 / 12 MET A  40
LEU A 237
ARG A 141
ILE A  23
ILE A  27
 None
None
AKG  A 302 (-3.7A)
None
None
 1.14A 4j24A-3w21A:
undetectable		 4j24A-3w21A:
21.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4J24_B_ESTB600_1
(ESTROGEN RECEPTOR
BETA)		 3w21 PUTATIVE
UNCHARACTERIZED
PROTEIN
(Burkholderia
ambifaria) 		5 / 12 MET A  40
LEU A 237
ARG A 141
ILE A  23
ILE A  27
 None
None
AKG  A 302 (-3.7A)
None
None
 1.16A 4j24B-3w21A:
undetectable		 4j24B-3w21A:
21.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4J4V_C_SVRC301_1
(NUCLEOCAPSID PROTEIN)		 3w21 PUTATIVE
UNCHARACTERIZED
PROTEIN
(Burkholderia
ambifaria) 		4 / 8 GLY A 179
ARG A 199
PHE A 272
ILE A 263
 AKG  A 302 ( 4.8A)
None
None
None
 0.97A 4j4vC-3w21A:
undetectable		 4j4vC-3w21A:
21.30
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.
4KLR_A_CHDA504_0
(FERROCHELATASE,
MITOCHONDRIAL)		 3tht ALKYLATED DNA REPAIR
PROTEIN ALKB HOMOLOG
8
(Homo
sapiens) 		4 / 7 LEU A 152
ARG A 328
PRO A 221
VAL A 250
 None
AKG  A 403 (-3.2A)
None
None
 1.20A 4klrA-3thtA:
undetectable		 4klrA-3thtA:
22.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4MS4_A_2C0A501_1
(GAMMA-AMINOBUTYRIC
ACID TYPE B RECEPTOR
SUBUNIT 1)		 4p7w L-PROLINE
CIS-4-HYDROXYLASE
(Mesorhizobium
japonicum) 		4 / 8 SER A 155
HIS A 106
ILE A  97
TRP A  40
 None
CO  A 301 ( 3.3A)
None
AKG  A 302 (-4.2A)
 1.09A 4ms4A-4p7wA:
undetectable		 4ms4A-4p7wA:
19.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4NKV_A_AERA601_2
(STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE)		 3kv6 JMJC
DOMAIN-CONTAINING
HISTONE
DEMETHYLATION
PROTEIN 1D
(Homo
sapiens) 		4 / 5 LEU A 271
ASP A 284
GLU A 229
VAL A 241
 AKG  A 702 ( 4.7A)
FE2  A 491 ( 2.6A)
None
None
 0.84A 4nkvA-3kv6A:
undetectable		 4nkvA-3kv6A:
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.
4NKX_B_STRB601_2
(STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE)		 3kv6 JMJC
DOMAIN-CONTAINING
HISTONE
DEMETHYLATION
PROTEIN 1D
(Homo
sapiens) 		4 / 5 LEU A 271
ASP A 284
GLU A 229
VAL A 241
 AKG  A 702 ( 4.7A)
FE2  A 491 ( 2.6A)
None
None
 0.81A 4nkxB-3kv6A:
undetectable		 4nkxB-3kv6A:
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.
4OBW_C_SAMC601_0
(2-METHOXY-6-POLYPREN
YL-1,4-BENZOQUINOL
METHYLASE,
MITOCHONDRIAL)		 2ze3 DFA0005
(Deinococcus
ficus) 		5 / 12 ASN A 149
GLY A  41
ASP A  82
ILE A  77
SER A 230
 None
None
AKG  A 276 (-2.9A)
None
AKG  A 276 (-2.7A)
 1.17A 4obwC-2ze3A:
undetectable		 4obwC-2ze3A:
22.71
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.
4OKT_A_198A1001_1
(ANDROGEN RECEPTOR)		 2a1x PHYTANOYL-COA
DIOXYGENASE
(Homo
sapiens) 		5 / 12 LEU A 206
GLY A 265
ARG A 275
MET A 157
ILE A 236
 None
None
AKG  A 451 (-3.2A)
AKG  A 451 (-3.3A)
None
 1.39A 4oktA-2a1xA:
undetectable		 4oktA-2a1xA:
21.91
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.
4P6X_G_HCYG900_2
(GLUCOCORTICOID
RECEPTOR)		 1drt CLAVAMINATE SYNTHASE
1
(Streptomyces
clavuligerus) 		3 / 3 LEU A 159
MET A  94
TYR A 124
 AKG  A 326 (-4.9A)
None
None
 0.78A 4p6xG-1drtA:
undetectable		 4p6xG-1drtA:
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.
4PH9_A_IBPA601_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3la2 GLOBAL NITROGEN
REGULATOR
(Nostoc
sp.
PCC
7120) 		5 / 10 VAL A 108
LEU A 112
GLY A  76
SER A  79
LEU A  80
 None
None
AKG  A 224 (-3.1A)
None
None
 0.92A 4ph9A-3la2A:
undetectable		 4ph9A-3la2A:
18.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4PH9_B_IBPB601_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3la2 GLOBAL NITROGEN
REGULATOR
(Nostoc
sp.
PCC
7120) 		5 / 10 VAL A 108
LEU A 112
GLY A  76
SER A  79
LEU A  80
 None
None
AKG  A 224 (-3.1A)
None
None
 0.91A 4ph9B-3la2A:
undetectable		 4ph9B-3la2A:
18.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QCK_A_ASDA404_1
(3-KETOSTEROID-9-ALPH
A-MONOOXYGENASE
OXYGENASE SUBUNIT)		 5zm4 DIOXYGENASE ANDA
(Aspergillus
stellatus) 		5 / 12 LEU A 123
ALA A 230
MET A 156
ASN A 158
GLY A 214
 AKG  A 302 ( 3.6A)
9FU  A 303 (-3.5A)
9FU  A 303 ( 4.0A)
9FU  A 303 (-4.3A)
AKG  A 302 ( 3.9A)
 1.09A 4qckA-5zm4A:
undetectable		 4qckA-5zm4A:
undetectable
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QKN_A_JMSA602_1
(ALPHA-KETOGLUTARATE-
DEPENDENT
DIOXYGENASE FTO)		 5f8p ALPHA-KETOGLUTARATE-
DEPENDENT
DIOXYGENASE FTO
(Homo
sapiens) 		6 / 8 LEU A  90
THR A  92
PRO A  93
ARG A  96
LEU A 109
HIS A 231
 FIJ  A 602 (-3.9A)
FIJ  A 602 (-3.7A)
FIJ  A 602 (-4.5A)
AKG  A 603 (-3.4A)
FIJ  A 602 (-4.7A)
FIJ  A 602 (-4.0A)
 0.72A 4qknA-5f8pA:
56.8		 4qknA-5f8pA:
99.58
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QKN_A_JMSA602_1
(ALPHA-KETOGLUTARATE-
DEPENDENT
DIOXYGENASE FTO)		 5f8p ALPHA-KETOGLUTARATE-
DEPENDENT
DIOXYGENASE FTO
(Homo
sapiens) 		7 / 8 LEU A  90
THR A  92
PRO A  93
LEU A 109
VAL A 228
SER A 229
HIS A 231
 FIJ  A 602 (-3.9A)
FIJ  A 602 (-3.7A)
FIJ  A 602 (-4.5A)
FIJ  A 602 (-4.7A)
AKG  A 603 ( 4.7A)
FIJ  A 602 (-2.9A)
FIJ  A 602 (-4.0A)
 0.71A 4qknA-5f8pA:
56.8		 4qknA-5f8pA:
99.58
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.
4QVL_B_BO2B201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 5m0t ALPHA-KETOGLUTARATE-
DEPENDENT NON-HEME
IRON OXYGENASE EASH
(Aspergillus
japonicus) 		5 / 11 THR A 121
THR A 216
GLY A 212
ALA A 167
THR A 168
 None
None
None
None
AKG  A 302 (-3.0A)
 1.43A 4qvlV-5m0tA:
undetectable
4qvlb-5m0tA:
undetectable		 4qvlV-5m0tA:
23.23
4qvlb-5m0tA:
20.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QVL_N_BO2N201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 5m0t ALPHA-KETOGLUTARATE-
DEPENDENT NON-HEME
IRON OXYGENASE EASH
(Aspergillus
japonicus) 		5 / 11 THR A 121
THR A 216
GLY A 212
ALA A 167
THR A 168
 None
None
None
None
AKG  A 302 (-3.0A)
 1.43A 4qvlH-5m0tA:
undetectable
4qvlN-5m0tA:
undetectable		 4qvlH-5m0tA:
23.23
4qvlN-5m0tA:
20.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QVM_B_BO2B201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 5m0t ALPHA-KETOGLUTARATE-
DEPENDENT NON-HEME
IRON OXYGENASE EASH
(Aspergillus
japonicus) 		5 / 11 THR A 121
THR A 216
GLY A 212
ALA A 167
THR A 168
 None
None
None
None
AKG  A 302 (-3.0A)
 1.43A 4qvmV-5m0tA:
undetectable
4qvmb-5m0tA:
undetectable		 4qvmV-5m0tA:
23.23
4qvmb-5m0tA:
20.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QVM_N_BO2N201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 5m0t ALPHA-KETOGLUTARATE-
DEPENDENT NON-HEME
IRON OXYGENASE EASH
(Aspergillus
japonicus) 		5 / 11 THR A 121
THR A 216
GLY A 212
ALA A 167
THR A 168
 None
None
None
None
AKG  A 302 (-3.0A)
 1.43A 4qvmH-5m0tA:
undetectable
4qvmN-5m0tA:
undetectable		 4qvmH-5m0tA:
23.23
4qvmN-5m0tA:
20.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QVW_B_BO2B201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 5m0t ALPHA-KETOGLUTARATE-
DEPENDENT NON-HEME
IRON OXYGENASE EASH
(Aspergillus
japonicus) 		5 / 11 THR A 121
THR A 216
GLY A 212
ALA A 167
THR A 168
 None
None
None
None
AKG  A 302 (-3.0A)
 1.42A 4qvwV-5m0tA:
undetectable
4qvwb-5m0tA:
undetectable		 4qvwV-5m0tA:
23.23
4qvwb-5m0tA:
20.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QVW_N_BO2N201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 5m0t ALPHA-KETOGLUTARATE-
DEPENDENT NON-HEME
IRON OXYGENASE EASH
(Aspergillus
japonicus) 		5 / 11 THR A 121
THR A 216
GLY A 212
ALA A 167
THR A 168
 None
None
None
None
AKG  A 302 (-3.0A)
 1.42A 4qvwH-5m0tA:
undetectable
4qvwN-5m0tA:
undetectable		 4qvwH-5m0tA:
23.23
4qvwN-5m0tA:
20.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QW0_B_BO2B201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 5m0t ALPHA-KETOGLUTARATE-
DEPENDENT NON-HEME
IRON OXYGENASE EASH
(Aspergillus
japonicus) 		5 / 11 THR A 121
THR A 216
GLY A 212
ALA A 167
THR A 168
 None
None
None
None
AKG  A 302 (-3.0A)
 1.42A 4qw0V-5m0tA:
undetectable
4qw0b-5m0tA:
undetectable		 4qw0V-5m0tA:
23.23
4qw0b-5m0tA:
20.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QW0_K_BO2K301_1
(PROTEASOME SUBUNIT
BETA TYPE-5)		 5m0t ALPHA-KETOGLUTARATE-
DEPENDENT NON-HEME
IRON OXYGENASE EASH
(Aspergillus
japonicus) 		4 / 7 ALA A 211
THR A 168
ALA A 167
THR A 121
 AKG  A 302 (-3.4A)
AKG  A 302 (-3.0A)
None
None
 0.77A 4qw0K-5m0tA:
undetectable		 4qw0K-5m0tA:
21.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QW0_N_BO2N201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 5m0t ALPHA-KETOGLUTARATE-
DEPENDENT NON-HEME
IRON OXYGENASE EASH
(Aspergillus
japonicus) 		5 / 11 THR A 121
THR A 216
GLY A 212
ALA A 167
THR A 168
 None
None
None
None
AKG  A 302 (-3.0A)
 1.42A 4qw0H-5m0tA:
undetectable
4qw0N-5m0tA:
undetectable		 4qw0H-5m0tA:
23.23
4qw0N-5m0tA:
20.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QW0_Y_BO2Y301_1
(PROTEASOME SUBUNIT
BETA TYPE-5)		 5m0t ALPHA-KETOGLUTARATE-
DEPENDENT NON-HEME
IRON OXYGENASE EASH
(Aspergillus
japonicus) 		4 / 7 ALA A 211
THR A 168
ALA A 167
THR A 121
 AKG  A 302 (-3.4A)
AKG  A 302 (-3.0A)
None
None
 0.77A 4qw0Y-5m0tA:
undetectable		 4qw0Y-5m0tA:
21.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QW1_B_BO2B201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 5m0t ALPHA-KETOGLUTARATE-
DEPENDENT NON-HEME
IRON OXYGENASE EASH
(Aspergillus
japonicus) 		5 / 11 THR A 121
THR A 216
GLY A 212
ALA A 167
THR A 168
 None
None
None
None
AKG  A 302 (-3.0A)
 1.45A 4qw1V-5m0tA:
undetectable
4qw1b-5m0tA:
undetectable		 4qw1V-5m0tA:
23.23
4qw1b-5m0tA:
20.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QW1_N_BO2N201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 5m0t ALPHA-KETOGLUTARATE-
DEPENDENT NON-HEME
IRON OXYGENASE EASH
(Aspergillus
japonicus) 		5 / 11 THR A 121
THR A 216
GLY A 212
ALA A 167
THR A 168
 None
None
None
None
AKG  A 302 (-3.0A)
 1.45A 4qw1H-5m0tA:
undetectable
4qw1N-5m0tA:
undetectable		 4qw1H-5m0tA:
23.23
4qw1N-5m0tA:
20.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QW3_B_BO2B201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 5m0t ALPHA-KETOGLUTARATE-
DEPENDENT NON-HEME
IRON OXYGENASE EASH
(Aspergillus
japonicus) 		5 / 11 THR A 121
THR A 216
GLY A 212
ALA A 167
THR A 168
 None
None
None
None
AKG  A 302 (-3.0A)
 1.42A 4qw3V-5m0tA:
undetectable
4qw3b-5m0tA:
undetectable		 4qw3V-5m0tA:
23.23
4qw3b-5m0tA:
20.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QW3_N_BO2N201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 5m0t ALPHA-KETOGLUTARATE-
DEPENDENT NON-HEME
IRON OXYGENASE EASH
(Aspergillus
japonicus) 		5 / 11 THR A 121
THR A 216
GLY A 212
ALA A 167
THR A 168
 None
None
None
None
AKG  A 302 (-3.0A)
 1.42A 4qw3H-5m0tA:
undetectable
4qw3N-5m0tA:
undetectable		 4qw3H-5m0tA:
23.23
4qw3N-5m0tA:
20.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4R29_C_SAMC301_0
(UNCHARACTERIZED
PROTEIN)		 5m0t ALPHA-KETOGLUTARATE-
DEPENDENT NON-HEME
IRON OXYGENASE EASH
(Aspergillus
japonicus) 		5 / 12 ARG A 169
ALA A 211
ARG A 221
GLY A 223
MET A 195
 None
AKG  A 302 (-3.4A)
AKG  A 302 (-2.7A)
None
None
 1.23A 4r29C-5m0tA:
undetectable		 4r29C-5m0tA:
21.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4U9U_A_ACTA1502_0
(NA(+)-TRANSLOCATING
NADH-QUINONE
REDUCTASE SUBUNIT F)		 5y7r IRON/ALPHA-KETOGLUTA
RATE-DEPENDENT
DIOXYGENASE ASQJ
(Aspergillus
nidulans) 		4 / 5 ARG B 194
GLY B 170
ALA B 171
GLY B 213
 None
None
None
AKG  B 402 (-2.9A)
 0.86A 4u9uA-5y7rB:
undetectable		 4u9uA-5y7rB:
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.
4UAC_A_ACRA501_2
(CARBOHYDRATE ABC
TRANSPORTER
SUBSTRATE-BINDING
PROTEIN, CUT1 FAMILY
(TC 3.A.1.1.-))		 2vdc GLUTAMATE SYNTHASE
[NADPH] LARGE CHAIN
(Azospirillum
brasilense) 		4 / 7 GLU A 886
SER A1033
GLU A 940
ASP A 651
 AKG  A2475 (-4.2A)
None
None
None
 1.32A 4uacA-2vdcA:
undetectable		 4uacA-2vdcA:
15.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UIL_H_QI9H1223_0
(FAB 314.1)		 1ofe FERREDOXIN-DEPENDENT
GLUTAMATE SYNTHASE 2
(Synechocystis
sp.
PCC
6803) 		5 / 12 ALA A 971
SER A1068
GLY A1128
GLN A 944
GLY A 902
 None
AKG  A2510 ( 4.7A)
FMN  A2508 (-3.4A)
FMN  A2508 (-2.9A)
FMN  A2508 ( 3.9A)
 1.15A 4uilH-1ofeA:
undetectable
4uilL-1ofeA:
undetectable		 4uilH-1ofeA:
9.45
4uilL-1ofeA:
9.05
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.
4UUU_B_SAMB1548_0
(CYSTATHIONINE
BETA-SYNTHASE)		 6g3u -
(-) 		5 / 11 SER A  88
ALA A 586
PRO A 587
THR A  12
ILE A  43
 AKG  A 802 ( 3.0A)
NAP  A 801 (-4.2A)
NAP  A 801 (-4.3A)
None
None
 1.31A 4uuuB-6g3uA:
undetectable		 4uuuB-6g3uA:
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.
4WNV_D_QI9D602_0
(CYTOCHROME P450 2D6)		 3bi3 ALPHA-KETOGLUTARATE-
DEPENDENT
DIOXYGENASE ALKB
(Escherichia
coli) 		4 / 7 PHE A 154
LEU A 168
SER A 147
THR A 208
 None
None
AKG  A 302 ( 4.7A)
AKG  A 302 (-3.7A)
 1.05A 4wnvD-3bi3A:
undetectable		 4wnvD-3bi3A:
20.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4XE0_A_40LA1101_0
(PHOSPHATIDYLINOSITOL
4,5-BISPHOSPHATE
3-KINASE CATALYTIC
SUBUNIT DELTA
ISOFORM)		 5nci LEUCINE HYDROXYLASE
(Streptomyces
muensis) 		5 / 12 TRP A 116
TYR A 228
VAL A 128
ASN A  97
ILE A 226
 LEU  A 303 (-3.4A)
None
None
AKG  A 302 (-3.3A)
None
 1.24A 4xe0A-5nciA:
undetectable		 4xe0A-5nciA:
14.13
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.
4XE0_A_40LA1101_0
(PHOSPHATIDYLINOSITOL
4,5-BISPHOSPHATE
3-KINASE CATALYTIC
SUBUNIT DELTA
ISOFORM)		 5ui3 DIHYDRODIPICOLINATE
SYNTHASE
(Chlamydomonas
reinhardtii) 		5 / 12 PRO D 229
TYR D  47
THR D  68
ASN D 260
ILE D  32
 None
None
AKG  D 401 (-3.6A)
AKG  D 401 (-3.8A)
None
 1.32A 4xe0A-5ui3D:
undetectable		 4xe0A-5ui3D:
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.
4XUD_A_SAMA303_1
(CATECHOL
O-METHYLTRANSFERASE)		 1bl5 ISOCITRATE
DEHYDROGENASE
(Escherichia
coli) 		3 / 3 SER A 310
GLU A 336
ASP A 307
 None
AKG  A   1 ( 4.6A)
MG  A 418 (-3.1A)
 0.68A 4xudA-1bl5A:
undetectable		 4xudA-1bl5A:
19.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ZPH_A_PRLA501_0
(ARYL HYDROCARBON
RECEPTOR NUCLEAR
TRANSLOCATOR
ENDOTHELIAL PAS
DOMAIN-CONTAINING
PROTEIN 1)		 2xko GLOBAL NITROGEN
REGULATOR
(Synechococcus
elongatus) 		4 / 7 VAL A  51
LEU A  53
SER A  54
GLU A  62
 None
AKG  A1223 (-4.2A)
None
None
 1.10A 4zphA-2xkoA:
undetectable
4zphB-2xkoA:
undetectable		 4zphA-2xkoA:
20.51
4zphB-2xkoA:
21.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ZPH_A_PRLA501_0
(ARYL HYDROCARBON
RECEPTOR NUCLEAR
TRANSLOCATOR
ENDOTHELIAL PAS
DOMAIN-CONTAINING
PROTEIN 1)		 3la2 GLOBAL NITROGEN
REGULATOR
(Nostoc
sp.
PCC
7120) 		4 / 7 VAL A  52
LEU A  54
SER A  55
GLU A  63
 None
AKG  A 224 (-4.3A)
None
None
 1.02A 4zphA-3la2A:
undetectable
4zphB-3la2A:
undetectable		 4zphA-3la2A:
22.25
4zphB-3la2A:
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.
5BTF_G_GFNG101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
DNA SUBSTRATE 24-MER
TTACGTGCATAGTCATTCAT
GACC)		 3tht ALKYLATED DNA REPAIR
PROTEIN ALKB HOMOLOG
8
(Homo
sapiens) 		4 / 7 SER A 330
ASP A 300
ARG A 297
GLY A 232
 AKG  A 403 (-3.4A)
None
None
None
 0.83A 5btfA-3thtA:
2.7
5btfC-3thtA:
2.6
5btfD-3thtA:
undetectable		 5btfA-3thtA:
20.70
5btfC-3thtA:
20.70
5btfD-3thtA:
22.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5BW4_B_SAMB301_1
(16S RRNA
(ADENINE(1408)-N(1))
-METHYLTRANSFERASE)		 5o9w THEBAINE
6-O-DEMETHYLASE
(Papaver
somniferum) 		3 / 3 ASP A 144
GLU A 137
SER A 307
 None
None
AKG  A 402 (-2.5A)
 0.82A 5bw4B-5o9wA:
undetectable		 5bw4B-5o9wA:
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.
5BXN_B_BO2B201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 5m0t ALPHA-KETOGLUTARATE-
DEPENDENT NON-HEME
IRON OXYGENASE EASH
(Aspergillus
japonicus) 		5 / 11 THR A 121
THR A 216
GLY A 212
ALA A 167
THR A 168
 None
None
None
None
AKG  A 302 (-3.0A)
 1.44A 5bxnV-5m0tA:
undetectable
5bxnb-5m0tA:
undetectable		 5bxnV-5m0tA:
22.92
5bxnb-5m0tA:
20.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5BXN_N_BO2N201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 5m0t ALPHA-KETOGLUTARATE-
DEPENDENT NON-HEME
IRON OXYGENASE EASH
(Aspergillus
japonicus) 		5 / 11 THR A 121
THR A 216
GLY A 212
ALA A 167
THR A 168
 None
None
None
None
AKG  A 302 (-3.0A)
 1.44A 5bxnH-5m0tA:
undetectable
5bxnN-5m0tA:
undetectable		 5bxnH-5m0tA:
22.92
5bxnN-5m0tA:
20.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5CDQ_F_MFXF2101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT
B,DNA GYRASE SUBUNIT
B)		 3tht ALKYLATED DNA REPAIR
PROTEIN ALKB HOMOLOG
8
(Homo
sapiens) 		4 / 6 SER A 330
ASP A 300
ARG A 297
GLY A 232
 AKG  A 403 (-3.4A)
None
None
None
 1.07A 5cdqA-3thtA:
2.5
5cdqC-3thtA:
2.2
5cdqD-3thtA:
undetectable		 5cdqA-3thtA:
20.77
5cdqC-3thtA:
20.77
5cdqD-3thtA:
18.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5D0X_B_BO2B201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 5m0t ALPHA-KETOGLUTARATE-
DEPENDENT NON-HEME
IRON OXYGENASE EASH
(Aspergillus
japonicus) 		5 / 11 THR A 121
THR A 216
GLY A 212
ALA A 167
THR A 168
 None
None
None
None
AKG  A 302 (-3.0A)
 1.43A 5d0xV-5m0tA:
undetectable
5d0xb-5m0tA:
undetectable		 5d0xV-5m0tA:
23.23
5d0xb-5m0tA:
20.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5D0X_N_BO2N201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 5m0t ALPHA-KETOGLUTARATE-
DEPENDENT NON-HEME
IRON OXYGENASE EASH
(Aspergillus
japonicus) 		5 / 11 THR A 121
THR A 216
GLY A 212
ALA A 167
THR A 168
 None
None
None
None
AKG  A 302 (-3.0A)
 1.43A 5d0xH-5m0tA:
undetectable
5d0xN-5m0tA:
undetectable		 5d0xH-5m0tA:
23.23
5d0xN-5m0tA:
20.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5D0Y_A_FOLA201_0
(CONSERVED
HYPOTHETICAL
MEMBRANE PROTEIN)		 6d3i -
(-) 		5 / 12 LEU A  83
GLY A 107
PHE A 171
THR A 168
HIS A 270
 None
AKG  A 302 (-3.1A)
None
None
CO  A 301 (-3.2A)
 1.36A 5d0yA-6d3iA:
undetectable		 5d0yA-6d3iA:
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.
5GWX_A_SAMA301_0
(GLYCINE SARCOSINE
N-METHYLTRANSFERASE)		 1ofe FERREDOXIN-DEPENDENT
GLUTAMATE SYNTHASE 2
(Synechocystis
sp.
PCC
6803) 		5 / 12 GLY A 977
GLY A 974
GLY A 948
SER A 947
HIS A1006
 AKG  A2510 (-3.2A)
None
None
None
None
 1.09A 5gwxA-1ofeA:
2.8		 5gwxA-1ofeA:
10.88
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.
5HFJ_A_SAMA301_0
(ADENINE SPECIFIC DNA
METHYLTRANSFERASE
(DPNA))		 5ijz NADP-SPECIFIC
GLUTAMATE
DEHYDROGENASE
(Corynebacterium
glutamicum) 		5 / 12 ALA A 166
GLY A 204
THR A 201
GLU A 382
SER A 379
 AKG  A 502 (-3.3A)
None
None
None
AKG  A 502 (-2.5A)
 1.22A 5hfjA-5ijzA:
undetectable		 5hfjA-5ijzA:
18.40
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.
5HFJ_D_SAMD301_0
(ADENINE SPECIFIC DNA
METHYLTRANSFERASE
(DPNA))		 6g3u -
(-) 		5 / 12 ASP A  13
ASP A 548
GLY A 583
SER A 562
SER A 585
 None
AKG  A 802 (-3.7A)
NAP  A 801 (-4.1A)
None
NAP  A 801 (-3.4A)
 1.12A 5hfjD-6g3uA:
undetectable		 5hfjD-6g3uA:
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.
5HFJ_E_SAME301_0
(ADENINE SPECIFIC DNA
METHYLTRANSFERASE
(DPNA))		 6g3u -
(-) 		5 / 12 ASP A  13
ASP A 548
GLY A 583
SER A 562
SER A 585
 None
AKG  A 802 (-3.7A)
NAP  A 801 (-4.1A)
None
NAP  A 801 (-3.4A)
 1.09A 5hfjE-6g3uA:
undetectable		 5hfjE-6g3uA:
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.
5HIK_A_SAMA301_0
(GLYCINE SARCOSINE
N-METHYLTRANSFERASE)		 1ofe FERREDOXIN-DEPENDENT
GLUTAMATE SYNTHASE 2
(Synechocystis
sp.
PCC
6803) 		5 / 12 ARG A 992
GLY A 977
GLY A 974
GLY A 948
HIS A1006
 AKG  A2510 (-2.9A)
AKG  A2510 (-3.2A)
None
None
None
 1.10A 5hikA-1ofeA:
undetectable		 5hikA-1ofeA:
10.88
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.
5HIK_A_SAMA301_0
(GLYCINE SARCOSINE
N-METHYLTRANSFERASE)		 1ofe FERREDOXIN-DEPENDENT
GLUTAMATE SYNTHASE 2
(Synechocystis
sp.
PCC
6803) 		5 / 12 GLY A 977
GLY A 974
GLY A 948
SER A 947
HIS A1006
 AKG  A2510 (-3.2A)
None
None
None
None
 1.16A 5hikA-1ofeA:
undetectable		 5hikA-1ofeA:
10.88
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.
5HIK_A_SAMA301_0
(GLYCINE SARCOSINE
N-METHYLTRANSFERASE)		 2vdc GLUTAMATE SYNTHASE
[NADPH] LARGE CHAIN
(Azospirillum
brasilense) 		5 / 12 ARG A 957
GLY A 942
GLY A 939
GLY A 913
HIS A 971
 AKG  A2475 (-2.8A)
AKG  A2475 (-3.0A)
None
None
None
 1.14A 5hikA-2vdcA:
undetectable		 5hikA-2vdcA:
10.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HIK_A_SAMA301_0
(GLYCINE SARCOSINE
N-METHYLTRANSFERASE)		 2vdc GLUTAMATE SYNTHASE
[NADPH] LARGE CHAIN
(Azospirillum
brasilense) 		5 / 12 GLY A 942
GLY A 939
GLY A 913
SER A 912
HIS A 971
 AKG  A2475 (-3.0A)
None
None
None
None
 1.26A 5hikA-2vdcA:
undetectable		 5hikA-2vdcA:
10.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HS6_A_J3ZA302_1
(17-BETA-HYDROXYSTERO
ID DEHYDROGENASE 14)		 4nao PUTATIVE OXYGENASE
(Claviceps
purpurea) 		4 / 8 HIS A 141
GLN A 138
LEU A 189
TRP A 140
 FE2  A 404 ( 3.7A)
AKG  A 402 (-3.5A)
None
None
 0.86A 5hs6A-4naoA:
undetectable		 5hs6A-4naoA:
22.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5IKR_B_ID8B602_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3la2 GLOBAL NITROGEN
REGULATOR
(Nostoc
sp.
PCC
7120) 		5 / 12 VAL A 108
LEU A 112
GLY A  76
SER A  79
LEU A  80
 None
None
AKG  A 224 (-3.1A)
None
None
 0.98A 5ikrB-3la2A:
undetectable		 5ikrB-3la2A:
18.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5JGL_A_SAMA301_1
(UBIE/COQ5 FAMILY
METHYLTRANSFERASE,
PUTATIVE)		 3hww 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Escherichia
coli) 		3 / 3 GLY A 441
ASP A 442
ASN A 494
 AKG  A 557 ( 3.1A)
MG  A 558 ( 2.9A)
None
 0.57A 5jglA-3hwwA:
undetectable		 5jglA-3hwwA:
20.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5JVZ_A_FLPA601_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3la2 GLOBAL NITROGEN
REGULATOR
(Nostoc
sp.
PCC
7120) 		5 / 12 VAL A 108
LEU A 112
GLY A  76
SER A  79
LEU A  80
 None
None
AKG  A 224 (-3.1A)
None
None
 0.95A 5jvzA-3la2A:
undetectable		 5jvzA-3la2A:
18.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5JVZ_B_FLPB601_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3la2 GLOBAL NITROGEN
REGULATOR
(Nostoc
sp.
PCC
7120) 		5 / 12 VAL A 108
LEU A 112
GLY A  76
SER A  79
LEU A  80
 None
None
AKG  A 224 (-3.1A)
None
None
 0.94A 5jvzB-3la2A:
0.4		 5jvzB-3la2A:
18.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5JW1_A_CELA602_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3la2 GLOBAL NITROGEN
REGULATOR
(Nostoc
sp.
PCC
7120) 		5 / 12 VAL A 108
LEU A 112
GLY A  76
SER A  79
LEU A  80
 None
None
AKG  A 224 (-3.1A)
None
None
 1.05A 5jw1A-3la2A:
undetectable		 5jw1A-3la2A:
18.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5L66_B_BO2B201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 5m0t ALPHA-KETOGLUTARATE-
DEPENDENT NON-HEME
IRON OXYGENASE EASH
(Aspergillus
japonicus) 		5 / 11 THR A 121
THR A 216
GLY A 212
ALA A 167
THR A 168
 None
None
None
None
AKG  A 302 (-3.0A)
 1.44A 5l66V-5m0tA:
undetectable
5l66b-5m0tA:
undetectable		 5l66V-5m0tA:
23.23
5l66b-5m0tA:
20.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5L66_N_BO2N201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 5m0t ALPHA-KETOGLUTARATE-
DEPENDENT NON-HEME
IRON OXYGENASE EASH
(Aspergillus
japonicus) 		5 / 11 THR A 121
THR A 216
GLY A 212
ALA A 167
THR A 168
 None
None
None
None
AKG  A 302 (-3.0A)
 1.44A 5l66H-5m0tA:
undetectable
5l66N-5m0tA:
undetectable		 5l66H-5m0tA:
23.23
5l66N-5m0tA:
20.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5LJC_A_RTLA201_1
(RETINOL-BINDING
PROTEIN 1)		 2a1x PHYTANOYL-COA
DIOXYGENASE
(Homo
sapiens) 		4 / 7 LEU A 174
ILE A 199
MET A 250
TRP A 193
 None
None
None
AKG  A 451 (-3.9A)
 1.28A 5ljcA-2a1xA:
undetectable		 5ljcA-2a1xA:
18.87
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.
5LJC_A_RTLA201_1
(RETINOL-BINDING
PROTEIN 1)		 2a1x PHYTANOYL-COA
DIOXYGENASE
(Homo
sapiens) 		4 / 7 LEU A 209
ILE A 199
MET A 250
TRP A 193
 None
None
None
AKG  A 451 (-3.9A)
 1.27A 5ljcA-2a1xA:
undetectable		 5ljcA-2a1xA:
18.87
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.
5LRB_A_ACRA1003_1
(ALPHA-1,4 GLUCAN
PHOSPHORYLASE)		 2fct SYRINGOMYCIN
BIOSYNTHESIS ENZYME
2
(Pseudomonas
syringae) 		4 / 6 GLU A 102
THR A 120
TYR A 272
PHE A 104
 None
None
None
AKG  A 897 (-3.6A)
 1.21A 5lrbA-2fctA:
undetectable		 5lrbA-2fctA:
16.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5TL8_A_X2NA502_1
(PROTEIN CYP51)		 5ybp PRHA
(Penicillium
brasilianum) 		5 / 12 PHE A 244
PHE A 160
TYR A 206
ALA A 166
ALA A 216
 None
None
None
None
AKG  A 302 (-3.3A)
 1.09A 5tl8A-5ybpA:
undetectable		 5tl8A-5ybpA:
9.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UXC_A_ZITA307_1
(PREDICTED
AMINOGLYCOSIDE
PHOSPHOTRANSFERASE)		 5ybl MULTIFUNCTIONAL
DIOXYGENASE AUSE
(Aspergillus
nidulans) 		4 / 5 ASP A 204
GLU A 119
ARG A 226
THR A 158
 None
None
AKG  A 302 (-3.0A)
None
 1.44A 5uxcA-5yblA:
undetectable		 5uxcA-5yblA:
18.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VEU_B_RITB602_1
(CYTOCHROME P450 3A5)		 4xgi GLUTAMATE
DEHYDROGENASE
(Burkholderia
thailandensis) 		5 / 12 SER A  83
ILE A 423
ALA A 114
ILE A 160
GLY A  89
 None
None
None
None
AKG  A 501 ( 3.9A)
 1.02A 5veuB-4xgiA:
undetectable		 5veuB-4xgiA:
20.36
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.
5VKQ_A_PCFA1805_0
(NO MECHANORECEPTOR
POTENTIAL C ISOFORM
L)		 4nao PUTATIVE OXYGENASE
(Claviceps
purpurea) 		4 / 7 PHE A 170
VAL A 201
ILE A 210
THR A 177
 None
None
None
AKG  A 402 (-2.9A)
 1.04A 5vkqA-4naoA:
undetectable
5vkqD-4naoA:
undetectable		 5vkqA-4naoA:
11.21
5vkqD-4naoA:
11.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VW9_A_NCAA403_0
(FERREDOXIN--NADP
REDUCTASE)		 1ofe FERREDOXIN-DEPENDENT
GLUTAMATE SYNTHASE 2
(Synechocystis
sp.
PCC
6803) 		4 / 8 GLY A 951
GLY A 905
GLU A 903
SER A 901
 None
None
AKG  A2510 (-4.0A)
None
 0.70A 5vw9A-1ofeA:
undetectable		 5vw9A-1ofeA:
11.85
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.
5X19_J_CHDJ101_0
(CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 3w21 PUTATIVE
UNCHARACTERIZED
PROTEIN
(Burkholderia
ambifaria) 		4 / 5 ARG A 256
MET A 258
THR A 257
LEU A 182
 None
None
AKG  A 302 (-3.1A)
None
 1.37A 5x19J-3w21A:
undetectable		 5x19J-3w21A:
11.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5X1B_J_CHDJ101_0
(CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 3w21 PUTATIVE
UNCHARACTERIZED
PROTEIN
(Burkholderia
ambifaria) 		4 / 5 ARG A 256
MET A 258
THR A 257
LEU A 182
 None
None
AKG  A 302 (-3.1A)
None
 1.30A 5x1bJ-3w21A:
undetectable		 5x1bJ-3w21A:
11.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6AOG_A_CP6A704_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 2iuw ALKYLATED REPAIR
PROTEIN ALKB HOMOLOG
3
(Homo
sapiens) 		5 / 10 VAL A 188
ASP A 193
THR A 133
MET A 148
TYR A 181
 None
FE  A 500 ( 2.6A)
LED  A 177 ( 4.3A)
None
AKG  A 700 (-4.1A)
 1.35A 6aogA-2iuwA:
undetectable		 6aogA-2iuwA:
14.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6AOG_B_CP6B704_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 2iuw ALKYLATED REPAIR
PROTEIN ALKB HOMOLOG
3
(Homo
sapiens) 		5 / 10 VAL A 188
ASP A 193
THR A 133
MET A 148
TYR A 181
 None
FE  A 500 ( 2.6A)
LED  A 177 ( 4.3A)
None
AKG  A 700 (-4.1A)
 1.40A 6aogB-2iuwA:
undetectable		 6aogB-2iuwA:
14.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6BEC_C_RBTC601_1
(SCAFFOLD PROTEIN D13)		 3u78 LYSINE-SPECIFIC
DEMETHYLASE 7
(Homo
sapiens) 		5 / 12 VAL A 179
VAL A 356
PHE A 214
GLN A 200
ILE A 300
 None
AKG  A 701 (-4.1A)
None
E67  A 707 (-3.3A)
None
 1.37A 6becA-3u78A:
undetectable
6becB-3u78A:
undetectable
6becC-3u78A:
undetectable		 6becA-3u78A:
21.05
6becB-3u78A:
21.05
6becC-3u78A:
21.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6BTX_A_EDTA503_0
(SOLUTE CARRIER
FAMILY 39
(IRON-REGULATED
TRANSPORTER))		 2iuw ALKYLATED REPAIR
PROTEIN ALKB HOMOLOG
3
(Homo
sapiens) 		4 / 7 SER A 206
SER A 208
GLY A 242
ARG A 269
 AKG  A 700 ( 4.1A)
AKG  A 700 ( 4.8A)
None
AKG  A 700 (-2.9A)
 1.05A 6btxA-2iuwA:
undetectable		 6btxA-2iuwA:
19.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6BTX_A_EDTA503_0
(SOLUTE CARRIER
FAMILY 39
(IRON-REGULATED
TRANSPORTER))		 3bi3 ALPHA-KETOGLUTARATE-
DEPENDENT
DIOXYGENASE ALKB
(Escherichia
coli) 		4 / 7 SER A 145
SER A 147
GLY A 173
ARG A 204
 AKG  A 302 ( 3.8A)
AKG  A 302 ( 4.7A)
None
AKG  A 302 (-2.8A)
 0.97A 6btxA-3bi3A:
undetectable		 6btxA-3bi3A:
20.99
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.
6BTX_A_EDTA503_0
(SOLUTE CARRIER
FAMILY 39
(IRON-REGULATED
TRANSPORTER))		 4npl RNA DEMETHYLASE
ALKBH5
(Danio
rerio) 		4 / 7 SER A 148
SER A 150
GLY A 182
ARG A 208
 AKG  A 301 ( 4.6A)
AKG  A 301 ( 4.8A)
None
AKG  A 301 (-3.0A)
 0.99A 6btxA-4nplA:
undetectable		 6btxA-4nplA:
20.58
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.
6DCH_A_ACTA401_0
(SCOE PROTEIN)		 1nx8 CARBAPENEM SYNTHASE
(Pectobacterium
carotovorum) 		4 / 5 HIS A 101
ASP A 103
HIS A 251
ARG A 267
 FE  A 300 ( 3.3A)
FE  A 300 ( 2.4A)
FE  A 300 ( 3.3A)
AKG  A 280 (-3.9A)
 0.80A 6dchA-1nx8A:
19.1		 6dchA-1nx8A:
24.71
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.
6DCH_A_ACTA401_0
(SCOE PROTEIN)		 1oij PUTATIVE
ALKYLSULFATASE ATSK
(Pseudomonas
putida) 		4 / 5 HIS C 108
ASP C 110
HIS C 264
ARG C 279
 NA  C1300 ( 3.7A)
NA  C1300 (-2.9A)
NA  C1300 ( 3.3A)
AKG  C1301 ( 3.9A)
 0.77A 6dchA-1oijC:
24.2		 6dchA-1oijC:
24.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6DCH_A_ACTA401_0
(SCOE PROTEIN)		 3bi3 ALPHA-KETOGLUTARATE-
DEPENDENT
DIOXYGENASE ALKB
(Escherichia
coli) 		4 / 5 HIS A 131
ASP A 133
HIS A 187
ARG A 210
 MN  A 301 ( 3.3A)
MN  A 301 ( 2.5A)
MN  A 301 ( 3.3A)
AKG  A 302 (-3.9A)
 1.20A 6dchA-3bi3A:
5.3		 6dchA-3bi3A:
21.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6DCH_A_ACTA401_0
(SCOE PROTEIN)		 3tht ALKYLATED DNA REPAIR
PROTEIN ALKB HOMOLOG
8
(Homo
sapiens) 		4 / 5 HIS A 238
ASP A 240
HIS A 292
ARG A 334
 MN  A 402 ( 3.8A)
MN  A 402 ( 2.6A)
MN  A 402 ( 3.6A)
AKG  A 403 (-3.9A)
 1.18A 6dchA-3thtA:
5.6		 6dchA-3thtA:
23.54
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.
6DCH_A_ACTA401_0
(SCOE PROTEIN)		 4npl RNA DEMETHYLASE
ALKBH5
(Danio
rerio) 		4 / 5 HIS A 135
ASP A 137
HIS A 197
ARG A 214
 MN  A 300 ( 3.3A)
MN  A 300 (-2.8A)
MN  A 300 ( 3.4A)
AKG  A 301 ( 4.6A)
 0.99A 6dchA-4nplA:
5.3		 6dchA-4nplA:
21.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6DEB_B_MTXB302_1
(BIFUNCTIONAL PROTEIN
FOLD)		 1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE
(Streptomyces
clavuligerus) 		5 / 12 LEU A 215
PRO A 216
PHE A 225
ILE A 192
VAL A 262
 None
None
None
AKG  A 902 ( 4.6A)
AKG  A 902 ( 4.8A)
 1.25A 6debB-1e5iA:
undetectable		 6debB-1e5iA:
13.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6DJZ_B_GMJB301_0
(SIGMA NON-OPIOID
INTRACELLULAR
RECEPTOR 1)		 5f8p ALPHA-KETOGLUTARATE-
DEPENDENT
DIOXYGENASE FTO
(Homo
sapiens) 		5 / 12 TYR A 295
LEU A 289
PHE A  69
HIS A 321
VAL A  65
 AKG  A 603 (-4.6A)
None
None
None
None
 1.36A 6djzB-5f8pA:
4.4		 6djzB-5f8pA:
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.
6DLZ_D_CYZD1302_0
(GLUTAMATE RECEPTOR
2,VOLTAGE-DEPENDENT
CALCIUM CHANNEL
GAMMA-2 SUBUNIT)		 2iuw ALKYLATED REPAIR
PROTEIN ALKB HOMOLOG
3
(Homo
sapiens) 		5 / 11 ILE A 237
PRO A  94
LEU A 239
SER A 206
LEU A 207
 None
None
None
AKG  A 700 ( 4.1A)
None
 1.42A 6dlzA-2iuwA:
undetectable
6dlzD-2iuwA:
undetectable		 6dlzA-2iuwA:
15.15
6dlzD-2iuwA:
15.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6DM1_D_CYZD1302_0
(GLUTAMATE RECEPTOR
2,VOLTAGE-DEPENDENT
CALCIUM CHANNEL
GAMMA-2 SUBUNIT)		 2iuw ALKYLATED REPAIR
PROTEIN ALKB HOMOLOG
3
(Homo
sapiens) 		5 / 11 ILE A 237
PRO A  94
LEU A 239
SER A 206
LEU A 207
 None
None
None
AKG  A 700 ( 4.1A)
None
 1.42A 6dm1A-2iuwA:
undetectable
6dm1D-2iuwA:
undetectable		 6dm1A-2iuwA:
15.15
6dm1D-2iuwA:
15.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6F5U_A_CQNA610_1
(ENVELOPE
GLYCOPROTEIN,ENVELOP
E GLYCOPROTEIN,GP1
ENVELOPE
GLYCOPROTEIN)		 5uqd DUMPY: SHORTER THAN
WILD-TYPE
(Caenorhabditis
elegans) 		5 / 10 VAL A1528
LEU A1579
LEU A1503
LEU A1587
THR A1449
 None
None
None
None
AKG  A1701 (-3.6A)
 0.87A 6f5uA-5uqdA:
undetectable
6f5uB-5uqdA:
undetectable		 6f5uA-5uqdA:
11.84
6f5uB-5uqdA:
12.62
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.
6FI4_B_DVAB8_0
(14-3-3 PROTEIN SIGMA
PRO-SEP-LEU-PRO-DVA)		 5ijz NADP-SPECIFIC
GLUTAMATE
DEHYDROGENASE
(Corynebacterium
glutamicum) 		4 / 5 SER A 379
VAL A 376
ASN A 117
PRO A 165
 AKG  A 502 (-2.5A)
AKG  A 502 (-4.1A)
None
None
 1.39A 6fi4A-5ijzA:
undetectable
6fi4B-5ijzA:
undetectable		 6fi4A-5ijzA:
20.90
6fi4B-5ijzA:
7.58
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.
6GNE_A_ACRA602_1
(-)		 4xgi GLUTAMATE
DEHYDROGENASE
(Burkholderia
thailandensis) 		5 / 12 GLY A  90
GLY A  89
VAL A 364
ASN A 113
GLY A 122
 AKG  A 501 (-3.2A)
AKG  A 501 ( 3.9A)
AKG  A 501 ( 4.2A)
None
None
 1.16A 6gneA-4xgiA:
2.7		 6gneA-4xgiA:
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.
6GNE_A_ACRA602_1
(-)		 5ijz NADP-SPECIFIC
GLUTAMATE
DEHYDROGENASE
(Corynebacterium
glutamicum) 		5 / 12 GLY A  94
GLY A  93
VAL A 376
ASN A 117
GLY A 126
 AKG  A 502 (-3.7A)
AKG  A 502 (-3.4A)
AKG  A 502 (-4.1A)
None
None
 1.17A 6gneA-5ijzA:
3.1		 6gneA-5ijzA:
21.76
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.
6H7J_A_5FWA401_0
(BETA-1 ADRENERGIC
RECEPTOR)		 1gy9 ALPHA-KETOGLUTARATE-
DEPENDENT TAURINE
DIOXYGENASE
(Escherichia
coli) 		5 / 12 TRP A 248
ASP A 101
VAL A 102
PHE A 159
ASN A  95
 None
FE  A 300 (-2.3A)
TAU  A 350 (-3.8A)
TAU  A 350 (-4.3A)
AKG  A 351 ( 3.5A)
 1.22A 6h7jA-1gy9A:
undetectable		 6h7jA-1gy9A:
17.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6H7M_A_68HA504_0
(BETA-1 ADRENERGIC
RECEPTOR)		 1gy9 ALPHA-KETOGLUTARATE-
DEPENDENT TAURINE
DIOXYGENASE
(Escherichia
coli) 		5 / 12 TRP A 248
ASP A 101
VAL A 102
PHE A 159
ASN A  95
 None
FE  A 300 (-2.3A)
TAU  A 350 (-3.8A)
TAU  A 350 (-4.3A)
AKG  A 351 ( 3.5A)
 1.20A 6h7mA-1gy9A:
undetectable		 6h7mA-1gy9A:
17.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6H7M_B_68HB405_0
(BETA-1 ADRENERGIC
RECEPTOR)		 1gy9 ALPHA-KETOGLUTARATE-
DEPENDENT TAURINE
DIOXYGENASE
(Escherichia
coli) 		5 / 12 TRP A 248
ASP A 101
VAL A 102
PHE A 159
ASN A  95
 None
FE  A 300 (-2.3A)
TAU  A 350 (-3.8A)
TAU  A 350 (-4.3A)
AKG  A 351 ( 3.5A)
 1.20A 6h7mB-1gy9A:
undetectable		 6h7mB-1gy9A:
17.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6NKN_W_CHDW101_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 2xko GLOBAL NITROGEN
REGULATOR
(Synechococcus
elongatus) 		3 / 3 ARG A 128
LEU A  68
PHE A  94
 AKG  A1223 (-2.7A)
None
None
 0.79A 6nknP-2xkoA:
undetectable		 6nknP-2xkoA:
22.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6NKN_W_CHDW101_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 3la2 GLOBAL NITROGEN
REGULATOR
(Nostoc
sp.
PCC
7120) 		3 / 3 ARG A 129
LEU A  69
PHE A  95
 AKG  A 224 (-2.5A)
None
None
 0.77A 6nknP-3la2A:
undetectable		 6nknP-3la2A:
22.30