SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'APC'


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.
1DRE_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 6fpe ATPASE YJEE,
PREDICTED TO HAVE
ESSENTIAL ROLE IN
CELL WALL
BIOSYNTHESIS
(Thermotoga
maritima) 		5 / 12 ALA E  39
LEU E  33
PHE E  44
ILE E 138
LEU E  21
 APC  E 201 (-4.3A)
None
None
None
None
 1.20A 1dreA-6fpeE:
undetectable		 1dreA-6fpeE:
14.72
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.
1H1D_A_SAMA301_0
(CATECHOL-O-METHYLTRA
NSFERASE)		 4l39 4-SUBSTITUTED
BENZOATES-GLUTAMATE
LIGASE GH3.12
(Arabidopsis
thaliana) 		5 / 12 VAL A 345
GLY A 404
TYR A 347
ASN A 407
TYR A 406
 None
None
APC  A 603 (-4.4A)
None
None
 1.37A 1h1dA-4l39A:
2.6		 1h1dA-4l39A:
17.20
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.
1HK3_A_T44A3003_1
(SERUM ALBUMIN)		 5f2v GTP
PYROPHOSPHOKINASE
YJBM
(Bacillus
subtilis) 		3 / 4 LYS V  56
ALA V  57
MET V  70
 APC  V 301 (-2.8A)
None
None
 0.99A 1hk3A-5f2vV:
2.4		 1hk3A-5f2vV:
17.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1M8E_B_H4BB903_1
(INDUCIBLE NITRIC
OXIDE SYNTHASE)		 5f2v GTP
PYROPHOSPHOKINASE
YJBM
(Bacillus
subtilis) 		3 / 3 ARG V 143
ILE V 153
TRP V 150
 APC  V 301 ( 4.9A)
None
None
 1.01A 1m8eB-5f2vV:
undetectable		 1m8eB-5f2vV:
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.
1NOD_B_H4BB902_1
(NITRIC OXIDE
SYNTHASE)		 5f2v GTP
PYROPHOSPHOKINASE
YJBM
(Bacillus
subtilis) 		3 / 3 ARG V 143
ILE V 153
TRP V 150
 APC  V 301 ( 4.9A)
None
None
 0.97A 1nodB-5f2vV:
undetectable		 1nodB-5f2vV:
20.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1OS6_A_DXCA75_0
(PPCA)		 3g5a FMN
ADENYLYLTRANSFERASE
([Candida]
glabrata) 		4 / 8 ILE A 277
LYS A  65
PHE A 114
GLY A 224
 None
APC  A 305 (-2.9A)
None
None
 1.02A 1os6A-3g5aA:
undetectable		 1os6A-3g5aA:
11.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1QOM_A_H4BA902_1
(NITRIC OXIDE
SYNTHASE)		 5f2v GTP
PYROPHOSPHOKINASE
YJBM
(Bacillus
subtilis) 		3 / 3 ARG V 143
ILE V 153
TRP V 150
 APC  V 301 ( 4.9A)
None
None
 0.93A 1qomA-5f2vV:
undetectable		 1qomA-5f2vV:
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.
1USQ_F_CLMF1144_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 4gr5 NON-RIBOSOMAL
PEPTIDE SYNTHETASE
(Streptomyces
lydicus) 		4 / 7 GLY A 332
THR A 366
ILE A 382
GLY A 355
 APC  A 601 (-3.5A)
None
None
APC  A 601 (-4.4A)
 0.84A 1usqF-4gr5A:
undetectable		 1usqF-4gr5A:
13.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2CL5_A_SAMA1217_0
(CATECHOL
O-METHYLTRANSFERASE)		 4l39 4-SUBSTITUTED
BENZOATES-GLUTAMATE
LIGASE GH3.12
(Arabidopsis
thaliana) 		5 / 12 VAL A 345
GLY A 404
TYR A 347
ASN A 407
TYR A 406
 None
None
APC  A 603 (-4.4A)
None
None
 1.44A 2cl5A-4l39A:
0.9		 2cl5A-4l39A:
17.20
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.
2DTT_B_H4BB1001_1
(HYPOTHETICAL PROTEIN
PH0634)		 3g5a FMN
ADENYLYLTRANSFERASE
([Candida]
glabrata) 		5 / 10 ILE A 121
PHE A 107
GLU A 141
THR A 113
GLU A 118
 None
APC  A 305 (-4.9A)
None
None
None
 1.31A 2dttA-3g5aA:
0.0
2dttB-3g5aA:
0.0		 2dttA-3g5aA:
17.39
2dttB-3g5aA:
17.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2E1Q_A_SALA2006_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)		 4q85 RIBOSOMAL PROTEIN
S12
METHYLTHIOTRANSFERAS
E ACCESSORY FACTOR
YCAO
(Escherichia
coli) 		4 / 6 ARG A 286
VAL A 194
LEU A 359
ALA A 276
 APC  A 601 ( 3.1A)
None
None
None
 1.07A 2e1qA-4q85A:
undetectable		 2e1qA-4q85A:
19.47
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.
2EZ7_A_DHIA301_0
(CARBONIC ANHYDRASE 2)		 3h9j MCCB PROTEIN
(Escherichia
coli) 		4 / 6 ASN A 154
GLN A 158
THR A 290
PRO A 288
 None
APC  A 359 (-3.7A)
None
None
 1.49A 2ez7A-3h9jA:
undetectable		 2ez7A-3h9jA:
20.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2HJH_A_NCAA900_0
(NAD-DEPENDENT
HISTONE DEACETYLASE
SIR2)		 5y0q UPF0348 PROTEIN
B4417_3650
(Bacillus
subtilis) 		4 / 5 ILE A 210
PRO A  12
PHE A  13
ILE A 204
 None
None
None
APC  A1001 (-4.0A)
 0.93A 2hjhA-5y0qA:
undetectable		 2hjhA-5y0qA:
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.
2I30_A_SALA1200_1
(SERUM ALBUMIN)		 2pz8 NH(3)-DEPENDENT
NAD(+) SYNTHETASE
(Bacillus
anthracis) 		4 / 4 LEU A  80
ILE A 147
ILE A  76
ALA A  77
 APC  A3001 (-4.1A)
None
None
None
 0.85A 2i30A-2pz8A:
undetectable		 2i30A-2pz8A:
20.81
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.
2JKJ_E_CLME1141_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 4gr5 NON-RIBOSOMAL
PEPTIDE SYNTHETASE
(Streptomyces
lydicus) 		4 / 7 GLY A 332
THR A 366
ILE A 382
GLY A 355
 APC  A 601 (-3.5A)
None
None
APC  A 601 (-4.4A)
 0.83A 2jkjE-4gr5A:
undetectable		 2jkjE-4gr5A:
13.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2JKL_E_CLME1143_0
(DR HEMAGGLUTININ
STRUCTURAL SUBUNIT)		 4gr5 NON-RIBOSOMAL
PEPTIDE SYNTHETASE
(Streptomyces
lydicus) 		4 / 7 GLY A 332
THR A 366
ILE A 382
GLY A 355
 APC  A 601 (-3.5A)
None
None
APC  A 601 (-4.4A)
 0.81A 2jklE-4gr5A:
undetectable		 2jklE-4gr5A:
13.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2NOD_B_H4BB902_1
(NITRIC OXIDE
SYNTHASE)		 5f2v GTP
PYROPHOSPHOKINASE
YJBM
(Bacillus
subtilis) 		3 / 3 ARG V 143
ILE V 153
TRP V 150
 APC  V 301 ( 4.9A)
None
None
 0.97A 2nodB-5f2vV:
undetectable		 2nodB-5f2vV:
20.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Q2H_B_ACTB501_0
(SECRETION CHAPERONE,
PHAGE-DISPLAY
DERIVED PEPTIDE)		 4u0z ADENOSINE
MONOPHOSPHATE-PROTEI
N TRANSFERASE FICD
(Homo
sapiens) 		3 / 3 ARG A 374
SER A 373
TYR A 399
 APC  A 501 (-3.3A)
None
APC  A 501 (-4.8A)
 0.86A 2q2hA-4u0zA:
undetectable
2q2hB-4u0zA:
undetectable		 2q2hA-4u0zA:
18.21
2q2hB-4u0zA:
18.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2XKW_B_P1BB1475_2
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 2qx0 7,8-DIHYDRO-6-HYDROX
YMETHYLPTERIN-PYROPH
OSPHOKINASE
(Yersinia
pestis) 		4 / 6 LEU A  71
ILE A  99
ILE A 132
LEU A  34
 None
APC  A 171 (-4.1A)
CSO  A  37 ( 4.6A)
CSO  A  37 ( 4.3A)
 0.95A 2xkwB-2qx0A:
undetectable		 2xkwB-2qx0A:
20.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ZZM_A_SAMA401_0
(UNCHARACTERIZED
PROTEIN MJ0883)		 3g5a FMN
ADENYLYLTRANSFERASE
([Candida]
glabrata) 		5 / 12 LEU A 205
GLY A 287
ASN A 232
LEU A 223
PHE A 114
 None
None
None
APC  A 305 (-4.4A)
None
 1.16A 2zzmA-3g5aA:
undetectable		 2zzmA-3g5aA:
23.45
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.
3E68_A_H4BA902_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)		 5f2v GTP
PYROPHOSPHOKINASE
YJBM
(Bacillus
subtilis) 		3 / 3 ARG V 143
ILE V 153
TRP V 150
 APC  V 301 ( 4.9A)
None
None
 1.02A 3e68A-5f2vV:
undetectable		 3e68A-5f2vV:
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.
3E6T_B_H4BB902_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)		 5f2v GTP
PYROPHOSPHOKINASE
YJBM
(Bacillus
subtilis) 		3 / 3 ARG V 143
ILE V 153
TRP V 150
 APC  V 301 ( 4.9A)
None
None
 0.97A 3e6tB-5f2vV:
undetectable		 3e6tB-5f2vV:
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.
3E7I_B_H4BB2902_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)		 5f2v GTP
PYROPHOSPHOKINASE
YJBM
(Bacillus
subtilis) 		3 / 3 ARG V 143
ILE V 153
TRP V 150
 APC  V 301 ( 4.9A)
None
None
 0.92A 3e7iB-5f2vV:
undetectable		 3e7iB-5f2vV:
20.74
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3G59_A_ACTA306_0
(FMN
ADENYLYLTRANSFERASE)		 3g5a FMN
ADENYLYLTRANSFERASE
([Candida]
glabrata) 		4 / 5 SER A  60
PHE A 147
ILE A 162
TRP A 184
 APC  A 305 ( 2.5A)
FMN  A 306 (-3.8A)
FMN  A 306 ( 4.3A)
FMN  A 306 (-3.5A)
 0.46A 3g59A-3g5aA:
46.3		 3g59A-3g5aA:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JB2_A_SAMA1101_1
(STRUCTURAL PROTEIN
VP3)		 1vfg POLY A POLYMERASE
(Aquifex
aeolicus) 		3 / 3 GLU A  81
ASP A 100
ASP A 105
 None
None
APC  A 500 (-3.6A)
 0.60A 3jb2A-1vfgA:
undetectable		 3jb2A-1vfgA:
16.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JQ7_B_DX2B271_1
(PTERIDINE REDUCTASE
1)		 4l39 4-SUBSTITUTED
BENZOATES-GLUTAMATE
LIGASE GH3.12
(Arabidopsis
thaliana) 		4 / 8 PHE A 332
ASP A 398
TYR A 325
LEU A 391
 None
APC  A 603 (-2.6A)
None
None
 1.09A 3jq7B-4l39A:
undetectable		 3jq7B-4l39A:
18.26
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.
3K13_C_THHC643_1
(5-METHYLTETRAHYDROFO
LATE-HOMOCYSTEINE
METHYLTRANSFERASE)		 3h9j MCCB PROTEIN
(Escherichia
coli) 		3 / 3 ASN A 154
ASP A 148
ARG A 285
 None
APC  A 359 (-3.0A)
None
 0.62A 3k13C-3h9jA:
undetectable		 3k13C-3h9jA:
21.77
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.
3KO0_J_TFPJ202_1
(PROTEIN S100-A4)		 2c5u RNA LIGASE
(Escherichia
virus
T4) 		5 / 11 LEU A 274
ASP A 273
LEU A 262
ILE A 288
PHE A  77
 None
APC  A1375 ( 4.3A)
None
None
None
 1.29A 3ko0A-2c5uA:
1.6
3ko0B-2c5uA:
0.0
3ko0I-2c5uA:
1.5
3ko0J-2c5uA:
undetectable		 3ko0A-2c5uA:
14.40
3ko0B-2c5uA:
14.40
3ko0I-2c5uA:
14.40
3ko0J-2c5uA:
14.40
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.
3NW2_A_H4BA902_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)		 5f2v GTP
PYROPHOSPHOKINASE
YJBM
(Bacillus
subtilis) 		3 / 3 ARG V 143
ILE V 153
TRP V 150
 APC  V 301 ( 4.9A)
None
None
 1.03A 3nw2A-5f2vV:
undetectable		 3nw2A-5f2vV:
20.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NW2_B_H4BB902_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)		 5f2v GTP
PYROPHOSPHOKINASE
YJBM
(Bacillus
subtilis) 		3 / 3 ARG V 143
ILE V 153
TRP V 150
 APC  V 301 ( 4.9A)
None
None
 0.98A 3nw2B-5f2vV:
undetectable		 3nw2B-5f2vV:
20.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NXU_B_RITB600_2
(CYTOCHROME P450 3A4)		 6fpe ATPASE YJEE,
PREDICTED TO HAVE
ESSENTIAL ROLE IN
CELL WALL
BIOSYNTHESIS
(Thermotoga
maritima) 		5 / 9 ILE E  76
LEU E  33
PHE E  44
THR E  63
GLY E  40
 None
None
None
None
APC  E 201 (-3.6A)
 1.47A 3nxuB-6fpeE:
undetectable		 3nxuB-6fpeE:
10.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3QWU_A_ADNA501_1
(DNA LIGASE)		 2c5u RNA LIGASE
(Escherichia
virus
T4) 		5 / 12 LYS A  99
GLU A 159
VAL A 206
VAL A 230
LYS A 240
 APC  A1375 (-2.7A)
APC  A1375 (-2.9A)
None
APC  A1375 (-4.5A)
APC  A1375 (-2.7A)
 0.72A 3qwuA-2c5uA:
15.6		 3qwuA-2c5uA:
22.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3S3O_A_DLUA399_1
(PFV INTEGRASE)		 5xog DNA-DIRECTED RNA
POLYMERASE SUBUNIT
DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA
(Komagataella
phaffii) 		4 / 7 ASP A 486
ASP A 484
GLN A 526
ARG B 766
 MG  A1803 (-2.6A)
MG  A1803 ( 2.2A)
None
APC  A1804 (-3.4A)
 1.18A 3s3oA-5xogA:
undetectable		 3s3oA-5xogA:
12.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3SJ0_X_DXCX75_0
(CYTOCHROME C7)		 3g5a FMN
ADENYLYLTRANSFERASE
([Candida]
glabrata) 		4 / 7 ILE A 277
LYS A  65
PHE A 114
GLY A 224
 None
APC  A 305 (-2.9A)
None
None
 0.99A 3sj0X-3g5aA:
undetectable		 3sj0X-3g5aA:
11.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4DJE_A_C2FA300_0
(5-METHYLTETRAHYDROFO
LATE CORRINOID/IRON
SULFUR PROTEIN
METHYLTRANSFERASE)		 3lpn RIBOSE-PHOSPHATE
PYROPHOSPHOKINASE
(Thermoplasma
volcanium) 		5 / 12 ASP A 211
LEU A 242
GLY A  88
SER A 104
GLN A  92
 None
None
None
None
APC  A 287 (-3.3A)
 1.33A 4djeA-3lpnA:
3.3		 4djeA-3lpnA:
22.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4EQ4_B_SALB601_1
(4-SUBSTITUTED
BENZOATES-GLUTAMATE
LIGASE GH3.12)		 4l39 4-SUBSTITUTED
BENZOATES-GLUTAMATE
LIGASE GH3.12
(Arabidopsis
thaliana) 		8 / 8 LEU A 116
TYR A 120
ARG A 123
THR A 161
ILE A 217
VAL A 299
THR A 324
GLY A 326
 SAL  A 602 (-4.7A)
SAL  A 602 (-4.3A)
SAL  A 602 (-3.1A)
None
SAL  A 602 ( 4.4A)
APC  A 603 (-4.2A)
SAL  A 602 ( 3.7A)
SAL  A 602 ( 3.6A)
 0.33A 4eq4B-4l39A:
63.2		 4eq4B-4l39A:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FEU_B_KANB301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 2pz8 NH(3)-DEPENDENT
NAD(+) SYNTHETASE
(Bacillus
anthracis) 		4 / 7 ASP A  51
ASP A 159
ASP A 233
GLU A 163
 APC  A3001 (-3.7A)
None
None
APC  A3001 ( 4.6A)
 1.09A 4feuB-2pz8A:
undetectable		 4feuB-2pz8A:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FEU_D_KAND301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 2pz8 NH(3)-DEPENDENT
NAD(+) SYNTHETASE
(Bacillus
anthracis) 		4 / 8 ASP A  51
ASP A 159
ASP A 233
GLU A 163
 APC  A3001 (-3.7A)
None
None
APC  A3001 ( 4.6A)
 1.07A 4feuD-2pz8A:
undetectable		 4feuD-2pz8A:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FEU_F_KANF301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 2pz8 NH(3)-DEPENDENT
NAD(+) SYNTHETASE
(Bacillus
anthracis) 		4 / 8 ASP A  51
ASP A 159
ASP A 233
GLU A 163
 APC  A3001 (-3.7A)
None
None
APC  A3001 ( 4.6A)
 1.06A 4feuF-2pz8A:
undetectable		 4feuF-2pz8A:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FEV_B_KANB301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 2pz8 NH(3)-DEPENDENT
NAD(+) SYNTHETASE
(Bacillus
anthracis) 		4 / 7 ASP A  51
ASP A 159
ASP A 233
GLU A 163
 APC  A3001 (-3.7A)
None
None
APC  A3001 ( 4.6A)
 1.11A 4fevB-2pz8A:
undetectable		 4fevB-2pz8A:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FEV_D_KAND301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 2pz8 NH(3)-DEPENDENT
NAD(+) SYNTHETASE
(Bacillus
anthracis) 		4 / 7 ASP A  51
ASP A 159
ASP A 233
GLU A 163
 APC  A3001 (-3.7A)
None
None
APC  A3001 ( 4.6A)
 1.11A 4fevD-2pz8A:
undetectable		 4fevD-2pz8A:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FEV_F_KANF301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 2pz8 NH(3)-DEPENDENT
NAD(+) SYNTHETASE
(Bacillus
anthracis) 		4 / 7 ASP A  51
ASP A 159
ASP A 233
GLU A 163
 APC  A3001 (-3.7A)
None
None
APC  A3001 ( 4.6A)
 1.10A 4fevF-2pz8A:
undetectable		 4fevF-2pz8A:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FEW_B_KANB301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 2pz8 NH(3)-DEPENDENT
NAD(+) SYNTHETASE
(Bacillus
anthracis) 		4 / 7 ASP A  51
ASP A 159
ASP A 233
GLU A 163
 APC  A3001 (-3.7A)
None
None
APC  A3001 ( 4.6A)
 1.10A 4fewB-2pz8A:
undetectable		 4fewB-2pz8A:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FEW_D_KAND301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 2pz8 NH(3)-DEPENDENT
NAD(+) SYNTHETASE
(Bacillus
anthracis) 		4 / 8 ASP A  51
ASP A 159
ASP A 233
GLU A 163
 APC  A3001 (-3.7A)
None
None
APC  A3001 ( 4.6A)
 1.12A 4fewD-2pz8A:
undetectable		 4fewD-2pz8A:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FEW_F_KANF301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 2pz8 NH(3)-DEPENDENT
NAD(+) SYNTHETASE
(Bacillus
anthracis) 		4 / 8 ASP A  51
ASP A 159
ASP A 233
GLU A 163
 APC  A3001 (-3.7A)
None
None
APC  A3001 ( 4.6A)
 1.11A 4fewF-2pz8A:
undetectable		 4fewF-2pz8A:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FEX_B_KANB301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 2pz8 NH(3)-DEPENDENT
NAD(+) SYNTHETASE
(Bacillus
anthracis) 		4 / 7 ASP A  51
ASP A 159
ASP A 233
GLU A 163
 APC  A3001 (-3.7A)
None
None
APC  A3001 ( 4.6A)
 1.14A 4fexB-2pz8A:
undetectable		 4fexB-2pz8A:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4GKH_B_KANB301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 2pz8 NH(3)-DEPENDENT
NAD(+) SYNTHETASE
(Bacillus
anthracis) 		4 / 8 ASP A  51
ASP A 159
ASP A 233
GLU A 163
 APC  A3001 (-3.7A)
None
None
APC  A3001 ( 4.6A)
 1.12A 4gkhB-2pz8A:
undetectable		 4gkhB-2pz8A:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4GKH_D_KAND301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 2pz8 NH(3)-DEPENDENT
NAD(+) SYNTHETASE
(Bacillus
anthracis) 		4 / 8 ASP A  51
ASP A 159
ASP A 233
GLU A 163
 APC  A3001 (-3.7A)
None
None
APC  A3001 ( 4.6A)
 1.10A 4gkhD-2pz8A:
undetectable		 4gkhD-2pz8A:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4GKH_F_KANF301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 2pz8 NH(3)-DEPENDENT
NAD(+) SYNTHETASE
(Bacillus
anthracis) 		4 / 8 ASP A  51
ASP A 159
ASP A 233
GLU A 163
 APC  A3001 (-3.7A)
None
None
APC  A3001 ( 4.6A)
 1.14A 4gkhF-2pz8A:
undetectable		 4gkhF-2pz8A:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4GKH_G_KANG301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 2pz8 NH(3)-DEPENDENT
NAD(+) SYNTHETASE
(Bacillus
anthracis) 		4 / 7 ASP A  51
ASP A 159
ASP A 233
GLU A 163
 APC  A3001 (-3.7A)
None
None
APC  A3001 ( 4.6A)
 1.12A 4gkhG-2pz8A:
undetectable		 4gkhG-2pz8A:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4GKH_J_KANJ301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 2pz8 NH(3)-DEPENDENT
NAD(+) SYNTHETASE
(Bacillus
anthracis) 		4 / 6 ASP A  51
ASP A 159
ASP A 233
GLU A 163
 APC  A3001 (-3.7A)
None
None
APC  A3001 ( 4.6A)
 1.11A 4gkhJ-2pz8A:
undetectable		 4gkhJ-2pz8A:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4GKH_K_KANK301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 2pz8 NH(3)-DEPENDENT
NAD(+) SYNTHETASE
(Bacillus
anthracis) 		4 / 8 ASP A  51
ASP A 159
ASP A 233
GLU A 163
 APC  A3001 (-3.7A)
None
None
APC  A3001 ( 4.6A)
 1.10A 4gkhC-2pz8A:
undetectable
4gkhK-2pz8A:
undetectable		 4gkhC-2pz8A:
21.57
4gkhK-2pz8A:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4GKI_A_KANA301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 2pz8 NH(3)-DEPENDENT
NAD(+) SYNTHETASE
(Bacillus
anthracis) 		4 / 8 ASP A  51
ASP A 159
ASP A 233
GLU A 163
 APC  A3001 (-3.7A)
None
None
APC  A3001 ( 4.6A)
 1.13A 4gkiA-2pz8A:
undetectable		 4gkiA-2pz8A:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4GKI_C_KANC301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 2pz8 NH(3)-DEPENDENT
NAD(+) SYNTHETASE
(Bacillus
anthracis) 		4 / 8 ASP A  51
ASP A 159
ASP A 233
GLU A 163
 APC  A3001 (-3.7A)
None
None
APC  A3001 ( 4.6A)
 1.12A 4gkiC-2pz8A:
undetectable		 4gkiC-2pz8A:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4GKI_G_KANG301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 2pz8 NH(3)-DEPENDENT
NAD(+) SYNTHETASE
(Bacillus
anthracis) 		4 / 8 ASP A  51
ASP A 159
ASP A 233
GLU A 163
 APC  A3001 (-3.7A)
None
None
APC  A3001 ( 4.6A)
 1.12A 4gkiE-2pz8A:
undetectable
4gkiG-2pz8A:
undetectable		 4gkiE-2pz8A:
21.57
4gkiG-2pz8A:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K87_A_ADNA602_1
(PROLINE--TRNA LIGASE)		 4dpg LYSINE--TRNA LIGASE
(Homo
sapiens) 		4 / 8 ARG A 323
PHE A 335
GLY A 548
THR A 337
 APC  A 602 (-3.1A)
APC  A 602 (-3.8A)
LYS  A 601 ( 4.0A)
None
 0.98A 4k87A-4dpgA:
11.3		 4k87A-4dpgA:
22.74
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.
4KR3_A_GLYA701_0
(GLYCINE--TRNA LIGASE)		 4dpg LYSINE--TRNA LIGASE
(Homo
sapiens) 		4 / 6 ARG A 323
GLU A 494
ARG A 485
GLU A 487
 APC  A 602 (-3.1A)
MG  A 603 ( 3.4A)
None
MG  A 603 (-3.4A)
 1.32A 4kr3A-4dpgA:
13.4		 4kr3A-4dpgA:
22.89
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4M5M_A_DX4A401_0
(2-AMINO-4-HYDROXY-6-
HYDROXYMETHYLDIHYDRO
PTERIDINE
PYROPHOSPHOKINASE)		 5ets 2-AMINO-4-HYDROXY-6-
HYDROXYMETHYLDIHYDRO
PTERIDINE
PYROPHOSPHOKINASE
(Staphylococcus
aureus) 		5 / 8 GLY B   9
THR B  43
ASN B  56
ARG B  92
PHE B 123
 5RX  B 202 ( 4.4A)
5RX  B 202 (-3.8A)
5RX  B 202 (-3.2A)
APC  B 201 ( 3.1A)
5RX  B 202 (-3.3A)
 0.45A 4m5mA-5etsB:
26.4		 4m5mA-5etsB:
40.00
Potential target for repurposing, i.e. matched protein structure has less than 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)		 1kny KANAMYCIN
NUCLEOTIDYLTRANSFERA
SE
(Staphylococcus
aureus) 		5 / 11 SER A  49
THR A 186
THR A 187
ARG A   9
GLY A  41
 APC  A 556 (-2.9A)
None
APC  A 556 (-3.4A)
None
None
 1.34A 4qvlV-1knyA:
undetectable
4qvlb-1knyA:
undetectable		 4qvlV-1knyA:
25.63
4qvlb-1knyA:
22.76
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.
4QVL_N_BO2N201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 1kny KANAMYCIN
NUCLEOTIDYLTRANSFERA
SE
(Staphylococcus
aureus) 		5 / 11 SER A  49
THR A 186
THR A 187
ARG A   9
GLY A  41
 APC  A 556 (-2.9A)
None
APC  A 556 (-3.4A)
None
None
 1.34A 4qvlH-1knyA:
undetectable
4qvlN-1knyA:
undetectable		 4qvlH-1knyA:
25.63
4qvlN-1knyA:
22.76
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.
4QVM_B_BO2B201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 1kny KANAMYCIN
NUCLEOTIDYLTRANSFERA
SE
(Staphylococcus
aureus) 		5 / 11 SER A  49
THR A 186
THR A 187
ARG A   9
GLY A  41
 APC  A 556 (-2.9A)
None
APC  A 556 (-3.4A)
None
None
 1.36A 4qvmV-1knyA:
undetectable
4qvmb-1knyA:
undetectable		 4qvmV-1knyA:
25.63
4qvmb-1knyA:
22.76
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.
4QVM_N_BO2N201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 1kny KANAMYCIN
NUCLEOTIDYLTRANSFERA
SE
(Staphylococcus
aureus) 		5 / 11 SER A  49
THR A 186
THR A 187
ARG A   9
GLY A  41
 APC  A 556 (-2.9A)
None
APC  A 556 (-3.4A)
None
None
 1.36A 4qvmH-1knyA:
undetectable
4qvmN-1knyA:
undetectable		 4qvmH-1knyA:
25.63
4qvmN-1knyA:
22.76
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.
4QVP_B_BO2B201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 1kny KANAMYCIN
NUCLEOTIDYLTRANSFERA
SE
(Staphylococcus
aureus) 		5 / 11 SER A  49
THR A 186
THR A 187
ARG A   9
GLY A  41
 APC  A 556 (-2.9A)
None
APC  A 556 (-3.4A)
None
None
 1.37A 4qvpV-1knyA:
undetectable
4qvpb-1knyA:
undetectable		 4qvpV-1knyA:
25.63
4qvpb-1knyA:
22.76
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.
4QVP_N_BO2N201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 1kny KANAMYCIN
NUCLEOTIDYLTRANSFERA
SE
(Staphylococcus
aureus) 		5 / 11 SER A  49
THR A 186
THR A 187
ARG A   9
GLY A  41
 APC  A 556 (-2.9A)
None
APC  A 556 (-3.4A)
None
None
 1.37A 4qvpH-1knyA:
undetectable
4qvpN-1knyA:
undetectable		 4qvpH-1knyA:
25.63
4qvpN-1knyA:
22.76
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.
4QVQ_B_BO2B201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 1kny KANAMYCIN
NUCLEOTIDYLTRANSFERA
SE
(Staphylococcus
aureus) 		5 / 11 SER A  49
THR A 186
THR A 187
ARG A   9
GLY A  41
 APC  A 556 (-2.9A)
None
APC  A 556 (-3.4A)
None
None
 1.37A 4qvqV-1knyA:
undetectable
4qvqb-1knyA:
undetectable		 4qvqV-1knyA:
25.63
4qvqb-1knyA:
22.76
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.
4QVQ_N_BO2N201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 1kny KANAMYCIN
NUCLEOTIDYLTRANSFERA
SE
(Staphylococcus
aureus) 		5 / 11 SER A  49
THR A 186
THR A 187
ARG A   9
GLY A  41
 APC  A 556 (-2.9A)
None
APC  A 556 (-3.4A)
None
None
 1.38A 4qvqH-1knyA:
undetectable
4qvqN-1knyA:
undetectable		 4qvqH-1knyA:
25.63
4qvqN-1knyA:
22.76
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.
4QVW_B_BO2B201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 1kny KANAMYCIN
NUCLEOTIDYLTRANSFERA
SE
(Staphylococcus
aureus) 		5 / 11 SER A  49
THR A 186
THR A 187
ARG A   9
GLY A  41
 APC  A 556 (-2.9A)
None
APC  A 556 (-3.4A)
None
None
 1.34A 4qvwV-1knyA:
undetectable
4qvwb-1knyA:
undetectable		 4qvwV-1knyA:
25.63
4qvwb-1knyA:
22.76
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.
4QVW_N_BO2N201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 1kny KANAMYCIN
NUCLEOTIDYLTRANSFERA
SE
(Staphylococcus
aureus) 		5 / 11 SER A  49
THR A 186
THR A 187
ARG A   9
GLY A  41
 APC  A 556 (-2.9A)
None
APC  A 556 (-3.4A)
None
None
 1.34A 4qvwH-1knyA:
undetectable
4qvwN-1knyA:
undetectable		 4qvwH-1knyA:
25.63
4qvwN-1knyA:
22.76
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.
4QW0_B_BO2B201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 1kny KANAMYCIN
NUCLEOTIDYLTRANSFERA
SE
(Staphylococcus
aureus) 		5 / 11 SER A  49
THR A 186
THR A 187
ARG A   9
GLY A  41
 APC  A 556 (-2.9A)
None
APC  A 556 (-3.4A)
None
None
 1.34A 4qw0V-1knyA:
undetectable
4qw0b-1knyA:
undetectable		 4qw0V-1knyA:
25.63
4qw0b-1knyA:
22.76
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.
4QW0_N_BO2N201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 1kny KANAMYCIN
NUCLEOTIDYLTRANSFERA
SE
(Staphylococcus
aureus) 		5 / 11 SER A  49
THR A 186
THR A 187
ARG A   9
GLY A  41
 APC  A 556 (-2.9A)
None
APC  A 556 (-3.4A)
None
None
 1.34A 4qw0H-1knyA:
undetectable
4qw0N-1knyA:
undetectable		 4qw0H-1knyA:
25.63
4qw0N-1knyA:
22.76
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.
4QW1_B_BO2B201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 1kny KANAMYCIN
NUCLEOTIDYLTRANSFERA
SE
(Staphylococcus
aureus) 		5 / 11 SER A  49
THR A 186
THR A 187
ARG A   9
GLY A  41
 APC  A 556 (-2.9A)
None
APC  A 556 (-3.4A)
None
None
 1.36A 4qw1V-1knyA:
undetectable
4qw1b-1knyA:
undetectable		 4qw1V-1knyA:
25.63
4qw1b-1knyA:
22.76
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.
4QW1_N_BO2N201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 1kny KANAMYCIN
NUCLEOTIDYLTRANSFERA
SE
(Staphylococcus
aureus) 		5 / 11 SER A  49
THR A 186
THR A 187
ARG A   9
GLY A  41
 APC  A 556 (-2.9A)
None
APC  A 556 (-3.4A)
None
None
 1.37A 4qw1H-1knyA:
undetectable
4qw1N-1knyA:
undetectable		 4qw1H-1knyA:
25.63
4qw1N-1knyA:
22.76
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.
4QW3_B_BO2B201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 1kny KANAMYCIN
NUCLEOTIDYLTRANSFERA
SE
(Staphylococcus
aureus) 		5 / 11 SER A  49
THR A 186
THR A 187
ARG A   9
GLY A  41
 APC  A 556 (-2.9A)
None
APC  A 556 (-3.4A)
None
None
 1.36A 4qw3V-1knyA:
undetectable
4qw3b-1knyA:
undetectable		 4qw3V-1knyA:
25.63
4qw3b-1knyA:
22.76
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.
4QW3_N_BO2N201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 1kny KANAMYCIN
NUCLEOTIDYLTRANSFERA
SE
(Staphylococcus
aureus) 		5 / 11 SER A  49
THR A 186
THR A 187
ARG A   9
GLY A  41
 APC  A 556 (-2.9A)
None
APC  A 556 (-3.4A)
None
None
 1.36A 4qw3H-1knyA:
undetectable
4qw3N-1knyA:
undetectable		 4qw3H-1knyA:
25.63
4qw3N-1knyA:
22.76
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.
4QWU_B_BO2B201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 1kny KANAMYCIN
NUCLEOTIDYLTRANSFERA
SE
(Staphylococcus
aureus) 		5 / 11 SER A  49
THR A 186
THR A 187
ARG A   9
GLY A  41
 APC  A 556 (-2.9A)
None
APC  A 556 (-3.4A)
None
None
 1.40A 4qwuV-1knyA:
undetectable
4qwub-1knyA:
undetectable		 4qwuV-1knyA:
25.63
4qwub-1knyA:
22.76
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.
4QWU_N_BO2N201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 1kny KANAMYCIN
NUCLEOTIDYLTRANSFERA
SE
(Staphylococcus
aureus) 		5 / 11 SER A  49
THR A 186
THR A 187
ARG A   9
GLY A  41
 APC  A 556 (-2.9A)
None
APC  A 556 (-3.4A)
None
None
 1.40A 4qwuH-1knyA:
undetectable
4qwuN-1knyA:
undetectable		 4qwuH-1knyA:
25.63
4qwuN-1knyA:
22.76
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.
4RVD_A_SAMA502_0
(D-MYCAROSE
3-C-METHYLTRANSFERAS
E)		 3vth HYDROGENASE
MATURATION FACTOR
(Caldanaerobacter
subterraneus) 		5 / 12 ILE A 283
GLY A 305
PRO A 251
ALA A 298
ILE A 381
 None
APC  A 804 (-4.0A)
APC  A 804 (-4.0A)
APC  A 804 ( 4.5A)
None
 1.08A 4rvdA-3vthA:
undetectable		 4rvdA-3vthA:
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.
4UCK_B_SAMB2409_1
(RNA-DIRECTED RNA
POLYMERASE L)		 2pz8 NH(3)-DEPENDENT
NAD(+) SYNTHETASE
(Bacillus
anthracis) 		4 / 6 GLY A  48
ASP A 211
ASP A  51
ASP A  90
 None
GOL  A3309 (-3.2A)
APC  A3001 (-3.7A)
None
 0.96A 4uckB-2pz8A:
undetectable		 4uckB-2pz8A:
23.99
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.
5BXN_B_BO2B201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 1kny KANAMYCIN
NUCLEOTIDYLTRANSFERA
SE
(Staphylococcus
aureus) 		5 / 11 SER A  49
THR A 186
THR A 187
ARG A   9
GLY A  41
 APC  A 556 (-2.9A)
None
APC  A 556 (-3.4A)
None
None
 1.37A 5bxnV-1knyA:
undetectable
5bxnb-1knyA:
undetectable		 5bxnV-1knyA:
25.63
5bxnb-1knyA:
22.76
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.
5BXN_N_BO2N201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 1kny KANAMYCIN
NUCLEOTIDYLTRANSFERA
SE
(Staphylococcus
aureus) 		5 / 11 SER A  49
THR A 186
THR A 187
ARG A   9
GLY A  41
 APC  A 556 (-2.9A)
None
APC  A 556 (-3.4A)
None
None
 1.38A 5bxnH-1knyA:
undetectable
5bxnN-1knyA:
undetectable		 5bxnH-1knyA:
25.63
5bxnN-1knyA:
22.76
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.
5CZ7_N_BO2N201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 1kny KANAMYCIN
NUCLEOTIDYLTRANSFERA
SE
(Staphylococcus
aureus) 		5 / 11 SER A  49
THR A 186
THR A 187
ARG A   9
GLY A  41
 APC  A 556 (-2.9A)
None
APC  A 556 (-3.4A)
None
None
 1.36A 5cz7H-1knyA:
undetectable
5cz7N-1knyA:
undetectable		 5cz7H-1knyA:
25.63
5cz7N-1knyA:
22.76
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.
5D0X_B_BO2B201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 1kny KANAMYCIN
NUCLEOTIDYLTRANSFERA
SE
(Staphylococcus
aureus) 		5 / 11 SER A  49
THR A 186
THR A 187
ARG A   9
GLY A  41
 APC  A 556 (-2.9A)
None
APC  A 556 (-3.4A)
None
None
 1.34A 5d0xV-1knyA:
undetectable
5d0xb-1knyA:
undetectable		 5d0xV-1knyA:
25.63
5d0xb-1knyA:
22.76
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.
5D0X_N_BO2N201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 1kny KANAMYCIN
NUCLEOTIDYLTRANSFERA
SE
(Staphylococcus
aureus) 		5 / 11 SER A  49
THR A 186
THR A 187
ARG A   9
GLY A  41
 APC  A 556 (-2.9A)
None
APC  A 556 (-3.4A)
None
None
 1.35A 5d0xH-1knyA:
undetectable
5d0xN-1knyA:
undetectable		 5d0xH-1knyA:
25.63
5d0xN-1knyA:
22.76
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.
5FHR_B_SAMB303_0
(CATECHOL
O-METHYLTRANSFERASE)		 4l39 4-SUBSTITUTED
BENZOATES-GLUTAMATE
LIGASE GH3.12
(Arabidopsis
thaliana) 		5 / 12 VAL A 345
GLY A 404
TYR A 347
ASN A 407
TYR A 406
 None
None
APC  A 603 (-4.4A)
None
None
 1.44A 5fhrB-4l39A:
2.3		 5fhrB-4l39A:
17.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HQA_A_ACRA705_1
(ALPHA-GLUCOSIDASE)		 4q85 RIBOSOMAL PROTEIN
S12
METHYLTHIOTRANSFERAS
E ACCESSORY FACTOR
YCAO
(Escherichia
coli) 		5 / 12 GLU A  78
GLU A 290
LYS A  61
GLU A  75
GLU A 199
 MG  A 603 ( 2.8A)
MG  A 604 ( 2.5A)
APC  A 601 ( 3.3A)
APC  A 601 (-3.2A)
MG  A 603 ( 2.5A)
 1.22A 5hqaA-4q85A:
0.0		 5hqaA-4q85A:
21.52
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.
5KPC_A_SAMA401_0
(PAVINE
N-METHYLTRANSFERASE)		 3h9j MCCB PROTEIN
(Escherichia
coli) 		5 / 12 GLY A 127
GLY A 124
LEU A 160
VAL A 210
ALA A 298
 None
APC  A 359 (-3.0A)
None
None
None
 0.90A 5kpcA-3h9jA:
4.3		 5kpcA-3h9jA:
21.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5L66_B_BO2B201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 1kny KANAMYCIN
NUCLEOTIDYLTRANSFERA
SE
(Staphylococcus
aureus) 		5 / 11 SER A  49
THR A 186
THR A 187
ARG A   9
GLY A  41
 APC  A 556 (-2.9A)
None
APC  A 556 (-3.4A)
None
None
 1.38A 5l66V-1knyA:
undetectable
5l66b-1knyA:
undetectable		 5l66V-1knyA:
25.63
5l66b-1knyA:
22.76
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.
5L66_N_BO2N201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 1kny KANAMYCIN
NUCLEOTIDYLTRANSFERA
SE
(Staphylococcus
aureus) 		5 / 11 SER A  49
THR A 186
THR A 187
ARG A   9
GLY A  41
 APC  A 556 (-2.9A)
None
APC  A 556 (-3.4A)
None
None
 1.37A 5l66H-1knyA:
undetectable
5l66N-1knyA:
undetectable		 5l66H-1knyA:
25.63
5l66N-1knyA:
22.76
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.
5N5D_B_SAMB303_1
(METHYLTRANSFERASE)		 4dpg LYSINE--TRNA LIGASE
(Homo
sapiens) 		4 / 7 GLY A 326
GLU A 325
ASP A 328
ASN A 332
 None
APC  A 602 ( 4.7A)
None
None
 1.02A 5n5dB-4dpgA:
undetectable		 5n5dB-4dpgA:
18.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5N8J_E_DVAE7_0
(GLY-DTY-GLY-DLE-DAL-
DSG-DVA-DAS-DGL-DSN-
DSN-GLY
STREPTAVIDIN)		 3g5a FMN
ADENYLYLTRANSFERASE
([Candida]
glabrata) 		3 / 3 TYR A 216
SER A 222
TRP A 202
 APC  A 305 (-4.7A)
APC  A 305 (-2.5A)
None
 0.98A 5n8jB-3g5aA:
undetectable		 5n8jB-3g5aA:
21.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5N8J_O_DVAO7_0
(GLY-DTY-GLY-DLE-DAL-
DSG-DVA-DAS-DGL-DSN-
DSN-GLY
STREPTAVIDIN)		 3g5a FMN
ADENYLYLTRANSFERASE
([Candida]
glabrata) 		3 / 3 TYR A 216
SER A 222
TRP A 202
 APC  A 305 (-4.7A)
APC  A 305 (-2.5A)
None
 0.99A 5n8jA-3g5aA:
undetectable		 5n8jA-3g5aA:
21.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UXC_A_ZITA306_1
(PREDICTED
AMINOGLYCOSIDE
PHOSPHOTRANSFERASE)		 5y0q UPF0348 PROTEIN
B4417_3650
(Bacillus
subtilis) 		4 / 7 ARG A 187
PHE A 100
LEU A  98
SER A 172
 APC  A1001 (-2.8A)
None
None
None
 0.90A 5uxcA-5y0qA:
undetectable		 5uxcA-5y0qA:
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.
5VLM_G_CVIG301_1
(REGULATORY PROTEIN
TETR)		 6fpe ATPASE YJEE,
PREDICTED TO HAVE
ESSENTIAL ROLE IN
CELL WALL
BIOSYNTHESIS
(Thermotoga
maritima) 		4 / 7 GLY E 110
TYR E  70
ASP E  80
TYR E  82
 None
None
APC  E 201 ( 4.7A)
None
 1.20A 5vlmG-6fpeE:
undetectable		 5vlmG-6fpeE:
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.
5ZVG_B_SAMB401_1
(389AA LONG
HYPOTHETICAL
NUCLEOLAR PROTEIN)		 1vfg POLY A POLYMERASE
(Aquifex
aeolicus) 		3 / 3 ASP A 100
ARG A  79
ASP A  33
 None
None
APC  A 500 ( 4.8A)
 0.89A 5zvgB-1vfgA:
undetectable		 5zvgB-1vfgA:
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.
6BNI_A_ADNA602_1
(LYSINE--TRNA LIGASE)		 4dpg LYSINE--TRNA LIGASE
(Homo
sapiens) 		6 / 10 ARG A 323
GLU A 325
HIS A 331
PHE A 335
GLY A 550
ILE A 564
 APC  A 602 (-3.1A)
APC  A 602 ( 4.7A)
APC  A 602 (-4.2A)
APC  A 602 (-3.8A)
APC  A 602 (-3.4A)
None
 0.89A 6bniA-4dpgA:
51.4		 6bniA-4dpgA:
9.98
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.
6BNI_A_ADNA602_1
(LYSINE--TRNA LIGASE)		 4dpg LYSINE--TRNA LIGASE
(Homo
sapiens) 		6 / 10 ARG A 323
PHE A 335
GLU A 494
GLY A 550
ARG A 553
ILE A 564
 APC  A 602 (-3.1A)
APC  A 602 (-3.8A)
MG  A 603 ( 3.4A)
APC  A 602 (-3.4A)
APC  A 602 (-3.7A)
None
 1.06A 6bniA-4dpgA:
51.4		 6bniA-4dpgA:
9.98
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.
6BNI_B_ADNB602_1
(LYSINE--TRNA LIGASE)		 4dpg LYSINE--TRNA LIGASE
(Homo
sapiens) 		6 / 10 ARG A 323
GLU A 325
HIS A 331
PHE A 335
GLY A 550
ILE A 564
 APC  A 602 (-3.1A)
APC  A 602 ( 4.7A)
APC  A 602 (-4.2A)
APC  A 602 (-3.8A)
APC  A 602 (-3.4A)
None
 0.84A 6bniB-4dpgA:
51.5		 6bniB-4dpgA:
9.98
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.
6BNI_B_ADNB602_1
(LYSINE--TRNA LIGASE)		 4dpg LYSINE--TRNA LIGASE
(Homo
sapiens) 		6 / 10 ARG A 323
PHE A 335
GLU A 494
GLY A 550
ARG A 553
ILE A 564
 APC  A 602 (-3.1A)
APC  A 602 (-3.8A)
MG  A 603 ( 3.4A)
APC  A 602 (-3.4A)
APC  A 602 (-3.7A)
None
 1.05A 6bniB-4dpgA:
51.5		 6bniB-4dpgA:
9.98
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.
6CE2_B_SVRB202_1
()		 3g5a FMN
ADENYLYLTRANSFERASE
([Candida]
glabrata) 		4 / 8 LEU A 130
LEU A 132
LEU A  70
GLY A 163
 None
None
None
APC  A 305 (-3.2A)
 0.90A 6ce2A-3g5aA:
undetectable		 6ce2A-3g5aA:
16.99