SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'P6G'


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.
1A7Y_A_DVAA8_0
(ACTINOMYCIN D)		 4h16 SHORT CHAIN ALCOHOL
DEHYDROGENASE-RELATE
D DEHYDROGENASE
(Sinorhizobium
meliloti) 		3 / 3 THR A 149
THR A 148
PRO A 145
 None
P6G  A 305 ( 4.5A)
None
 0.77A 1a7yA-4h16A:
undetectable		 1a7yA-4h16A:
3.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1A7Y_B_DVAB8_0
(ACTINOMYCIN D)		 4h16 SHORT CHAIN ALCOHOL
DEHYDROGENASE-RELATE
D DEHYDROGENASE
(Sinorhizobium
meliloti) 		3 / 3 THR A 149
THR A 148
PRO A 145
 None
P6G  A 305 ( 4.5A)
None
 0.80A 1a7yB-4h16A:
undetectable		 1a7yB-4h16A:
3.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1BX4_A_ADNA350_1
(PROTEIN (ADENOSINE
KINASE))		 4h16 SHORT CHAIN ALCOHOL
DEHYDROGENASE-RELATE
D DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 12 LEU A 116
GLY A  86
GLY A  85
ALA A 112
LEU A  57
 None
P6G  A 305 ( 3.7A)
P6G  A 305 (-4.9A)
None
None
 0.97A 1bx4A-4h16A:
5.7		 1bx4A-4h16A:
24.51
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.
1EII_A_RTLA135_1
(CELLULAR
RETINOL-BINDING
PROTEIN II)		 3qg7 AP4-24H11 ANTIBODY
HEAVY CHAIN
(Mus
musculus) 		4 / 7 GLN H  81
THR H  70
SER H  68
GLN H  77
 None
None
P6G  H 229 (-4.2A)
None
 1.44A 1eiiA-3qg7H:
undetectable		 1eiiA-3qg7H:
19.63
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.
1G5Y_C_9CRC502_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 5xj1 UNCHARACTERIZED RNA
METHYLTRANSFERASE
SP_1029
(Streptococcus
pneumoniae) 		5 / 10 ALA A  74
LEU A  71
PHE A 160
PHE A 159
ILE A  80
 None
None
None
P6G  A 503 (-4.0A)
P6G  A 503 ( 4.7A)
 1.21A 1g5yC-5xj1A:
undetectable		 1g5yC-5xj1A:
19.69
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.
1GTI_B_CCSB47_0
(GLUTATHIONE
S-TRANSFERASE)		 5w7a ACYLOXYACYL
HYDROLASE LARGE
SUBUNIT
(Oryctolagus
cuniculus) 		4 / 7 LEU B 480
THR B 483
LEU B 415
GLY B 417
 None
P6G  B 608 (-3.3A)
None
None
 0.93A 1gtiB-5w7aB:
undetectable		 1gtiB-5w7aB:
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.
1HZE_A_RBFA98_1
(RIBOFLAVIN SYNTHASE
ALPHA CHAIN)		 4h16 SHORT CHAIN ALCOHOL
DEHYDROGENASE-RELATE
D DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 9 LEU A 144
LEU A 142
THR A 255
ILE A 218
ILE A 211
 None
None
None
None
P6G  A 305 ( 4.9A)
 1.27A 1hzeA-4h16A:
undetectable
1hzeB-4h16A:
undetectable		 1hzeA-4h16A:
17.51
1hzeB-4h16A:
17.51
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.
1HZE_B_RBFB99_1
(RIBOFLAVIN SYNTHASE
ALPHA CHAIN)		 4h16 SHORT CHAIN ALCOHOL
DEHYDROGENASE-RELATE
D DEHYDROGENASE
(Sinorhizobium
meliloti) 		5 / 9 ILE A 211
LEU A 144
LEU A 142
THR A 255
ILE A 218
 P6G  A 305 ( 4.9A)
None
None
None
None
 1.27A 1hzeA-4h16A:
undetectable
1hzeB-4h16A:
undetectable		 1hzeA-4h16A:
17.51
1hzeB-4h16A:
17.51
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.
1I3W_E_DVAE2_0
(ACTINOMYCIN D)		 4h16 SHORT CHAIN ALCOHOL
DEHYDROGENASE-RELATE
D DEHYDROGENASE
(Sinorhizobium
meliloti) 		3 / 3 THR A 148
PRO A 145
THR A 149
 P6G  A 305 ( 4.5A)
None
None
 0.78A 1i3wE-4h16A:
undetectable		 1i3wE-4h16A:
3.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1I3W_F_DVAF8_0
(ACTINOMYCIN D)		 4h16 SHORT CHAIN ALCOHOL
DEHYDROGENASE-RELATE
D DEHYDROGENASE
(Sinorhizobium
meliloti) 		3 / 3 THR A 149
THR A 148
PRO A 145
 None
P6G  A 305 ( 4.5A)
None
 0.80A 1i3wF-4h16A:
undetectable		 1i3wF-4h16A:
3.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1I3W_G_DVAG2_0
(ACTINOMYCIN D)		 4h16 SHORT CHAIN ALCOHOL
DEHYDROGENASE-RELATE
D DEHYDROGENASE
(Sinorhizobium
meliloti) 		3 / 3 THR A 148
PRO A 145
THR A 149
 P6G  A 305 ( 4.5A)
None
None
 0.81A 1i3wG-4h16A:
undetectable		 1i3wG-4h16A:
3.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1I3W_G_DVAG8_0
(ACTINOMYCIN D)		 4h16 SHORT CHAIN ALCOHOL
DEHYDROGENASE-RELATE
D DEHYDROGENASE
(Sinorhizobium
meliloti) 		3 / 3 THR A 149
THR A 148
PRO A 145
 None
P6G  A 305 ( 4.5A)
None
 0.86A 1i3wG-4h16A:
undetectable		 1i3wG-4h16A:
3.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1KT4_A_RTLA184_0
(PLASMA
RETINOL-BINDING
PROTEIN)		 4bwc PHOSPHOLIPASE B-LIKE
1
(Bos
taurus) 		5 / 12 LEU B 366
LEU B 357
ALA B 502
ALA B 497
VAL B 360
 None
P6G  B1546 ( 4.1A)
None
P6G  B1546 (-4.3A)
None
 1.27A 1kt4A-4bwcB:
undetectable		 1kt4A-4bwcB:
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.
1L2I_A_CCSA417_0
(ESTROGEN RECEPTOR)		 1w99 PESTICIDIAL CRYSTAL
PROTEIN CRY4BA
(Bacillus
thuringiensis) 		3 / 3 GLU A 286
LYS A 467
VAL A 469
 None
P6G  A1667 (-4.1A)
None
 0.95A 1l2iA-1w99A:
undetectable		 1l2iA-1w99A:
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.
1MNV_D_DVAD8_0
(ACTINOMYCIN D)		 4h16 SHORT CHAIN ALCOHOL
DEHYDROGENASE-RELATE
D DEHYDROGENASE
(Sinorhizobium
meliloti) 		3 / 3 THR A 149
THR A 148
PRO A 145
 None
P6G  A 305 ( 4.5A)
None
 0.80A 1mnvD-4h16A:
undetectable		 1mnvD-4h16A:
3.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1N49_B_RITB301_2
(PROTEASE)		 3o9t NONSTRUCTURAL
PROTEIN 1
(Influenza
A
virus) 		5 / 11 GLY A 158
VAL A 192
ILE A 182
GLY A 184
ILE A 128
 None
None
None
P6G  A5928 (-3.8A)
None
 0.96A 1n49B-3o9tA:
undetectable		 1n49B-3o9tA:
22.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1N49_D_RITD401_1
(PROTEASE)		 3o9t NONSTRUCTURAL
PROTEIN 1
(Influenza
A
virus) 		5 / 11 GLY A 158
VAL A 192
ILE A 182
GLY A 184
ILE A 128
 None
None
None
P6G  A5928 (-3.8A)
None
 0.95A 1n49C-3o9tA:
undetectable		 1n49C-3o9tA:
22.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1OVF_B_DVAB2_0
(ACTINOMYCIN D)		 4h16 SHORT CHAIN ALCOHOL
DEHYDROGENASE-RELATE
D DEHYDROGENASE
(Sinorhizobium
meliloti) 		3 / 3 THR A 148
PRO A 145
THR A 149
 P6G  A 305 ( 4.5A)
None
None
 0.88A 1ovfB-4h16A:
undetectable		 1ovfB-4h16A:
3.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1P2Y_A_NCTA440_1
(CYTOCHROME P450-CAM)		 4uzs BETA-GALACTOSIDASE
(Bifidobacterium
bifidum) 		4 / 7 LEU A  89
VAL A  53
GLY A  54
ASP A  74
 None
None
None
P6G  A 705 ( 3.5A)
 0.42A 1p2yA-4uzsA:
undetectable		 1p2yA-4uzsA:
20.89
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.
1QFI_A_DVAA8_0
(ACTINOMYCIN X2)		 4h16 SHORT CHAIN ALCOHOL
DEHYDROGENASE-RELATE
D DEHYDROGENASE
(Sinorhizobium
meliloti) 		3 / 3 THR A 149
THR A 148
PRO A 145
 None
P6G  A 305 ( 4.5A)
None
 0.78A 1qfiA-4h16A:
undetectable		 1qfiA-4h16A:
3.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1QFI_B_DVAB8_0
(ACTINOMYCIN X2)		 4h16 SHORT CHAIN ALCOHOL
DEHYDROGENASE-RELATE
D DEHYDROGENASE
(Sinorhizobium
meliloti) 		3 / 3 THR A 149
THR A 148
PRO A 145
 None
P6G  A 305 ( 4.5A)
None
 0.83A 1qfiB-4h16A:
undetectable		 1qfiB-4h16A:
3.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1RLB_F_REAF177_1
(RETINOL BINDING
PROTEIN)		 4bwc PHOSPHOLIPASE B-LIKE
1
(Bos
taurus) 		5 / 11 LEU B 357
ALA B 502
ALA B 497
VAL B 360
LEU B 366
 P6G  B1546 ( 4.1A)
None
P6G  B1546 (-4.3A)
None
None
 1.05A 1rlbF-4bwcB:
undetectable		 1rlbF-4bwcB:
21.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1RNR_B_DAHB208_1
(RIBONUCLEOTIDE
REDUCTASE R1 PROTEIN)		 2inc TOLUENE, O-XYLENE
MONOOXYGENASE
OXYGENASE SUBUNIT
(Pseudomonas
stutzeri) 		5 / 12 GLU A 134
HIS A 137
GLU A 197
PHE A 205
ILE A 227
 FE  A 502 ( 2.5A)
FE  A 501 (-3.3A)
FE  A 502 (-2.7A)
P6G  A 503 (-4.9A)
None
 1.12A 1rnrB-2incA:
15.1		 1rnrB-2incA:
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.
1S14_B_NOVB2300_1
(TOPOISOMERASE IV
SUBUNIT B)		 5cxo EPOXIDE HYDROLASE
(Streptomyces
albus) 		5 / 12 ASN A  58
SER A  57
ARG A  52
ALA A  34
ILE A  36
 P6G  A 202 (-3.2A)
P6G  A 202 (-3.2A)
None
None
None
 1.36A 1s14B-5cxoA:
undetectable		 1s14B-5cxoA:
20.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1T88_A_CAMA1422_0
(CYTOCHROME P450-CAM)		 4uzs BETA-GALACTOSIDASE
(Bifidobacterium
bifidum) 		4 / 7 LEU A  89
VAL A  53
GLY A  54
ASP A  74
 None
None
None
P6G  A 705 ( 3.5A)
 0.35A 1t88A-4uzsA:
undetectable		 1t88A-4uzsA:
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.
1UNJ_F_DVAF2_0
(7-AMINO-ACTINOMYCIN
D)		 4h16 SHORT CHAIN ALCOHOL
DEHYDROGENASE-RELATE
D DEHYDROGENASE
(Sinorhizobium
meliloti) 		3 / 3 THR A 148
PRO A 145
THR A 149
 P6G  A 305 ( 4.5A)
None
None
 0.85A 1unjF-4h16A:
undetectable		 1unjF-4h16A:
3.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1UNJ_F_DVAF8_0
(7-AMINO-ACTINOMYCIN
D)		 4h16 SHORT CHAIN ALCOHOL
DEHYDROGENASE-RELATE
D DEHYDROGENASE
(Sinorhizobium
meliloti) 		3 / 3 THR A 149
THR A 148
PRO A 145
 None
P6G  A 305 ( 4.5A)
None
 0.79A 1unjF-4h16A:
undetectable		 1unjF-4h16A:
3.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1UNJ_R_DVAR8_0
(7-AMINO-ACTINOMYCIN
D)		 4h16 SHORT CHAIN ALCOHOL
DEHYDROGENASE-RELATE
D DEHYDROGENASE
(Sinorhizobium
meliloti) 		3 / 3 THR A 149
THR A 148
PRO A 145
 None
P6G  A 305 ( 4.5A)
None
 0.85A 1unjR-4h16A:
undetectable		 1unjR-4h16A:
3.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1UNM_F_DVAF2_0
(7-AMINOACTINOMYCIN D)		 4h16 SHORT CHAIN ALCOHOL
DEHYDROGENASE-RELATE
D DEHYDROGENASE
(Sinorhizobium
meliloti) 		3 / 3 THR A 148
PRO A 145
THR A 149
 P6G  A 305 ( 4.5A)
None
None
 0.85A 1unmF-4h16A:
undetectable		 1unmF-4h16A:
3.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1UNM_F_DVAF8_0
(7-AMINOACTINOMYCIN D)		 4h16 SHORT CHAIN ALCOHOL
DEHYDROGENASE-RELATE
D DEHYDROGENASE
(Sinorhizobium
meliloti) 		3 / 3 THR A 149
THR A 148
PRO A 145
 None
P6G  A 305 ( 4.5A)
None
 0.80A 1unmF-4h16A:
undetectable		 1unmF-4h16A:
3.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1VM1_A_TAZA504_1
(BETA-LACTAMASE SHV-1)		 4are COLLAGENASE G
(Hathewaya
histolytica) 		3 / 3 ASP A 340
TYR A 344
GLU A 381
 P6G  A1791 (-3.4A)
P6G  A1791 ( 3.5A)
None
 0.85A 1vm1A-4areA:
undetectable		 1vm1A-4areA:
20.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1WRL_D_TFPD207_1
(TROPONIN C, SLOW
SKELETAL AND CARDIAC
MUSCLES)		 2qib TETR-FAMILY
TRANSCRIPTIONAL
REGULATOR
(Streptomyces
coelicolor) 		4 / 8 LEU A 208
PHE A 186
MET A 190
SER A 193
 None
P6G  A 703 (-4.1A)
None
None
 1.02A 1wrlC-2qibA:
undetectable
1wrlD-2qibA:
undetectable		 1wrlC-2qibA:
17.14
1wrlD-2qibA:
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.
1WRL_F_TFPF211_1
(TROPONIN C, SLOW
SKELETAL AND CARDIAC
MUSCLES)		 2qib TETR-FAMILY
TRANSCRIPTIONAL
REGULATOR
(Streptomyces
coelicolor) 		4 / 7 LEU A 137
PHE A 186
MET A 190
SER A 193
 None
P6G  A 703 (-4.1A)
None
None
 0.86A 1wrlE-2qibA:
undetectable
1wrlF-2qibA:
undetectable		 1wrlE-2qibA:
17.14
1wrlF-2qibA:
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.
1X7P_A_SAMA301_0
(RRNA
METHYLTRANSFERASE)		 4mes THIAMINE TRANSPORTER
THIT
(Lactococcus
lactis) 		6 / 11 GLY A  59
GLY A  56
ILE A  24
LEU A  20
ALA A  18
ALA A  21
 None
None
P6G  A 220 (-4.0A)
P6G  A 220 (-4.9A)
None
None
 1.48A 1x7pA-4mesA:
undetectable
1x7pB-4mesA:
undetectable		 1x7pA-4mesA:
20.91
1x7pB-4mesA:
20.91
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.
1X7P_A_SAMA301_0
(RRNA
METHYLTRANSFERASE)		 4mes THIAMINE TRANSPORTER
THIT
(Lactococcus
lactis) 		6 / 11 GLY A  60
GLY A  56
ILE A  24
LEU A  20
ALA A  18
ALA A  21
 None
None
P6G  A 220 (-4.0A)
P6G  A 220 (-4.9A)
None
None
 1.30A 1x7pA-4mesA:
undetectable
1x7pB-4mesA:
undetectable		 1x7pA-4mesA:
20.91
1x7pB-4mesA:
20.91
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.
2A1O_A_CAMA1422_0
(CYTOCHROME P450-CAM)		 4uzs BETA-GALACTOSIDASE
(Bifidobacterium
bifidum) 		4 / 8 LEU A  89
VAL A  53
GLY A  54
ASP A  74
 None
None
None
P6G  A 705 ( 3.5A)
 0.44A 2a1oA-4uzsA:
undetectable		 2a1oA-4uzsA:
20.89
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.
2A3B_B_CFFB2434_1
(CHITINASE)		 3wyh LYSOZYME G
(Struthio
camelus) 		4 / 6 GLU A  73
TYR A 147
ASP A  97
ARG A  99
 TAM  A 201 (-2.9A)
P6G  A 202 ( 3.5A)
TAM  A 201 ( 3.4A)
None
 1.41A 2a3bB-3wyhA:
undetectable		 2a3bB-3wyhA:
20.42
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.
2A7Q_A_CFBA328_2
(DEOXYCYTIDINE KINASE)		 4hhr ALPHA-DIOXYGENASE
(Arabidopsis
thaliana) 		4 / 4 ILE A 507
ASP A 535
LEU A 540
ARG A 500
 P6G  A 715 (-4.8A)
None
None
None
 1.26A 2a7qA-4hhrA:
undetectable		 2a7qA-4hhrA:
18.04
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.
2AVV_A_MK1A901_1
(POL POLYPROTEIN)		 3o9t NONSTRUCTURAL
PROTEIN 1
(Influenza
A
virus) 		5 / 12 GLY A 158
ILE A 182
GLY A 183
GLY A 184
ILE A 128
 None
None
P6G  A5928 (-3.7A)
P6G  A5928 (-3.8A)
None
 0.78A 2avvA-3o9tA:
undetectable		 2avvA-3o9tA:
22.22
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.
2AVV_A_MK1A901_2
(POL POLYPROTEIN)		 1xqa GLYOXALASE/BLEOMYCIN
RESISTANCE PROTEIN
(Bacillus
cereus) 		3 / 3 ASP A  83
VAL A  87
PRO A  90
 P6G  A 502 (-3.2A)
None
None
 0.70A 2avvA-1xqaA:
undetectable		 2avvA-1xqaA:
20.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2BXE_B_1FLB2001_1
(SERUM ALBUMIN)		 3ctz XAA-PRO
AMINOPEPTIDASE 1
(Homo
sapiens) 		5 / 12 ILE A 414
PHE A 381
TYR A 420
VAL A 427
LEU A 341
 None
P6G  A 628 ( 4.0A)
None
None
None
 1.27A 2bxeB-3ctzA:
undetectable		 2bxeB-3ctzA:
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.
2DCF_A_ACAA502_1
(6-AMINOHEXANOATE-DIM
ER HYDROLASE)		 5cxo EPOXIDE HYDROLASE
(Streptomyces
albus) 		5 / 12 MET A  87
ALA A  61
ASP A  38
SER A  57
ASN A  58
 P6G  A 202 (-3.1A)
None
P6G  A 202 (-3.8A)
P6G  A 202 (-3.2A)
P6G  A 202 (-3.2A)
 1.08A 2dcfA-5cxoA:
undetectable		 2dcfA-5cxoA:
17.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2DQY_A_CHDA1_0
(LIVER
CARBOXYLESTERASE 1)		 5cxp POSSIBLE XYLAN
DEGRADATION ENZYME
(GLYCOSYL HYDROLASE
FAMILY 30-LIKE
DOMAIN AND RICIN
B-LIKE DOMAIN)
(Clostridium
acetobutylicum) 		4 / 5 TRP A 263
GLY A 235
LYS A 283
LEU A 272
 P6G  A 622 (-3.5A)
None
None
None
 1.50A 2dqyA-5cxpA:
undetectable		 2dqyA-5cxpA:
21.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2OKC_A_SAMA500_0
(TYPE I RESTRICTION
ENZYME STYSJI M
PROTEIN)		 3wyh LYSOZYME G
(Struthio
camelus) 		5 / 12 ILE A 144
GLY A 150
GLY A 143
SER A 100
ASN A 148
 None
P6G  A 202 (-3.4A)
None
None
TAM  A 201 ( 3.5A)
 1.14A 2okcA-3wyhA:
undetectable		 2okcA-3wyhA:
18.12
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.
2OKC_B_SAMB500_0
(TYPE I RESTRICTION
ENZYME STYSJI M
PROTEIN)		 3wyh LYSOZYME G
(Struthio
camelus) 		5 / 12 ILE A 144
GLY A 150
GLY A 143
SER A 100
ASN A 148
 None
P6G  A 202 (-3.4A)
None
None
TAM  A 201 ( 3.5A)
 1.15A 2okcB-3wyhA:
undetectable		 2okcB-3wyhA:
18.12
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.
2PIV_A_T3A933_1
(ANDROGEN RECEPTOR)		 4hhr ALPHA-DIOXYGENASE
(Arabidopsis
thaliana) 		5 / 9 PRO A 506
ILE A 507
GLY A 529
GLU A 532
ARG A 500
 None
P6G  A 715 (-4.8A)
None
None
None
 1.36A 2pivA-4hhrA:
undetectable		 2pivA-4hhrA:
15.24
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.
2PNJ_B_CHDB502_0
(FERROCHELATASE,
MITOCHONDRIAL)		 5xj1 UNCHARACTERIZED RNA
METHYLTRANSFERASE
SP_1029
(Streptococcus
pneumoniae) 		4 / 7 ILE A 161
ARG A 127
GLY A 144
MET A 154
 None
P6G  A 503 (-3.5A)
None
None
 1.10A 2pnjB-5xj1A:
3.7		 2pnjB-5xj1A:
22.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Q0I_A_BEZA990_0
(QUINOLONE SIGNAL
RESPONSE PROTEIN)		 3kkf PUTATIVE ANTIBIOTIC
BIOSYNTHESIS
MONOOXYGENASE
(Bacteroides
thetaiotaomicron) 		4 / 8 ASP A 120
GLU A  85
SER A  36
LEU A 118
 None
ACT  A 203 ( 3.9A)
P6G  A 206 ( 4.9A)
None
 1.05A 2q0iA-3kkfA:
undetectable		 2q0iA-3kkfA:
14.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QO4_A_CHDA130_0
(LIVER-BASIC FATTY
ACID BINDING PROTEIN)		 1lkd BIPHENYL-2,3-DIOL
1,2-DIOXYGENASE
(Paraburkholderia
xenovorans) 		5 / 12 LEU A  27
ALA A 224
VAL A 221
THR A 235
HIS A 210
 None
None
None
P6G  A 600 ( 4.8A)
FE2  A 500 ( 3.5A)
 1.32A 2qo4A-1lkdA:
0.0		 2qo4A-1lkdA:
16.21
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.
2QO6_A_CHDA130_0
(LIVER-BASIC FATTY
ACID BINDING PROTEIN)		 1lkd BIPHENYL-2,3-DIOL
1,2-DIOXYGENASE
(Paraburkholderia
xenovorans) 		5 / 12 LEU A  27
ALA A 224
VAL A 221
THR A 235
HIS A 210
 None
None
None
P6G  A 600 ( 4.8A)
FE2  A 500 ( 3.5A)
 1.31A 2qo6A-1lkdA:
undetectable		 2qo6A-1lkdA:
17.51
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.
2V3D_A_NBVA1503_1
(GLUCOSYLCERAMIDASE)		 5cxp POSSIBLE XYLAN
DEGRADATION ENZYME
(GLYCOSYL HYDROLASE
FAMILY 30-LIKE
DOMAIN AND RICIN
B-LIKE DOMAIN)
(Clostridium
acetobutylicum) 		7 / 12 TRP A  87
ASN A 140
GLU A 141
HIS A 207
TYR A 209
GLU A 230
TRP A 263
 P6G  A 622 (-4.0A)
P6G  A 622 (-3.3A)
NA  A 607 ( 2.1A)
None
P6G  A 622 ( 3.4A)
P6G  A 622 ( 2.7A)
P6G  A 622 (-3.5A)
 0.55A 2v3dA-5cxpA:
34.6		 2v3dA-5cxpA:
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.
2V3D_B_NBVB1504_1
(GLUCOSYLCERAMIDASE)		 5cxp POSSIBLE XYLAN
DEGRADATION ENZYME
(GLYCOSYL HYDROLASE
FAMILY 30-LIKE
DOMAIN AND RICIN
B-LIKE DOMAIN)
(Clostridium
acetobutylicum) 		6 / 11 TRP A  87
ASN A 140
GLU A 141
TYR A 209
GLU A 230
TRP A 263
 P6G  A 622 (-4.0A)
P6G  A 622 (-3.3A)
NA  A 607 ( 2.1A)
P6G  A 622 ( 3.4A)
P6G  A 622 ( 2.7A)
P6G  A 622 (-3.5A)
 0.59A 2v3dB-5cxpA:
34.6		 2v3dB-5cxpA:
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.
2V7U_B_SAMB1299_1
(5'-FLUORO-5'-DEOXY
ADENOSINE SYNTHETASE)		 5o0x PUTATIVE FERRIC
REDUCTASE
(Cylindrospermum
stagnale) 		4 / 7 PHE A 578
TRP A 580
SER A 425
ARG A 478
 None
None
P6G  A 812 ( 3.6A)
CL  A 802 (-3.5A)
 1.37A 2v7uB-5o0xA:
4.5		 2v7uB-5o0xA:
19.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2VMY_A_FFOA505_1
(SERINE
HYDROXYMETHYLTRANSFE
RASE)		 2qib TETR-FAMILY
TRANSCRIPTIONAL
REGULATOR
(Streptomyces
coelicolor) 		5 / 12 LEU A 109
VAL A 116
SER A  69
ALA A  68
SER A  30
 None
None
P6G  A 701 ( 4.3A)
P6G  A 701 ( 3.9A)
None
 1.27A 2vmyB-2qibA:
undetectable		 2vmyB-2qibA:
22.22
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.
2ZMA_A_ACAA502_1
(6-AMINOHEXANOATE-DIM
ER HYDROLASE)		 5cxo EPOXIDE HYDROLASE
(Streptomyces
albus) 		5 / 11 MET A  87
ALA A  61
ASP A  38
SER A  57
ASN A  58
 P6G  A 202 (-3.1A)
None
P6G  A 202 (-3.8A)
P6G  A 202 (-3.2A)
P6G  A 202 (-3.2A)
 1.08A 2zmaA-5cxoA:
undetectable		 2zmaA-5cxoA:
17.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3A35_B_RBFB191_1
(LUMAZINE PROTEIN)		 4ql0 FILAMENTOUS
HEMAGGLUTININ
TRANSPORTER PROTEIN
FHAC
(Bordetella
pertussis) 		5 / 12 SER A 157
ASP A 171
GLN A 174
ALA A 175
ILE A 179
 None
1PE  A 607 (-3.4A)
P6G  A 609 (-3.7A)
None
None
 1.19A 3a35B-4ql0A:
undetectable		 3a35B-4ql0A:
16.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3A65_A_ACAA601_1
(6-AMINOHEXANOATE-DIM
ER HYDROLASE)		 5cxo EPOXIDE HYDROLASE
(Streptomyces
albus) 		5 / 12 MET A  87
ALA A  61
ASP A  38
SER A  57
ASN A  58
 P6G  A 202 (-3.1A)
None
P6G  A 202 (-3.8A)
P6G  A 202 (-3.2A)
P6G  A 202 (-3.2A)
 1.12A 3a65A-5cxoA:
undetectable		 3a65A-5cxoA:
17.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3A66_A_ACAA601_1
(6-AMINOHEXANOATE-DIM
ER HYDROLASE)		 5cxo EPOXIDE HYDROLASE
(Streptomyces
albus) 		5 / 10 MET A  87
ALA A  61
ASP A  38
SER A  57
ASN A  58
 P6G  A 202 (-3.1A)
None
P6G  A 202 (-3.8A)
P6G  A 202 (-3.2A)
P6G  A 202 (-3.2A)
 1.11A 3a66A-5cxoA:
undetectable		 3a66A-5cxoA:
17.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3CS8_A_BRLA503_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 2h84 STEELY1
(Dictyostelium
discoideum) 		5 / 12 GLY A3133
CYH A2930
ILE A2978
LEU A3028
LEU A3030
 None
P6G  A1000 (-3.4A)
None
None
P6G  A1000 ( 4.4A)
 1.36A 3cs8A-2h84A:
undetectable		 3cs8A-2h84A:
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.
3CYX_A_ROCA201_3
(HIV-1 PROTEASE)		 3o9t NONSTRUCTURAL
PROTEIN 1
(Influenza
A
virus) 		5 / 12 GLY A 158
ILE A 182
GLY A 183
GLY A 184
ILE A 128
 None
None
P6G  A5928 (-3.7A)
P6G  A5928 (-3.8A)
None
 0.79A 3cyxB-3o9tA:
undetectable		 3cyxB-3o9tA:
22.22
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.
3F8W_B_ADNB301_1
(PURINE-NUCLEOSIDE
PHOSPHORYLASE)		 2qib TETR-FAMILY
TRANSCRIPTIONAL
REGULATOR
(Streptomyces
coelicolor) 		5 / 12 GLY A 117
VAL A 116
GLY A 112
ASN A 122
VAL A 125
 None
None
None
None
P6G  A 701 ( 4.0A)
 1.34A 3f8wB-2qibA:
undetectable		 3f8wB-2qibA:
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.
3G4L_C_ROFC903_1
(CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4D)		 2inc TOLUENE, O-XYLENE
MONOOXYGENASE
OXYGENASE SUBUNIT
(Pseudomonas
stutzeri) 		3 / 3 SER A 289
GLN A 288
PHE A 293
 None
None
P6G  A 503 ( 4.5A)
 0.83A 3g4lC-2incA:
undetectable		 3g4lC-2incA:
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.
3HS6_B_EPAB1_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 4uir OLEATE HYDRATASE
(Elizabethkingia
meningoseptica) 		5 / 12 GLY A 109
TYR A 152
ILE A 116
GLY A 120
GLY A 107
 None
None
None
P6G  A1649 ( 3.3A)
None
 1.02A 3hs6B-4uirA:
undetectable		 3hs6B-4uirA:
21.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3K8M_A_ACRA720_1
(ALPHA-AMYLASE, SUSG)		 4gbm CURM
SULFOTRANSFERASE
(Moorea
producens) 		4 / 7 TYR A 305
TRP A 194
LEU A 303
ASN A 198
 None
None
P6G  A 417 (-4.9A)
None
 1.06A 3k8mA-4gbmA:
undetectable		 3k8mA-4gbmA:
18.96
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.
3K8M_B_ACRB820_1
(ALPHA-AMYLASE, SUSG)		 4gbm CURM
SULFOTRANSFERASE
(Moorea
producens) 		4 / 7 TYR A 305
TRP A 194
LEU A 303
ASN A 198
 None
None
P6G  A 417 (-4.9A)
None
 1.02A 3k8mB-4gbmA:
undetectable		 3k8mB-4gbmA:
18.96
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.
3LSL_G_PZIG800_0
(GLUTAMATE RECEPTOR 2)		 3hbz PUTATIVE GLYCOSIDE
HYDROLASE
(Bacteroides
thetaiotaomicron) 		4 / 6 ASN A 278
LEU A 274
ASP A 275
LYS A 220
 None
None
None
P6G  A 362 (-3.0A)
 1.44A 3lslG-3hbzA:
undetectable		 3lslG-3hbzA:
22.01
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.
3MED_A_65BA561_0
(P51 REVERSE
TRANSCRIPTASE
P66 REVERSE
TRANSCRIPTASE)		 3w6x MPR1 PROTEIN
(Saccharomyces
cerevisiae) 		5 / 12 LEU A  61
VAL A  47
TYR A 121
PHE A 138
LEU A 139
 None
None
P6G  A 302 ( 4.6A)
None
None
 1.28A 3medA-3w6xA:
undetectable
3medB-3w6xA:
undetectable		 3medA-3w6xA:
18.16
3medB-3w6xA:
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.
3NK7_B_SAMB770_0
(23S RRNA
METHYLTRANSFERASE)		 2h84 STEELY1
(Dictyostelium
discoideum) 		5 / 12 GLY A2970
GLY A2969
ILE A2810
SER A2965
SER A2976
 P6G  A1000 (-3.5A)
P6G  A1000 (-3.2A)
None
None
None
 0.98A 3nk7B-2h84A:
undetectable		 3nk7B-2h84A:
23.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NS1_C_PM6C1_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)		 5c1m MU-TYPE OPIOID
RECEPTOR
(Mus
musculus) 		4 / 6 PHE A 178
THR A 180
ALA A 168
ALA A 175
 P6G  A 406 (-4.6A)
None
None
None
 1.23A 3ns1C-5c1mA:
undetectable		 3ns1C-5c1mA:
17.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3PEO_F_CU9F301_2
(SOLUBLE
ACETYLCHOLINE
RECEPTOR)		 3tdg PUTATIVE
UNCHARACTERIZED
PROTEIN
(Helicobacter
pylori) 		4 / 6 THR A  71
GLN A 119
TYR A  73
ILE A  75
 None
None
None
P6G  A 401 ( 4.1A)
 1.14A 3peoG-3tdgA:
undetectable		 3peoG-3tdgA:
20.48
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.
3Q1E_C_T44C128_1
(5-HYDROXYISOURATE
HYDROLASE)		 3iuz PUTATIVE GLYOXALASE
SUPERFAMILY PROTEIN
(Cupriavidus
pinatubonensis) 		4 / 6 PRO A 108
LEU A 106
LEU A 195
LEU A 199
 P6G  A 340 ( 4.8A)
None
None
None
 1.07A 3q1eA-3iuzA:
undetectable
3q1eC-3iuzA:
undetectable		 3q1eA-3iuzA:
19.16
3q1eC-3iuzA:
19.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3RGL_A_GLYA301_0
(GLYCYL-TRNA
SYNTHETASE ALPHA
SUBUNIT)		 3se5 CELL FILAMENTATION
PROTEIN FIC-RELATED
PROTEIN
(Neisseria
meningitidis) 		4 / 8 ALA A  40
GLY A  41
THR A  38
GLN A  44
 None
None
None
P6G  A 202 ( 3.5A)
 0.90A 3rglA-3se5A:
undetectable		 3rglA-3se5A:
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.
3SUD_D_SUED1201_2
(NS3 PROTEASE, NS4A
PROTEIN)		 4w7s PRE-MRNA-SPLICING
ATP-DEPENDENT RNA
HELICASE PRP28
(Saccharomyces
cerevisiae) 		4 / 5 PHE A 217
LEU A 229
LYS A 227
ARG A 202
 None
None
None
P6G  A 604 (-3.6A)
 1.48A 3sudD-4w7sA:
undetectable		 3sudD-4w7sA:
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.
3T3R_B_9PLB501_1
(CYTOCHROME P450 2A6)		 1xqa GLYOXALASE/BLEOMYCIN
RESISTANCE PROTEIN
(Bacillus
cereus) 		5 / 9 PHE A  98
VAL A  87
ASN A  77
ILE A  76
PHE A  19
 None
None
None
P6G  A 502 ( 4.9A)
None
 1.14A 3t3rB-1xqaA:
undetectable		 3t3rB-1xqaA:
13.99
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.
3TVX_B_PNXB902_1
(CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4A)		 5cxo EPOXIDE HYDROLASE
(Streptomyces
albus) 		4 / 7 TYR A  54
ILE A  36
PHE A  30
PHE A 106
 P6G  A 202 (-4.9A)
None
None
None
 1.15A 3tvxB-5cxoA:
undetectable		 3tvxB-5cxoA:
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.
3V4T_E_ACTE502_0
(UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE)		 3kkf PUTATIVE ANTIBIOTIC
BIOSYNTHESIS
MONOOXYGENASE
(Bacteroides
thetaiotaomicron) 		3 / 3 LYS A 106
ARG A  34
LEU A 116
 P6G  A 206 (-2.7A)
P6G  A 206 ( 4.6A)
P6G  A 206 (-4.0A)
 1.11A 3v4tE-3kkfA:
undetectable		 3v4tE-3kkfA:
13.25
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.
3VWP_A_ACAA503_1
(6-AMINOHEXANOATE-DIM
ER HYDROLASE)		 5cxo EPOXIDE HYDROLASE
(Streptomyces
albus) 		5 / 10 MET A  87
ALA A  61
ASP A  38
SER A  57
ASN A  58
 P6G  A 202 (-3.1A)
None
P6G  A 202 (-3.8A)
P6G  A 202 (-3.2A)
P6G  A 202 (-3.2A)
 1.11A 3vwpA-5cxoA:
undetectable		 3vwpA-5cxoA:
17.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3VWQ_A_ACAA601_1
(6-AMINOHEXANOATE-DIM
ER HYDROLASE)		 5cxo EPOXIDE HYDROLASE
(Streptomyces
albus) 		5 / 12 MET A  87
ALA A  61
ASP A  38
SER A  57
ASN A  58
 P6G  A 202 (-3.1A)
None
P6G  A 202 (-3.8A)
P6G  A 202 (-3.2A)
P6G  A 202 (-3.2A)
 1.11A 3vwqA-5cxoA:
undetectable		 3vwqA-5cxoA:
17.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3VWR_A_ACAA601_1
(6-AMINOHEXANOATE-DIM
ER HYDROLASE)		 5cxo EPOXIDE HYDROLASE
(Streptomyces
albus) 		5 / 11 MET A  87
ALA A  61
ASP A  38
SER A  57
ASN A  58
 P6G  A 202 (-3.1A)
None
P6G  A 202 (-3.8A)
P6G  A 202 (-3.2A)
P6G  A 202 (-3.2A)
 1.13A 3vwrA-5cxoA:
undetectable		 3vwrA-5cxoA:
17.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4A3U_A_NCAA1359_0
(NADH:FLAVIN
OXIDOREDUCTASE/NADH
OXIDASE)		 4uir OLEATE HYDRATASE
(Elizabethkingia
meningoseptica) 		4 / 7 THR A 268
HIS A 442
ASN A 438
TYR A 152
 None
None
P6G  A1649 (-3.4A)
None
 1.30A 4a3uA-4uirA:
undetectable		 4a3uA-4uirA:
19.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4A3U_B_NCAB1359_0
(NADH:FLAVIN
OXIDOREDUCTASE/NADH
OXIDASE)		 4uir OLEATE HYDRATASE
(Elizabethkingia
meningoseptica) 		4 / 7 THR A 268
HIS A 442
ASN A 438
TYR A 152
 None
None
P6G  A1649 (-3.4A)
None
 1.29A 4a3uB-4uirA:
undetectable		 4a3uB-4uirA:
19.39
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4DAJ_A_0HKA2000_1
(MUSCARINIC
ACETYLCHOLINE
RECEPTOR M3,
LYSOZYME)		 5dsg MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M4,ENDOLYSIN,ENDOLYS
IN,MUSCARINIC
ACETYLCHOLINE
RECEPTOR M4
(Escherichia
virus
T4;
Homo
sapiens) 		12 / 12 ASP A 112
TYR A 113
SER A 116
ASN A 117
TRP A 164
THR A 196
ALA A 203
TRP A 413
TYR A 416
ASN A 417
TYR A 439
CYH A 442
 0HK  A1201 (-4.0A)
0HK  A1201 ( 3.2A)
0HK  A1201 (-3.3A)
OLC  A1208 ( 3.6A)
OLC  A1208 ( 4.0A)
P6G  A1205 (-4.6A)
0HK  A1201 (-3.6A)
0HK  A1201 (-4.3A)
0HK  A1201 (-4.2A)
0HK  A1201 (-2.8A)
0HK  A1201 (-3.6A)
0HK  A1201 (-3.6A)
 0.62A 4dajA-5dsgA:
42.2		 4dajA-5dsgA:
66.12
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4DAJ_B_0HKB2000_1
(MUSCARINIC
ACETYLCHOLINE
RECEPTOR M3,
LYSOZYME)		 5dsg MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M4,ENDOLYSIN,ENDOLYS
IN,MUSCARINIC
ACETYLCHOLINE
RECEPTOR M4
(Escherichia
virus
T4;
Homo
sapiens) 		11 / 12 ASP A 112
TYR A 113
SER A 116
THR A 196
THR A 199
ALA A 203
TRP A 413
TYR A 416
ASN A 417
TYR A 439
CYH A 442
 0HK  A1201 (-4.0A)
0HK  A1201 ( 3.2A)
0HK  A1201 (-3.3A)
P6G  A1205 (-4.6A)
OLC  A1208 (-4.4A)
0HK  A1201 (-3.6A)
0HK  A1201 (-4.3A)
0HK  A1201 (-4.2A)
0HK  A1201 (-2.8A)
0HK  A1201 (-3.6A)
0HK  A1201 (-3.6A)
 0.64A 4dajB-5dsgA:
42.1		 4dajB-5dsgA:
66.12
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4DAJ_B_0HKB2000_1
(MUSCARINIC
ACETYLCHOLINE
RECEPTOR M3,
LYSOZYME)		 5dsg MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M4,ENDOLYSIN,ENDOLYS
IN,MUSCARINIC
ACETYLCHOLINE
RECEPTOR M4
(Escherichia
virus
T4;
Homo
sapiens) 		7 / 12 ASP A 112
TYR A 113
THR A 196
TRP A 413
ASN A 417
TYR A 439
CYH A 442
 0HK  A1201 (-4.0A)
0HK  A1201 ( 3.2A)
P6G  A1205 (-4.6A)
0HK  A1201 (-4.3A)
0HK  A1201 (-2.8A)
0HK  A1201 (-3.6A)
0HK  A1201 (-3.6A)
 1.46A 4dajB-5dsgA:
42.1		 4dajB-5dsgA:
66.12
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4DAJ_B_0HKB2000_1
(MUSCARINIC
ACETYLCHOLINE
RECEPTOR M3,
LYSOZYME)		 5dsg MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M4,ENDOLYSIN,ENDOLYS
IN,MUSCARINIC
ACETYLCHOLINE
RECEPTOR M4
(Escherichia
virus
T4;
Homo
sapiens) 		11 / 12 ASP A 112
TYR A 113
TRP A 164
THR A 196
THR A 199
ALA A 203
TRP A 413
TYR A 416
ASN A 417
TYR A 439
CYH A 442
 0HK  A1201 (-4.0A)
0HK  A1201 ( 3.2A)
OLC  A1208 ( 4.0A)
P6G  A1205 (-4.6A)
OLC  A1208 (-4.4A)
0HK  A1201 (-3.6A)
0HK  A1201 (-4.3A)
0HK  A1201 (-4.2A)
0HK  A1201 (-2.8A)
0HK  A1201 (-3.6A)
0HK  A1201 (-3.6A)
 0.51A 4dajB-5dsgA:
42.1		 4dajB-5dsgA:
66.12
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4DAJ_B_0HKB2000_1
(MUSCARINIC
ACETYLCHOLINE
RECEPTOR M3,
LYSOZYME)		 5dsg MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M4,ENDOLYSIN,ENDOLYS
IN,MUSCARINIC
ACETYLCHOLINE
RECEPTOR M4
(Escherichia
virus
T4;
Homo
sapiens) 		5 / 12 TYR A 113
THR A 196
ALA A 200
TYR A 439
CYH A 442
 0HK  A1201 ( 3.2A)
P6G  A1205 (-4.6A)
0HK  A1201 ( 4.2A)
0HK  A1201 (-3.6A)
0HK  A1201 (-3.6A)
 1.30A 4dajB-5dsgA:
42.1		 4dajB-5dsgA:
66.12
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4DAJ_C_0HKC2000_1
(MUSCARINIC
ACETYLCHOLINE
RECEPTOR M3,
LYSOZYME)		 5dsg MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M4,ENDOLYSIN,ENDOLYS
IN,MUSCARINIC
ACETYLCHOLINE
RECEPTOR M4
(Escherichia
virus
T4;
Homo
sapiens) 		11 / 12 ASP A 112
TYR A 113
ASN A 117
TRP A 164
THR A 196
THR A 199
TRP A 413
TYR A 416
ASN A 417
TYR A 439
CYH A 442
 0HK  A1201 (-4.0A)
0HK  A1201 ( 3.2A)
OLC  A1208 ( 3.6A)
OLC  A1208 ( 4.0A)
P6G  A1205 (-4.6A)
OLC  A1208 (-4.4A)
0HK  A1201 (-4.3A)
0HK  A1201 (-4.2A)
0HK  A1201 (-2.8A)
0HK  A1201 (-3.6A)
0HK  A1201 (-3.6A)
 0.55A 4dajC-5dsgA:
41.9		 4dajC-5dsgA:
66.12
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4DAJ_C_0HKC2000_1
(MUSCARINIC
ACETYLCHOLINE
RECEPTOR M3,
LYSOZYME)		 5dsg MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M4,ENDOLYSIN,ENDOLYS
IN,MUSCARINIC
ACETYLCHOLINE
RECEPTOR M4
(Escherichia
virus
T4;
Homo
sapiens) 		11 / 12 ASP A 112
TYR A 113
SER A 116
ASN A 117
THR A 196
THR A 199
TRP A 413
TYR A 416
ASN A 417
TYR A 439
CYH A 442
 0HK  A1201 (-4.0A)
0HK  A1201 ( 3.2A)
0HK  A1201 (-3.3A)
OLC  A1208 ( 3.6A)
P6G  A1205 (-4.6A)
OLC  A1208 (-4.4A)
0HK  A1201 (-4.3A)
0HK  A1201 (-4.2A)
0HK  A1201 (-2.8A)
0HK  A1201 (-3.6A)
0HK  A1201 (-3.6A)
 0.67A 4dajC-5dsgA:
41.9		 4dajC-5dsgA:
66.12
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4DAJ_D_0HKD2000_1
(MUSCARINIC
ACETYLCHOLINE
RECEPTOR M3,
LYSOZYME)		 5dsg MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M4,ENDOLYSIN,ENDOLYS
IN,MUSCARINIC
ACETYLCHOLINE
RECEPTOR M4
(Escherichia
virus
T4;
Homo
sapiens) 		12 / 12 ASP A 112
TYR A 113
SER A 116
ASN A 117
TRP A 164
THR A 196
THR A 199
TRP A 413
TYR A 416
ASN A 417
TYR A 439
CYH A 442
 0HK  A1201 (-4.0A)
0HK  A1201 ( 3.2A)
0HK  A1201 (-3.3A)
OLC  A1208 ( 3.6A)
OLC  A1208 ( 4.0A)
P6G  A1205 (-4.6A)
OLC  A1208 (-4.4A)
0HK  A1201 (-4.3A)
0HK  A1201 (-4.2A)
0HK  A1201 (-2.8A)
0HK  A1201 (-3.6A)
0HK  A1201 (-3.6A)
 0.57A 4dajD-5dsgA:
42.1		 4dajD-5dsgA:
66.12
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4DAJ_D_0HKD2000_1
(MUSCARINIC
ACETYLCHOLINE
RECEPTOR M3,
LYSOZYME)		 5dsg MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M4,ENDOLYSIN,ENDOLYS
IN,MUSCARINIC
ACETYLCHOLINE
RECEPTOR M4
(Escherichia
virus
T4;
Homo
sapiens) 		7 / 12 ASP A 112
TYR A 113
THR A 196
TRP A 413
ASN A 417
TYR A 439
CYH A 442
 0HK  A1201 (-4.0A)
0HK  A1201 ( 3.2A)
P6G  A1205 (-4.6A)
0HK  A1201 (-4.3A)
0HK  A1201 (-2.8A)
0HK  A1201 (-3.6A)
0HK  A1201 (-3.6A)
 1.49A 4dajD-5dsgA:
42.1		 4dajD-5dsgA:
66.12
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.
4IR0_A_FCNA202_1
(METALLOTHIOL
TRANSFERASE FOSB 2)		 1lkd BIPHENYL-2,3-DIOL
1,2-DIOXYGENASE
(Paraburkholderia
xenovorans) 		5 / 11 HIS A 210
TYR A 250
GLU A 260
HIS A 146
ALA A 198
 FE2  A 500 ( 3.5A)
P6G  A 600 ( 3.7A)
FE2  A 500 ( 2.8A)
FE2  A 500 ( 3.5A)
BP6  A 300 ( 4.2A)
 0.57A 4ir0A-1lkdA:
7.2
4ir0B-1lkdA:
7.5		 4ir0A-1lkdA:
17.24
4ir0B-1lkdA:
17.24
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.
4IR0_B_FCNB202_1
(METALLOTHIOL
TRANSFERASE FOSB 2)		 1lkd BIPHENYL-2,3-DIOL
1,2-DIOXYGENASE
(Paraburkholderia
xenovorans) 		5 / 11 HIS A 146
ALA A 198
HIS A 210
TYR A 250
GLU A 260
 FE2  A 500 ( 3.5A)
BP6  A 300 ( 4.2A)
FE2  A 500 ( 3.5A)
P6G  A 600 ( 3.7A)
FE2  A 500 ( 2.8A)
 0.51A 4ir0A-1lkdA:
7.2
4ir0B-1lkdA:
7.5		 4ir0A-1lkdA:
17.24
4ir0B-1lkdA:
17.24
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.
4JD1_A_FCNA202_1
(METALLOTHIOL
TRANSFERASE FOSB 2)		 1lkd BIPHENYL-2,3-DIOL
1,2-DIOXYGENASE
(Paraburkholderia
xenovorans) 		5 / 12 HIS A 210
TYR A 250
GLU A 260
HIS A 146
ALA A 198
 FE2  A 500 ( 3.5A)
P6G  A 600 ( 3.7A)
FE2  A 500 ( 2.8A)
FE2  A 500 ( 3.5A)
BP6  A 300 ( 4.2A)
 0.52A 4jd1A-1lkdA:
7.3
4jd1B-1lkdA:
7.3		 4jd1A-1lkdA:
17.24
4jd1B-1lkdA:
17.24
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.
4JD1_B_FCNB203_1
(METALLOTHIOL
TRANSFERASE FOSB 2)		 1lkd BIPHENYL-2,3-DIOL
1,2-DIOXYGENASE
(Paraburkholderia
xenovorans) 		5 / 12 HIS A 146
ALA A 198
HIS A 210
TYR A 250
GLU A 260
 FE2  A 500 ( 3.5A)
BP6  A 300 ( 4.2A)
FE2  A 500 ( 3.5A)
P6G  A 600 ( 3.7A)
FE2  A 500 ( 2.8A)
 0.63A 4jd1A-1lkdA:
7.3
4jd1B-1lkdA:
7.3		 4jd1A-1lkdA:
17.24
4jd1B-1lkdA:
17.24
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.
4JH3_A_FCNA204_1
(METALLOTHIOL
TRANSFERASE FOSB)		 1lkd BIPHENYL-2,3-DIOL
1,2-DIOXYGENASE
(Paraburkholderia
xenovorans) 		5 / 12 HIS A 210
TYR A 250
GLU A 260
HIS A 146
ALA A 198
 FE2  A 500 ( 3.5A)
P6G  A 600 ( 3.7A)
FE2  A 500 ( 2.8A)
FE2  A 500 ( 3.5A)
BP6  A 300 ( 4.2A)
 0.50A 4jh3A-1lkdA:
3.8
4jh3B-1lkdA:
7.2		 4jh3A-1lkdA:
17.85
4jh3B-1lkdA:
17.85
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.
4JH3_B_FCNB203_1
(METALLOTHIOL
TRANSFERASE FOSB)		 1lkd BIPHENYL-2,3-DIOL
1,2-DIOXYGENASE
(Paraburkholderia
xenovorans) 		5 / 11 HIS A 146
ALA A 198
HIS A 210
TYR A 250
GLU A 260
 FE2  A 500 ( 3.5A)
BP6  A 300 ( 4.2A)
FE2  A 500 ( 3.5A)
P6G  A 600 ( 3.7A)
FE2  A 500 ( 2.8A)
 0.48A 4jh3A-1lkdA:
3.8
4jh3B-1lkdA:
7.2		 4jh3A-1lkdA:
17.85
4jh3B-1lkdA:
17.85
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.
4JH4_A_FCNA202_1
(METALLOTHIOL
TRANSFERASE FOSB)		 1lkd BIPHENYL-2,3-DIOL
1,2-DIOXYGENASE
(Paraburkholderia
xenovorans) 		5 / 11 HIS A 210
TYR A 250
GLU A 260
HIS A 146
ALA A 198
 FE2  A 500 ( 3.5A)
P6G  A 600 ( 3.7A)
FE2  A 500 ( 2.8A)
FE2  A 500 ( 3.5A)
BP6  A 300 ( 4.2A)
 0.43A 4jh4A-1lkdA:
7.1
4jh4B-1lkdA:
7.0		 4jh4A-1lkdA:
17.85
4jh4B-1lkdA:
17.85
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.
4JH4_B_FCNB202_1
(METALLOTHIOL
TRANSFERASE FOSB)		 1lkd BIPHENYL-2,3-DIOL
1,2-DIOXYGENASE
(Paraburkholderia
xenovorans) 		5 / 11 HIS A 146
ALA A 198
HIS A 210
TYR A 250
GLU A 260
 FE2  A 500 ( 3.5A)
BP6  A 300 ( 4.2A)
FE2  A 500 ( 3.5A)
P6G  A 600 ( 3.7A)
FE2  A 500 ( 2.8A)
 0.44A 4jh4A-1lkdA:
7.1
4jh4B-1lkdA:
7.0		 4jh4A-1lkdA:
17.85
4jh4B-1lkdA:
17.85
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.
4JH5_A_FCNA202_1
(METALLOTHIOL
TRANSFERASE FOSB)		 1lkd BIPHENYL-2,3-DIOL
1,2-DIOXYGENASE
(Paraburkholderia
xenovorans) 		5 / 11 HIS A 210
TYR A 250
GLU A 260
HIS A 146
ALA A 198
 FE2  A 500 ( 3.5A)
P6G  A 600 ( 3.7A)
FE2  A 500 ( 2.8A)
FE2  A 500 ( 3.5A)
BP6  A 300 ( 4.2A)
 0.47A 4jh5A-1lkdA:
7.1
4jh5B-1lkdA:
6.2		 4jh5A-1lkdA:
17.85
4jh5B-1lkdA:
17.85
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.
4JH5_B_FCNB203_1
(METALLOTHIOL
TRANSFERASE FOSB)		 1lkd BIPHENYL-2,3-DIOL
1,2-DIOXYGENASE
(Paraburkholderia
xenovorans) 		5 / 11 HIS A 146
ALA A 198
HIS A 210
TYR A 250
GLU A 260
 FE2  A 500 ( 3.5A)
BP6  A 300 ( 4.2A)
FE2  A 500 ( 3.5A)
P6G  A 600 ( 3.7A)
FE2  A 500 ( 2.8A)
 0.48A 4jh5A-1lkdA:
7.1
4jh5B-1lkdA:
6.2		 4jh5A-1lkdA:
17.85
4jh5B-1lkdA:
17.85
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.
4JH6_A_FCNA202_1
(METALLOTHIOL
TRANSFERASE FOSB)		 1lkd BIPHENYL-2,3-DIOL
1,2-DIOXYGENASE
(Paraburkholderia
xenovorans) 		5 / 10 HIS A 210
TYR A 250
GLU A 260
HIS A 146
ALA A 198
 FE2  A 500 ( 3.5A)
P6G  A 600 ( 3.7A)
FE2  A 500 ( 2.8A)
FE2  A 500 ( 3.5A)
BP6  A 300 ( 4.2A)
 0.49A 4jh6A-1lkdA:
7.1
4jh6B-1lkdA:
6.6		 4jh6A-1lkdA:
17.85
4jh6B-1lkdA:
17.85
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.
4JH6_B_FCNB202_1
(METALLOTHIOL
TRANSFERASE FOSB)		 1lkd BIPHENYL-2,3-DIOL
1,2-DIOXYGENASE
(Paraburkholderia
xenovorans) 		5 / 10 HIS A 146
ALA A 198
HIS A 210
TYR A 250
GLU A 260
 FE2  A 500 ( 3.5A)
BP6  A 300 ( 4.2A)
FE2  A 500 ( 3.5A)
P6G  A 600 ( 3.7A)
FE2  A 500 ( 2.8A)
 0.50A 4jh6A-1lkdA:
7.1
4jh6B-1lkdA:
6.6		 4jh6A-1lkdA:
17.85
4jh6B-1lkdA:
17.85
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.
4JH8_A_FCNA204_1
(METALLOTHIOL
TRANSFERASE FOSB)		 1lkd BIPHENYL-2,3-DIOL
1,2-DIOXYGENASE
(Paraburkholderia
xenovorans) 		5 / 10 HIS A 210
TYR A 250
GLU A 260
HIS A 146
ALA A 198
 FE2  A 500 ( 3.5A)
P6G  A 600 ( 3.7A)
FE2  A 500 ( 2.8A)
FE2  A 500 ( 3.5A)
BP6  A 300 ( 4.2A)
 0.48A 4jh8A-1lkdA:
7.1
4jh8B-1lkdA:
6.6		 4jh8A-1lkdA:
17.85
4jh8B-1lkdA:
17.85
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.
4JH8_B_FCNB203_1
(METALLOTHIOL
TRANSFERASE FOSB)		 1lkd BIPHENYL-2,3-DIOL
1,2-DIOXYGENASE
(Paraburkholderia
xenovorans) 		5 / 10 HIS A 146
ALA A 198
HIS A 210
TYR A 250
GLU A 260
 FE2  A 500 ( 3.5A)
BP6  A 300 ( 4.2A)
FE2  A 500 ( 3.5A)
P6G  A 600 ( 3.7A)
FE2  A 500 ( 2.8A)
 0.48A 4jh8A-1lkdA:
7.1
4jh8B-1lkdA:
6.6		 4jh8A-1lkdA:
17.85
4jh8B-1lkdA:
17.85
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.
4JX1_E_CAME502_0
(CAMPHOR
5-MONOOXYGENASE)		 2inc TOLUENE, O-XYLENE
MONOOXYGENASE
OXYGENASE SUBUNIT
(Pseudomonas
stutzeri) 		4 / 5 PHE A 269
THR A 198
PHE A 196
ILE A 298
 None
None
P6G  A 503 (-4.7A)
None
 1.14A 4jx1E-2incA:
undetectable		 4jx1E-2incA:
22.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4L9Q_B_9TPB601_1
(SERUM ALBUMIN)		 2qib TETR-FAMILY
TRANSCRIPTIONAL
REGULATOR
(Streptomyces
coelicolor) 		5 / 12 LEU A  88
ALA A 191
ILE A 157
LEU A 140
LEU A 137
 P6G  A 703 (-4.0A)
None
P6G  A 701 ( 4.8A)
None
None
 1.14A 4l9qB-2qibA:
4.4		 4l9qB-2qibA:
16.58
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.
4LNW_A_T3A502_1
(THYROID HORMONE
RECEPTOR ALPHA)		 3om5 LEVANSUCRASE
(Bacillus
megaterium) 		4 / 8 SER A 422
ASP A  95
GLU A 352
THR A 441
 None
P6G  A 485 ( 4.4A)
P6G  A 485 (-3.2A)
None
 1.10A 4lnwA-3om5A:
undetectable		 4lnwA-3om5A:
21.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4MA8_C_Z80C301_1
(MAJOR PRION PROTEIN)		 4h16 SHORT CHAIN ALCOHOL
DEHYDROGENASE-RELATE
D DEHYDROGENASE
(Sinorhizobium
meliloti) 		4 / 5 LEU A 215
GLY A 216
ILE A 138
GLN A 139
 None
None
None
P6G  A 305 (-3.9A)
 1.12A 4ma8C-4h16A:
undetectable		 4ma8C-4h16A:
18.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4MX0_A_BCZA513_0
(NEURAMINIDASE)		 3om5 LEVANSUCRASE
(Bacillus
megaterium) 		5 / 12 LEU A 118
ALA A 252
GLU A 350
GLU A 352
TYR A 421
 P6G  A 485 ( 4.9A)
None
None
P6G  A 485 (-3.2A)
P6G  A 485 (-4.1A)
 1.45A 4mx0A-3om5A:
10.5		 4mx0A-3om5A:
23.21
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.
4PEV_C_ADNC501_1
(MEMBRANE LIPOPROTEIN
FAMILY PROTEIN)		 4xx6 BETA-XYLANASE
(Gloeophyllum
trabeum) 		5 / 12 ASN A  70
LEU A 327
PHE A 328
PHE A  43
GLY A  44
 P6G  A 426 (-4.0A)
None
None
None
None
 1.35A 4pevC-4xx6A:
undetectable		 4pevC-4xx6A:
21.19
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.
4PGH_B_SAMB401_0
(CAFFEIC ACID
O-METHYLTRANSFERASE)		 4uir OLEATE HYDRATASE
(Elizabethkingia
meningoseptica) 		5 / 12 SER A 160
ASP A 254
GLY A 251
ASP A 250
ASP A 124
 None
NA  A1648 ( 3.8A)
NA  A1648 ( 4.6A)
None
P6G  A1649 ( 4.2A)
 1.06A 4pghB-4uirA:
2.5		 4pghB-4uirA:
19.97
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.
4RP8_C_ASCC501_1
(ASCORBATE-SPECIFIC
PERMEASE IIC
COMPONENT ULAA)		 1lkd BIPHENYL-2,3-DIOL
1,2-DIOXYGENASE
(Paraburkholderia
xenovorans) 		3 / 3 SER A 248
TYR A 250
ASP A 244
 None
P6G  A 600 ( 3.7A)
BP6  A 300 ( 4.4A)
 0.83A 4rp8C-1lkdA:
0.0		 4rp8C-1lkdA:
20.47
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.
4RP9_A_ASCA501_0
(ASCORBATE-SPECIFIC
PERMEASE IIC
COMPONENT ULAA)		 2inc TOLUENE, O-XYLENE
MONOOXYGENASE
OXYGENASE SUBUNIT
(Pseudomonas
stutzeri) 		5 / 12 THR A 273
HIS A  96
GLN A 204
ALA A 212
ILE A 276
 P6G  A 503 (-3.3A)
P6G  A 503 (-4.5A)
P6G  A 503 (-3.1A)
None
P6G  A 503 (-4.2A)
 1.43A 4rp9A-2incA:
0.0		 4rp9A-2incA:
22.08
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4U14_A_0HKA2000_1
(MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M3,ENDOLYSIN,MUSCARI
NIC ACETYLCHOLINE
RECEPTOR M3)		 5dsg MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M4,ENDOLYSIN,ENDOLYS
IN,MUSCARINIC
ACETYLCHOLINE
RECEPTOR M4
(Escherichia
virus
T4;
Homo
sapiens) 		11 / 12 ILE A  81
ASP A 112
TYR A 113
SER A 116
THR A 196
ALA A 200
ALA A 203
TRP A 413
ASN A 417
TYR A 439
CYH A 442
 None
0HK  A1201 (-4.0A)
0HK  A1201 ( 3.2A)
0HK  A1201 (-3.3A)
P6G  A1205 (-4.6A)
0HK  A1201 ( 4.2A)
0HK  A1201 (-3.6A)
0HK  A1201 (-4.3A)
0HK  A1201 (-2.8A)
0HK  A1201 (-3.6A)
0HK  A1201 (-3.6A)
 0.71A 4u14A-5dsgA:
41.2		 4u14A-5dsgA:
67.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4U14_A_0HKA2000_1
(MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M3,ENDOLYSIN,MUSCARI
NIC ACETYLCHOLINE
RECEPTOR M3)		 5dsg MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M4,ENDOLYSIN,ENDOLYS
IN,MUSCARINIC
ACETYLCHOLINE
RECEPTOR M4
(Escherichia
virus
T4;
Homo
sapiens) 		11 / 12 ILE A  81
ASP A 112
TYR A 113
TRP A 164
THR A 196
ALA A 200
ALA A 203
TRP A 413
ASN A 417
TYR A 439
CYH A 442
 None
0HK  A1201 (-4.0A)
0HK  A1201 ( 3.2A)
OLC  A1208 ( 4.0A)
P6G  A1205 (-4.6A)
0HK  A1201 ( 4.2A)
0HK  A1201 (-3.6A)
0HK  A1201 (-4.3A)
0HK  A1201 (-2.8A)
0HK  A1201 (-3.6A)
0HK  A1201 (-3.6A)
 0.64A 4u14A-5dsgA:
41.2		 4u14A-5dsgA:
67.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4U14_A_0HKA2000_2
(MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M3,ENDOLYSIN,MUSCARI
NIC ACETYLCHOLINE
RECEPTOR M3)		 5dsg MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M4,ENDOLYSIN,ENDOLYS
IN,MUSCARINIC
ACETYLCHOLINE
RECEPTOR M4
(Escherichia
virus
T4;
Homo
sapiens) 		4 / 4 ASN A 117
LEU A 190
PHE A 204
TYR A 416
 OLC  A1208 ( 3.6A)
P6G  A1205 (-4.6A)
None
0HK  A1201 (-4.2A)
 0.31A 4u14A-5dsgA:
41.2		 4u14A-5dsgA:
67.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4U15_A_0HKA2001_1
(MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M3,LYSOZYME,MUSCARIN
IC ACETYLCHOLINE
RECEPTOR M3)		 5dsg MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M4,ENDOLYSIN,ENDOLYS
IN,MUSCARINIC
ACETYLCHOLINE
RECEPTOR M4
(Escherichia
virus
T4;
Homo
sapiens) 		12 / 12 ASP A 112
TYR A 113
SER A 116
TRP A 164
THR A 196
THR A 199
ALA A 200
ALA A 203
TRP A 413
ASN A 417
TYR A 439
CYH A 442
 0HK  A1201 (-4.0A)
0HK  A1201 ( 3.2A)
0HK  A1201 (-3.3A)
OLC  A1208 ( 4.0A)
P6G  A1205 (-4.6A)
OLC  A1208 (-4.4A)
0HK  A1201 ( 4.2A)
0HK  A1201 (-3.6A)
0HK  A1201 (-4.3A)
0HK  A1201 (-2.8A)
0HK  A1201 (-3.6A)
0HK  A1201 (-3.6A)
 0.44A 4u15A-5dsgA:
43.6		 4u15A-5dsgA:
75.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4U15_A_0HKA2001_1
(MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M3,LYSOZYME,MUSCARIN
IC ACETYLCHOLINE
RECEPTOR M3)		 5dsg MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M4,ENDOLYSIN,ENDOLYS
IN,MUSCARINIC
ACETYLCHOLINE
RECEPTOR M4
(Escherichia
virus
T4;
Homo
sapiens) 		7 / 12 ASP A 112
TYR A 113
THR A 196
TRP A 413
ASN A 417
TYR A 439
CYH A 442
 0HK  A1201 (-4.0A)
0HK  A1201 ( 3.2A)
P6G  A1205 (-4.6A)
0HK  A1201 (-4.3A)
0HK  A1201 (-2.8A)
0HK  A1201 (-3.6A)
0HK  A1201 (-3.6A)
 1.43A 4u15A-5dsgA:
43.6		 4u15A-5dsgA:
75.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4U15_A_0HKA2001_1
(MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M3,LYSOZYME,MUSCARIN
IC ACETYLCHOLINE
RECEPTOR M3)		 5dsg MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M4,ENDOLYSIN,ENDOLYS
IN,MUSCARINIC
ACETYLCHOLINE
RECEPTOR M4
(Escherichia
virus
T4;
Homo
sapiens) 		5 / 12 TYR A 113
THR A 196
ALA A 200
TYR A 439
CYH A 442
 0HK  A1201 ( 3.2A)
P6G  A1205 (-4.6A)
0HK  A1201 ( 4.2A)
0HK  A1201 (-3.6A)
0HK  A1201 (-3.6A)
 1.25A 4u15A-5dsgA:
43.6		 4u15A-5dsgA:
75.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4U15_B_0HKB1201_1
(MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M3,LYSOZYME,MUSCARIN
IC ACETYLCHOLINE
RECEPTOR M3)		 5dsg MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M4,ENDOLYSIN,ENDOLYS
IN,MUSCARINIC
ACETYLCHOLINE
RECEPTOR M4
(Escherichia
virus
T4;
Homo
sapiens) 		12 / 12 ASP A 112
TYR A 113
SER A 116
THR A 196
THR A 199
ALA A 200
ALA A 203
TRP A 413
TYR A 416
ASN A 417
TYR A 439
CYH A 442
 0HK  A1201 (-4.0A)
0HK  A1201 ( 3.2A)
0HK  A1201 (-3.3A)
P6G  A1205 (-4.6A)
OLC  A1208 (-4.4A)
0HK  A1201 ( 4.2A)
0HK  A1201 (-3.6A)
0HK  A1201 (-4.3A)
0HK  A1201 (-4.2A)
0HK  A1201 (-2.8A)
0HK  A1201 (-3.6A)
0HK  A1201 (-3.6A)
 0.48A 4u15B-5dsgA:
44.9		 4u15B-5dsgA:
75.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4U15_B_0HKB1201_1
(MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M3,LYSOZYME,MUSCARIN
IC ACETYLCHOLINE
RECEPTOR M3)		 5dsg MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M4,ENDOLYSIN,ENDOLYS
IN,MUSCARINIC
ACETYLCHOLINE
RECEPTOR M4
(Escherichia
virus
T4;
Homo
sapiens) 		5 / 12 TYR A 113
THR A 196
ALA A 200
TYR A 439
CYH A 442
 0HK  A1201 ( 3.2A)
P6G  A1205 (-4.6A)
0HK  A1201 ( 4.2A)
0HK  A1201 (-3.6A)
0HK  A1201 (-3.6A)
 1.27A 4u15B-5dsgA:
44.9		 4u15B-5dsgA:
75.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4U15_B_0HKB1201_2
(MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M3,LYSOZYME,MUSCARIN
IC ACETYLCHOLINE
RECEPTOR M3)		 5dsg MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M4,ENDOLYSIN,ENDOLYS
IN,MUSCARINIC
ACETYLCHOLINE
RECEPTOR M4
(Escherichia
virus
T4;
Homo
sapiens) 		4 / 4 ASN A 117
TRP A 164
LEU A 190
PHE A 204
 OLC  A1208 ( 3.6A)
OLC  A1208 ( 4.0A)
P6G  A1205 (-4.6A)
None
 0.29A 4u15B-5dsgA:
44.9		 4u15B-5dsgA:
75.41
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.
4Z4D_A_IPHA902_0
(PROTEIN ARGONAUTE-2)		 4w7s PRE-MRNA-SPLICING
ATP-DEPENDENT RNA
HELICASE PRP28
(Saccharomyces
cerevisiae) 		4 / 6 ARG A 202
ILE A 205
GLN A 201
ILE A 160
 P6G  A 604 (-3.6A)
None
None
None
 1.17A 4z4dA-4w7sA:
undetectable		 4z4dA-4w7sA:
20.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ZBQ_A_DIFA602_1
(SERUM ALBUMIN)		 3o9t NONSTRUCTURAL
PROTEIN 1
(Influenza
A
virus) 		4 / 8 ASP A 173
ASN A 176
ALA A 177
VAL A 180
 None
None
None
P6G  A5928 (-4.2A)
 0.71A 4zbqA-3o9tA:
undetectable		 4zbqA-3o9tA:
13.91
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.
4ZGF_A_BEZA210_0
(UNCHARACTERIZED
PROTEIN)		 3tdg PUTATIVE
UNCHARACTERIZED
PROTEIN
(Helicobacter
pylori) 		4 / 4 VAL A 101
ALA A 105
ASN A 108
GLN A 109
 None
None
P6G  A 401 ( 4.0A)
None
 1.35A 4zgfA-3tdgA:
undetectable		 4zgfA-3tdgA:
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.
5B6I_B_ADNB302_1
(FLUORINASE)		 4zgf UNCHARACTERIZED
PROTEIN
(Bacteroides
vulgatus) 		4 / 6 ASP A  86
TRP A 102
THR A  88
THR A  82
 P6G  A 207 ( 4.8A)
None
P6G  A 207 (-4.0A)
P6G  A 205 ( 4.9A)
 1.47A 5b6iB-4zgfA:
undetectable		 5b6iB-4zgfA:
18.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5CXV_A_0HKA501_2
(MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M1,ENDOLYSIN,MUSCARI
NIC ACETYLCHOLINE
RECEPTOR M1)		 5dsg MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M4,ENDOLYSIN,ENDOLYS
IN,MUSCARINIC
ACETYLCHOLINE
RECEPTOR M4
(Escherichia
virus
T4;
Homo
sapiens) 		3 / 3 THR A 196
THR A 199
PHE A 204
 P6G  A1205 (-4.6A)
OLC  A1208 (-4.4A)
None
 0.42A 5cxvA-5dsgA:
42.1		 5cxvA-5dsgA:
61.24
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.
5DZK_P_BEZP801_0
(ATP-DEPENDENT CLP
PROTEASE PROTEOLYTIC
SUBUNIT 2
BEZ-LEU-LEU)		 2inc TOLUENE, O-XYLENE
MONOOXYGENASE
OXYGENASE SUBUNIT
TOLUENE, O-XYLENE
MONOOXYGENASE
OXYGENASE SUBUNIT
(Pseudomonas
stutzeri;
Pseudomonas
stutzeri) 		4 / 5 SER A 108
ALA A 107
HIS B 143
MET A 181
 None
P6G  A 503 ( 3.8A)
None
None
 1.45A 5dzkb-2incA:
undetectable
5dzkp-2incA:
undetectable		 5dzkb-2incA:
19.91
5dzkp-2incA:
0.65
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.
5DZK_P_BEZP801_1
(ATP-DEPENDENT CLP
PROTEASE PROTEOLYTIC
SUBUNIT 2
BEZ-LEU-LEU)		 4zgf UNCHARACTERIZED
PROTEIN
(Bacteroides
vulgatus) 		4 / 6 SER A  31
ALA A  30
HIS A 160
LEU A 145
 None
None
P6G  A 205 ( 3.9A)
None
 1.11A 5dzkB-4zgfA:
undetectable
5dzkP-4zgfA:
undetectable		 5dzkB-4zgfA:
21.89
5dzkP-4zgfA:
1.63
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.
5DZK_Q_BEZQ801_0
(ATP-DEPENDENT CLP
PROTEASE PROTEOLYTIC
SUBUNIT 2
BEZ-LEU-LEU)		 2inc TOLUENE, O-XYLENE
MONOOXYGENASE
OXYGENASE SUBUNIT
TOLUENE, O-XYLENE
MONOOXYGENASE
OXYGENASE SUBUNIT
(Pseudomonas
stutzeri;
Pseudomonas
stutzeri) 		4 / 5 SER A 108
ALA A 107
HIS B 143
MET A 181
 None
P6G  A 503 ( 3.8A)
None
None
 1.45A 5dzkc-2incA:
undetectable
5dzkq-2incA:
undetectable		 5dzkc-2incA:
19.91
5dzkq-2incA:
0.65
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.
5DZK_T_BEZT801_0
(ATP-DEPENDENT CLP
PROTEASE PROTEOLYTIC
SUBUNIT 2
BEZ-LEU-LEU)		 2inc TOLUENE, O-XYLENE
MONOOXYGENASE
OXYGENASE SUBUNIT
TOLUENE, O-XYLENE
MONOOXYGENASE
OXYGENASE SUBUNIT
(Pseudomonas
stutzeri;
Pseudomonas
stutzeri) 		4 / 5 SER A 108
ALA A 107
HIS B 143
MET A 181
 None
P6G  A 503 ( 3.8A)
None
None
 1.45A 5dzkf-2incA:
undetectable
5dzkt-2incA:
undetectable		 5dzkf-2incA:
19.91
5dzkt-2incA:
0.65
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.
5DZK_T_BEZT801_0
(ATP-DEPENDENT CLP
PROTEASE PROTEOLYTIC
SUBUNIT 2
BEZ-LEU-LEU)		 4zgf UNCHARACTERIZED
PROTEIN
(Bacteroides
vulgatus) 		4 / 5 SER A  31
ALA A  30
HIS A 160
LEU A 145
 None
None
P6G  A 205 ( 3.9A)
None
 1.40A 5dzkf-4zgfA:
undetectable
5dzkt-4zgfA:
undetectable		 5dzkf-4zgfA:
21.89
5dzkt-4zgfA:
1.63
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.
5FLC_C_RAPC999_1
(SERINE/THREONINE-PRO
TEIN KINASE MTOR
FKBP)		 4zgf UNCHARACTERIZED
PROTEIN
(Bacteroides
vulgatus) 		4 / 8 GLU A  27
GLY A  32
THR A  88
TRP A 102
 None
P6G  A 205 (-3.3A)
P6G  A 207 (-4.0A)
None
 0.90A 5flcB-4zgfA:
undetectable		 5flcB-4zgfA:
8.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5FLC_G_RAPG999_1
(SERINE/THREONINE-PRO
TEIN KINASE MTOR
FKBP)		 4zgf UNCHARACTERIZED
PROTEIN
(Bacteroides
vulgatus) 		4 / 8 GLU A  27
GLY A  32
THR A  88
TRP A 102
 None
P6G  A 205 (-3.3A)
P6G  A 207 (-4.0A)
None
 0.91A 5flcF-4zgfA:
undetectable		 5flcF-4zgfA:
8.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HW8_A_FK5A201_1
(FK506-BINDING
PROTEIN 1)		 5dsg MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M4,ENDOLYSIN,ENDOLYS
IN,MUSCARINIC
ACETYLCHOLINE
RECEPTOR M4
(Escherichia
virus
T4;
Homo
sapiens) 		5 / 11 VAL A 104
TRP A  98
ILE A 187
ILE A  80
ILE A  81
 OLA  A1209 (-4.8A)
None
P6G  A1205 (-4.2A)
None
None
 1.05A 5hw8A-5dsgA:
undetectable
5hw8D-5dsgA:
undetectable		 5hw8A-5dsgA:
15.13
5hw8D-5dsgA:
15.13
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.
5JH7_B_6K9B503_1
(TUBULIN ALPHA-1B
CHAIN
TUBULIN BETA-2B
CHAIN)		 4are COLLAGENASE G
(Hathewaya
histolytica) 		4 / 7 VAL A 378
GLU A 381
ASN A 287
ILE A 290
 None
None
P6G  A1791 ( 4.3A)
None
 1.19A 5jh7C-4areA:
undetectable		 5jh7C-4areA:
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.
5JLC_A_1YNA602_2
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 3fdj DEGV FAMILY PROTEIN
([Eubacterium]
eligens) 		4 / 5 GLY A 116
THR A 115
GLY A 133
LEU A   3
 None
P6G  A 276 ( 3.7A)
None
None
 0.80A 5jlcA-3fdjA:
undetectable		 5jlcA-3fdjA:
20.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5L2T_A_6ZZA900_2
(CYCLIN-DEPENDENT
KINASE 6)		 4kpt GLUTAMINE ABC
TRANSPORTER PERMEASE
AND SUBSTRATE
BINDING PROTEIN
PROTEIN
(Lactococcus
lactis) 		3 / 3 LYS A 246
GLN A  44
ASN A  45
 None
P6G  A 305 (-3.5A)
None
 0.86A 5l2tA-4kptA:
undetectable		 5l2tA-4kptA:
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.
5L5F_Y_BO2Y301_1
(PROTEASOME SUBUNIT
BETA
TYPE-8,PROTEASOME
SUBUNIT BETA TYPE-5
PROTEASOME SUBUNIT
BETA
TYPE-6,PROTEASOME
SUBUNIT BETA
TYPE-1,PROTEASOME
SUBUNIT BETA
TYPE-6,PROTEASOME
SUBUNIT BETA
TYPE-1,PROTEASOME
SUBUNIT BETA TYPE-6)		 1lkd BIPHENYL-2,3-DIOL
1,2-DIOXYGENASE
(Paraburkholderia
xenovorans) 		4 / 8 SER A 287
SER A 236
MET A 175
SER A 281
 None
P6G  A 600 ( 4.0A)
P6G  A 600 (-4.4A)
BP6  A 300 ( 4.3A)
 1.12A 5l5fY-1lkdA:
0.0
5l5fZ-1lkdA:
undetectable		 5l5fY-1lkdA:
22.01
5l5fZ-1lkdA:
21.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5MUO_D_PFLD402_1
(PROTON-GATED ION
CHANNEL)		 5cxp POSSIBLE XYLAN
DEGRADATION ENZYME
(GLYCOSYL HYDROLASE
FAMILY 30-LIKE
DOMAIN AND RICIN
B-LIKE DOMAIN)
(Clostridium
acetobutylicum) 		5 / 9 THR A 280
THR A  37
ILE A 265
THR A  33
SER A  31
 CL  A 617 (-4.8A)
None
None
P6G  A 624 (-3.2A)
P6G  A 624 (-3.4A)
 0.96A 5muoA-5cxpA:
undetectable
5muoB-5cxpA:
undetectable
5muoC-5cxpA:
undetectable
5muoD-5cxpA:
undetectable
5muoE-5cxpA:
undetectable		 5muoA-5cxpA:
12.98
5muoB-5cxpA:
12.98
5muoC-5cxpA:
12.98
5muoD-5cxpA:
12.98
5muoE-5cxpA:
12.98
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.
5N0S_A_SAMA501_0
(PEPTIDE
N-METHYLTRANSFERASE)		 5c1m MU-TYPE OPIOID
RECEPTOR
(Mus
musculus) 		5 / 12 GLY A 253
VAL A 282
VAL A 286
ILE A 167
VAL A 163
 None
None
None
None
P6G  A 406 ( 4.7A)
 1.02A 5n0sA-5c1mA:
undetectable		 5n0sA-5c1mA:
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.
5N0T_A_SAMA501_0
(PEPTIDE
N-METHYLTRANSFERASE)		 5c1m MU-TYPE OPIOID
RECEPTOR
(Mus
musculus) 		5 / 12 GLY A 253
VAL A 282
VAL A 286
ILE A 167
VAL A 163
 None
None
None
None
P6G  A 406 ( 4.7A)
 1.06A 5n0tA-5c1mA:
undetectable		 5n0tA-5c1mA:
20.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5N0W_B_SAMB501_0
(PEPTIDE
N-METHYLTRANSFERASE)		 5c1m MU-TYPE OPIOID
RECEPTOR
(Mus
musculus) 		5 / 12 GLY A 253
VAL A 282
VAL A 286
ILE A 167
VAL A 163
 None
None
None
None
P6G  A 406 ( 4.7A)
 0.99A 5n0wB-5c1mA:
undetectable		 5n0wB-5c1mA:
20.92
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.
5N4I_A_SAMA501_0
(PEPTIDE
N-METHYLTRANSFERASE)		 5c1m MU-TYPE OPIOID
RECEPTOR
(Mus
musculus) 		5 / 12 GLY A 253
VAL A 282
VAL A 286
ILE A 167
VAL A 163
 None
None
None
None
P6G  A 406 ( 4.7A)
 0.97A 5n4iA-5c1mA:
undetectable		 5n4iA-5c1mA:
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.
5NKN_A_LOCA201_2
(NEUTROPHIL
GELATINASE-ASSOCIATE
D LIPOCALIN)		 4lms CRYPTOPHYTE
PHYCOCYANIN (ALPHA-1
CHAIN)
CRYPTOPHYTE
PHYCOCYANIN (BETA
CHAIN)
(Chroomonas
sp.) 		3 / 3 VAL B  19
LYS B  15
MET A  43
 None
None
P6G  B 204 (-3.6A)
 0.72A 5nknA-4lmsB:
undetectable		 5nknA-4lmsB:
17.96
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.
5TDZ_A_ADNA905_1
(ATP-CITRATE SYNTHASE)		 4ql0 FILAMENTOUS
HEMAGGLUTININ
TRANSPORTER PROTEIN
FHAC
(Bordetella
pertussis) 		4 / 6 THR A 279
ARG A 280
LEU A 281
ASP A 282
 None
P6G  A 609 (-2.8A)
None
PGE  A 601 ( 4.6A)
 1.07A 5tdzA-4ql0A:
undetectable		 5tdzA-4ql0A:
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.
5UAH_C_RFPC3001_1
(DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA)		 5xj1 UNCHARACTERIZED RNA
METHYLTRANSFERASE
SP_1029
(Streptococcus
pneumoniae) 		5 / 12 ARG A 127
LEU A 156
VAL A 199
LEU A 153
ARG A 135
 P6G  A 503 (-3.5A)
None
None
None
None
 1.50A 5uahC-5xj1A:
2.0		 5uahC-5xj1A:
16.88
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.
5UAN_B_REAB503_1
(RETINOIC ACID
RECEPTOR BETA)		 4mes THIAMINE TRANSPORTER
THIT
(Lactococcus
lactis) 		5 / 12 ALA A  95
LEU A 166
LEU A  45
ILE A  42
SER A  91
 None
None
None
P6G  A 220 (-3.9A)
PG4  A 207 (-4.8A)
 1.41A 5uanB-4mesA:
undetectable		 5uanB-4mesA:
17.12
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.
5UUN_B_ACTB309_0
(GLUTATHIONE
S-TRANSFERASE-LIKE
PROTEIN)		 4xx6 BETA-XYLANASE
(Gloeophyllum
trabeum) 		3 / 3 TYR A  42
ALA A 155
TYR A 154
 None
None
P6G  A 426 (-4.4A)
 0.71A 5uunB-4xx6A:
undetectable		 5uunB-4xx6A:
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.
5XPR_A_K86A1201_2
(ENDOTHELIN B
RECEPTOR,ENDOLYSIN,E
NDOTHELIN B RECEPTOR)		 4w7s PRE-MRNA-SPLICING
ATP-DEPENDENT RNA
HELICASE PRP28
(Saccharomyces
cerevisiae) 		4 / 4 ASP A 344
PRO A 383
GLU A 386
TYR A 398
 None
None
P6G  A 601 (-3.9A)
P6G  A 601 (-4.0A)
 1.19A 5xprA-4w7sA:
0.0		 5xprA-4w7sA:
22.22
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.
6BTX_A_EDTA503_0
(SOLUTE CARRIER
FAMILY 39
(IRON-REGULATED
TRANSPORTER))		 5cxp POSSIBLE XYLAN
DEGRADATION ENZYME
(GLYCOSYL HYDROLASE
FAMILY 30-LIKE
DOMAIN AND RICIN
B-LIKE DOMAIN)
(Clostridium
acetobutylicum) 		4 / 7 SER A 137
HIS A 207
GLY A 206
ARG A  48
 None
None
None
P6G  A 622 ( 4.8A)
 1.07A 6btxA-5cxpA:
undetectable		 6btxA-5cxpA:
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.
6BXL_B_SAMB401_0
(2-(3-AMINO-3-CARBOXY
PROPYL)HISTIDINE
SYNTHASE)		 3ctz XAA-PRO
AMINOPEPTIDASE 1
(Homo
sapiens) 		5 / 12 HIS A 485
VAL A 565
ARG A 535
VAL A 427
ASP A 415
 P6G  A 628 (-3.5A)
None
P6G  A 628 ( 4.3A)
None
MN  A 625 (-1.9A)
 1.32A 6bxlB-3ctzA:
undetectable		 6bxlB-3ctzA:
19.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6BZO_C_FI8C1201_2
(DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA
RNA POLYMERASE SIGMA
FACTOR SIGA)		 2h84 STEELY1
(Dictyostelium
discoideum) 		4 / 4 LEU A3030
ASP A2971
GLN A2972
VAL A2896
 P6G  A1000 ( 4.4A)
P6G  A1000 (-3.3A)
None
None
 1.43A 6bzoF-2h84A:
undetectable		 6bzoF-2h84A:
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.
6DRX_A_H8GA1201_0
(5HT2B RECEPTOR, BRIL
CHIMERA)		 5dsg MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M4,ENDOLYSIN,ENDOLYS
IN,MUSCARINIC
ACETYLCHOLINE
RECEPTOR M4
(Homo
sapiens;
Escherichia
virus
T4) 		5 / 12 TRP A 108
LEU A 109
SER A 116
ALA A 203
TRP A 413
 None
P6G  A1205 (-4.7A)
0HK  A1201 (-3.3A)
0HK  A1201 (-3.6A)
0HK  A1201 (-4.3A)
 1.22A 6drxA-5dsgA:
27.4		 6drxA-5dsgA:
29.55
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.
6EBZ_A_DAHA123_0
(RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE,
BETA SUBUNIT)		 5m0y CELLULOSOME
ANCHORING PROTEIN
COHESIN REGION
(Ruminiclostridiu
m
thermocellum) 		5 / 11 LEU A  85
GLY A  81
ILE A 128
PHE A  48
ILE A  42
 None
P6G  A 205 (-3.6A)
P6G  A 205 (-4.9A)
None
None
 0.98A 6ebzA-5m0yA:
undetectable		 6ebzA-5m0yA:
18.44
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.
6EBZ_B_DAHB123_0
(RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE,
BETA SUBUNIT)		 5m0y CELLULOSOME
ANCHORING PROTEIN
COHESIN REGION
(Ruminiclostridiu
m
thermocellum) 		5 / 11 LEU A  85
GLY A  81
ILE A 128
PHE A  48
ILE A  42
 None
P6G  A 205 (-3.6A)
P6G  A 205 (-4.9A)
None
None
 0.94A 6ebzB-5m0yA:
undetectable		 6ebzB-5m0yA:
18.44
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.
6EBZ_C_DAHC123_0
(RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE,
BETA SUBUNIT)		 5m0y CELLULOSOME
ANCHORING PROTEIN
COHESIN REGION
(Ruminiclostridiu
m
thermocellum) 		5 / 11 LEU A  85
GLY A  81
ILE A 128
PHE A  48
ILE A  42
 None
P6G  A 205 (-3.6A)
P6G  A 205 (-4.9A)
None
None
 0.96A 6ebzC-5m0yA:
undetectable		 6ebzC-5m0yA:
18.44
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.
6EBZ_D_DAHD123_0
(RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE,
BETA SUBUNIT)		 5m0y CELLULOSOME
ANCHORING PROTEIN
COHESIN REGION
(Ruminiclostridiu
m
thermocellum) 		5 / 11 LEU A  85
GLY A  81
ILE A 128
PHE A  48
ILE A  42
 None
P6G  A 205 (-3.6A)
P6G  A 205 (-4.9A)
None
None
 0.92A 6ebzD-5m0yA:
undetectable		 6ebzD-5m0yA:
18.44
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.
6FOS_A_PQNA2001_1
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A1)		 2qib TETR-FAMILY
TRANSCRIPTIONAL
REGULATOR
(Streptomyces
coelicolor) 		4 / 6 MET A 110
GLY A 105
ALA A  68
LEU A  65
 P6G  A 701 ( 4.3A)
P6G  A 701 ( 4.1A)
P6G  A 701 ( 3.9A)
P6G  A 701 (-4.4A)
 0.96A 6fosA-2qibA:
2.2		 6fosA-2qibA:
14.22
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.
6GP2_A_DAHA126_0
(RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE
BETA CHAIN)		 5m0y CELLULOSOME
ANCHORING PROTEIN
COHESIN REGION
(Ruminiclostridiu
m
thermocellum) 		5 / 11 LEU A  85
GLY A  81
ILE A 128
PHE A  48
ILE A  42
 None
P6G  A 205 (-3.6A)
P6G  A 205 (-4.9A)
None
None
 0.90A 6gp2A-5m0yA:
undetectable		 6gp2A-5m0yA:
19.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6GP2_B_DAHB126_0
(RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE
BETA CHAIN)		 5m0y CELLULOSOME
ANCHORING PROTEIN
COHESIN REGION
(Ruminiclostridiu
m
thermocellum) 		5 / 11 LEU A  85
GLY A  81
ILE A 128
PHE A  48
ILE A  42
 None
P6G  A 205 (-3.6A)
P6G  A 205 (-4.9A)
None
None
 0.85A 6gp2B-5m0yA:
undetectable		 6gp2B-5m0yA:
19.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6HQB_A_PQNA2001_0
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A1
PHOTOSYSTEM I
REACTION CENTER
SUBUNIT IX)		 5cxp POSSIBLE XYLAN
DEGRADATION ENZYME
(GLYCOSYL HYDROLASE
FAMILY 30-LIKE
DOMAIN AND RICIN
B-LIKE DOMAIN)
(Clostridium
acetobutylicum) 		5 / 10 TRP A 144
MET A 187
GLY A 206
LEU A 181
GLY A 182
 P6G  A 622 (-4.1A)
None
None
None
None
 1.45A 6hqbA-5cxpA:
undetectable
6hqbJ-5cxpA:
undetectable		 6hqbA-5cxpA:
11.54
6hqbJ-5cxpA:
9.12